data_26021 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 26021 _Entry.PDB_ID 2NCG 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 26021 _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 4 4 ASN HA H 4 4.749 4.749 4.557 0.192 26021 2 1 1 . 1 1 4 4 ASN C C 4 175.260 175.260 175.883 -0.623 26021 3 1 1 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.175 -0.344 26021 4 1 1 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.780 -0.099 26021 5 1 1 . 1 1 5 5 ALA N N 5 123.648 123.648 121.609 2.039 26021 6 1 1 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.629 -0.339 26021 7 1 1 . 1 1 5 5 ALA C C 5 178.256 178.256 178.703 -0.447 26021 8 1 1 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.789 1.292 26021 9 1 1 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.061 -0.035 26021 10 1 1 . 1 1 5 5 ALA H H 5 8.520 8.520 8.169 0.351 26021 11 1 1 . 1 1 6 6 GLY N N 6 107.044 107.044 108.875 -1.831 26021 12 1 1 . 1 1 6 6 GLY C C 6 174.961 174.961 175.489 -0.528 26021 13 1 1 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.997 -1.167 26021 14 1 1 . 1 1 6 6 GLY H H 6 8.350 8.350 8.238 0.112 26021 15 1 1 . 1 1 7 7 ALA N N 7 123.366 123.366 123.631 -0.265 26021 16 1 1 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.036 0.180 26021 17 1 1 . 1 1 7 7 ALA C C 7 179.006 179.006 179.000 0.006 26021 18 1 1 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.587 -0.884 26021 19 1 1 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.301 0.543 26021 20 1 1 . 1 1 7 7 ALA H H 7 8.078 8.078 8.310 -0.232 26021 21 1 1 . 1 1 8 8 ILE N N 8 117.376 117.376 118.238 -0.862 26021 22 1 1 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.709 0.071 26021 23 1 1 . 1 1 8 8 ILE C C 8 177.032 177.032 178.167 -1.135 26021 24 1 1 . 1 1 8 8 ILE CA C 8 63.158 63.158 63.956 -0.798 26021 25 1 1 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.069 -1.780 26021 26 1 1 . 1 1 8 8 ILE H H 8 7.943 7.943 7.285 0.658 26021 27 1 1 . 1 1 9 9 ALA N N 9 121.414 121.414 123.213 -1.799 26021 28 1 1 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.063 -0.130 26021 29 1 1 . 1 1 9 9 ALA C C 9 180.515 180.515 179.343 1.172 26021 30 1 1 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.779 0.319 26021 31 1 1 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.087 0.073 26021 32 1 1 . 1 1 9 9 ALA H H 9 8.062 8.062 7.589 0.473 26021 33 1 1 . 1 1 10 10 LYS N N 10 114.594 114.594 118.881 -4.287 26021 34 1 1 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.126 0.038 26021 35 1 1 . 1 1 10 10 LYS C C 10 178.099 178.099 177.978 0.121 26021 36 1 1 . 1 1 10 10 LYS CA C 10 57.840 57.840 57.686 0.154 26021 37 1 1 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.209 0.260 26021 38 1 1 . 1 1 10 10 LYS H H 10 7.554 7.554 8.113 -0.559 26021 39 1 1 . 1 1 11 11 LEU N N 11 119.662 119.662 118.606 1.056 26021 40 1 1 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.135 -0.057 26021 41 1 1 . 1 1 11 11 LEU C C 11 177.930 177.930 177.577 0.353 26021 42 1 1 . 1 1 11 11 LEU CA C 11 56.556 56.556 55.709 0.847 26021 43 1 1 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.636 1.452 26021 44 1 1 . 1 1 11 11 LEU H H 11 7.814 7.814 7.404 0.410 26021 45 1 1 . 1 1 12 12 ILE N N 12 117.945 117.945 121.065 -3.120 26021 46 1 1 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.856 -0.164 26021 47 1 1 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.247 1.382 26021 48 1 1 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.732 1.678 26021 49 1 1 . 1 1 12 12 ILE H H 12 7.426 7.426 7.652 -0.226 26021 50 1 1 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.268 0.135 26021 51 1 1 . 1 1 13 13 PRO C C 13 179.030 179.030 178.564 0.466 26021 52 1 1 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.184 0.060 26021 53 1 1 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.044 -0.235 26021 54 1 1 . 1 1 14 14 LYS N N 14 117.855 117.855 118.911 -1.056 26021 55 1 1 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.039 0.106 26021 56 1 1 . 1 1 14 14 LYS C C 14 178.565 178.565 178.574 -0.009 26021 57 1 1 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.300 0.133 26021 58 1 1 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.181 0.744 26021 59 1 1 . 1 1 14 14 LYS H H 14 6.685 6.685 7.522 -0.837 26021 60 1 1 . 1 1 15 15 LEU N N 15 118.008 118.008 116.487 1.521 26021 61 1 1 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.345 -0.342 26021 62 1 1 . 1 1 15 15 LEU C C 15 178.662 178.662 178.947 -0.285 26021 63 1 1 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.534 1.178 26021 64 1 1 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.287 -0.288 26021 65 1 1 . 1 1 15 15 LEU H H 15 8.148 8.148 7.621 0.527 26021 66 1 1 . 1 1 16 16 GLY N N 16 103.895 103.895 108.294 -4.399 26021 67 1 1 . 1 1 16 16 GLY C C 16 176.838 176.838 175.748 1.090 26021 68 1 1 . 1 1 16 16 GLY CA C 16 47.365 47.365 46.903 0.462 26021 69 1 1 . 1 1 16 16 GLY H H 16 8.104 8.104 7.665 0.439 26021 70 1 1 . 1 1 17 17 GLU N N 17 121.655 121.655 121.647 0.008 26021 71 1 1 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.114 0.019 26021 72 1 1 . 1 1 17 17 GLU C C 17 179.007 179.007 178.479 0.528 26021 73 1 1 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.167 -0.356 26021 74 1 1 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.489 -0.356 26021 75 1 1 . 1 1 17 17 GLU H H 17 7.817 7.817 7.743 0.074 26021 76 1 1 . 1 1 18 18 LEU N N 18 117.834 117.834 116.968 0.866 26021 77 1 1 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.438 -0.320 26021 78 1 1 . 1 1 18 18 LEU C C 18 177.658 177.658 177.762 -0.104 26021 79 1 1 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.916 1.113 26021 80 1 1 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.705 -0.035 26021 81 1 1 . 1 1 18 18 LEU H H 18 7.389 7.389 7.597 -0.208 26021 82 1 1 . 1 1 19 19 LEU N N 19 113.694 113.694 117.630 -3.936 26021 83 1 1 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.330 -0.168 26021 84 1 1 . 1 1 19 19 LEU C C 19 178.123 178.123 178.532 -0.409 26021 85 1 1 . 1 1 19 19 LEU CA C 19 55.852 55.852 56.141 -0.289 26021 86 1 1 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.496 0.724 26021 87 1 1 . 1 1 19 19 LEU H H 19 7.269 7.269 7.409 -0.140 26021 88 1 1 . 1 1 20 20 VAL N N 20 112.778 112.778 113.457 -0.679 26021 89 1 1 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.139 0.304 26021 90 1 1 . 1 1 20 20 VAL C C 20 177.021 177.021 176.760 0.261 26021 91 1 1 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.773 -1.918 26021 92 1 1 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.295 0.483 26021 93 1 1 . 1 1 20 20 VAL H H 20 7.356 7.356 7.799 -0.443 26021 94 1 1 . 1 1 21 21 GLY N N 21 108.962 108.962 107.315 1.647 26021 95 1 1 . 1 1 21 21 GLY C C 21 173.813 173.813 174.506 -0.693 26021 96 1 1 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.787 0.259 26021 97 1 1 . 1 1 21 21 GLY H H 21 7.925 7.925 8.221 -0.296 26021 98 1 1 . 1 1 22 22 GLU N N 22 120.607 120.607 122.361 -1.754 26021 99 1 1 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.668 -0.390 26021 100 1 1 . 1 1 22 22 GLU C C 22 175.869 175.869 175.707 0.162 26021 101 1 1 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.331 0.699 26021 102 1 1 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.991 -0.310 26021 103 1 1 . 1 1 22 22 GLU H H 22 8.300 8.300 8.120 0.180 26021 104 1 1 . 1 1 23 23 TYR N N 23 120.738 120.738 119.182 1.556 26021 105 1 1 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.131 -0.574 26021 106 1 1 . 1 1 23 23 TYR C C 23 175.264 175.264 174.157 1.107 26021 107 1 1 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.173 0.388 26021 108 1 1 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.127 0.119 26021 109 1 1 . 1 1 23 23 TYR H H 23 7.756 7.756 7.501 0.255 26021 110 1 1 . 1 1 24 24 LYS N N 24 122.095 122.095 121.829 0.266 26021 111 1 1 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.479 -0.296 26021 112 1 1 . 1 1 24 24 LYS C C 24 175.742 175.742 174.815 0.927 26021 113 1 1 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.499 0.619 26021 114 1 1 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.763 -0.044 26021 115 1 1 . 1 1 24 24 LYS H H 24 8.692 8.692 8.342 0.350 26021 116 1 1 . 1 1 25 25 LEU N N 25 121.123 121.123 120.049 1.074 26021 117 1 1 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.710 -0.218 26021 118 1 1 . 1 1 25 25 LEU C C 25 177.487 177.487 176.274 1.213 26021 119 1 1 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.531 0.804 26021 120 1 1 . 1 1 25 25 LEU CB C 25 43.758 43.758 45.113 -1.355 26021 121 1 1 . 1 1 25 25 LEU H H 25 8.088 8.088 7.719 0.369 26021 122 1 1 . 1 1 26 26 HIS N N 26 122.993 122.993 118.769 4.224 26021 123 1 1 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.742 -0.241 26021 124 1 1 . 1 1 26 26 HIS C C 26 176.716 176.716 176.593 0.123 26021 125 1 1 . 1 1 26 26 HIS CA C 26 57.197 57.197 54.934 2.263 26021 126 1 1 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.573 0.784 26021 127 1 1 . 1 1 26 26 HIS H H 26 8.882 8.882 8.625 0.257 26021 128 1 1 . 1 1 27 27 LYS N N 27 124.894 124.894 119.836 5.058 26021 129 1 1 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.335 -0.387 26021 130 1 1 . 1 1 27 27 LYS C C 27 178.873 178.873 178.836 0.037 26021 131 1 1 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.956 1.054 26021 132 1 1 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.670 -0.228 26021 133 1 1 . 1 1 27 27 LYS H H 27 8.699 8.699 8.464 0.235 26021 134 1 1 . 1 1 28 28 GLY N N 28 111.258 111.258 105.850 5.408 26021 135 1 1 . 1 1 28 28 GLY C C 28 176.131 176.131 175.335 0.796 26021 136 1 1 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.294 0.196 26021 137 1 1 . 1 1 28 28 GLY H H 28 9.814 9.814 8.629 1.185 26021 138 1 1 . 1 1 29 29 VAL N N 29 122.719 122.719 121.586 1.133 26021 139 1 1 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.873 0.019 26021 140 1 1 . 1 1 29 29 VAL C C 29 177.628 177.628 177.839 -0.211 26021 141 1 1 . 1 1 29 29 VAL CA C 29 65.520 65.520 64.769 0.751 26021 142 1 1 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.869 -0.126 26021 143 1 1 . 1 1 29 29 VAL H H 29 7.431 7.431 7.313 0.118 26021 144 1 1 . 1 1 30 30 LYS N N 30 119.791 119.791 119.836 -0.045 26021 145 1 1 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.745 -0.110 26021 146 1 1 . 1 1 30 30 LYS C C 30 177.666 177.666 178.422 -0.756 26021 147 1 1 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.461 1.563 26021 148 1 1 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.468 0.936 26021 149 1 1 . 1 1 30 30 LYS H H 30 8.255 8.255 7.581 0.674 26021 150 1 1 . 1 1 31 31 LYS N N 31 117.918 117.918 118.789 -0.871 26021 151 1 1 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.169 -0.053 26021 152 1 1 . 1 1 31 31 LYS C C 31 177.784 177.784 179.136 -1.352 26021 153 1 1 . 1 1 31 31 LYS CA C 31 58.703 58.703 58.830 -0.126 26021 154 1 1 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.857 -0.012 26021 155 1 1 . 1 1 31 31 LYS H H 31 7.689 7.689 7.747 -0.058 26021 156 1 1 . 1 1 32 32 ASN N N 32 116.347 116.347 116.744 -0.397 26021 157 1 1 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.811 -0.291 26021 158 1 1 . 1 1 32 32 ASN C C 32 177.764 177.764 177.108 0.656 26021 159 1 1 . 1 1 32 32 ASN CA C 32 56.315 56.315 56.049 0.266 26021 160 1 1 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.910 -0.278 26021 161 1 1 . 1 1 32 32 ASN H H 32 7.556 7.556 8.182 -0.626 26021 162 1 1 . 1 1 33 33 ILE N N 33 120.592 120.592 120.311 0.281 26021 163 1 1 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.754 -0.472 26021 164 1 1 . 1 1 33 33 ILE C C 33 177.074 177.074 177.424 -0.350 26021 165 1 1 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.282 2.607 26021 166 1 1 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.069 0.109 26021 167 1 1 . 1 1 33 33 ILE H H 33 8.236 8.236 7.797 0.439 26021 168 1 1 . 1 1 34 34 GLU N N 34 120.595 120.595 119.675 0.920 26021 169 1 1 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.884 -0.096 26021 170 1 1 . 1 1 34 34 GLU C C 34 179.739 179.739 178.845 0.894 26021 171 1 1 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.703 0.536 26021 172 1 1 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.947 0.898 26021 173 1 1 . 1 1 34 34 GLU H H 34 8.551 8.551 8.418 0.133 26021 174 1 1 . 1 1 35 35 ASP N N 35 120.600 120.600 120.822 -0.222 26021 175 1 1 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.451 -0.039 26021 176 1 1 . 1 1 35 35 ASP C C 35 178.681 178.681 178.224 0.457 26021 177 1 1 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.909 0.553 26021 178 1 1 . 1 1 35 35 ASP CB C 35 39.750 39.750 41.203 -1.453 26021 179 1 1 . 1 1 35 35 ASP H H 35 8.670 8.670 7.551 1.119 26021 180 1 1 . 1 1 36 36 LEU N N 36 123.004 123.004 120.509 2.495 26021 181 1 1 . 1 1 36 36 LEU HA H 36 4.095 4.095 3.898 0.197 26021 182 1 1 . 1 1 36 36 LEU C C 36 178.035 178.035 178.835 -0.800 26021 183 1 1 . 1 1 36 36 LEU CA C 36 58.028 58.028 58.002 0.026 26021 184 1 1 . 1 1 36 36 LEU CB C 36 41.876 41.876 41.931 -0.055 26021 185 1 1 . 1 1 36 36 LEU H H 36 8.166 8.166 7.361 0.805 26021 186 1 1 . 1 1 37 37 LEU N N 37 120.178 120.178 119.380 0.798 26021 187 1 1 . 1 1 37 37 LEU HA H 37 3.856 3.856 3.910 -0.054 26021 188 1 1 . 1 1 37 37 LEU C C 37 178.128 178.128 178.049 0.079 26021 189 1 1 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.101 0.574 26021 190 1 1 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.662 0.493 26021 191 1 1 . 1 1 37 37 LEU H H 37 8.736 8.736 8.183 0.553 26021 192 1 1 . 1 1 38 38 LYS N N 38 118.110 118.110 118.557 -0.447 26021 193 1 1 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.904 0.029 26021 194 1 1 . 1 1 38 38 LYS C C 38 179.533 179.533 178.680 0.853 26021 195 1 1 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.873 0.400 26021 196 1 1 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.158 0.119 26021 197 1 1 . 1 1 38 38 LYS H H 38 7.770 7.770 7.771 -0.001 26021 198 1 1 . 1 1 39 39 GLU N N 39 119.265 119.265 119.193 0.072 26021 199 1 1 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.159 0.143 26021 200 1 1 . 1 1 39 39 GLU C C 39 179.720 179.720 178.975 0.745 26021 201 1 1 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.350 0.408 26021 202 1 1 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.260 0.330 26021 203 1 1 . 1 1 39 39 GLU H H 39 7.709 7.709 7.556 0.153 26021 204 1 1 . 1 1 40 40 LEU N N 40 119.007 119.007 120.475 -1.468 26021 205 1 1 . 1 1 40 40 LEU HA H 40 4.050 4.050 3.897 0.153 26021 206 1 1 . 1 1 40 40 LEU C C 40 179.690 179.690 179.374 0.316 26021 207 1 1 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.897 -0.246 26021 208 1 1 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.011 0.674 26021 209 1 1 . 1 1 40 40 LEU H H 40 8.851 8.851 7.992 0.859 26021 210 1 1 . 1 1 41 41 LYS N N 41 120.500 120.500 118.674 1.826 26021 211 1 1 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.010 -0.058 26021 212 1 1 . 1 1 41 41 LYS C C 41 180.223 180.223 179.181 1.042 26021 213 1 1 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.605 1.286 26021 214 1 1 . 1 1 41 41 LYS CB C 41 32.067 32.067 31.949 0.118 26021 215 1 1 . 1 1 41 41 LYS H H 41 8.482 8.482 8.652 -0.170 26021 216 1 1 . 1 1 42 42 THR N N 42 119.555 119.555 113.234 6.321 26021 217 1 1 . 1 1 42 42 THR HA H 42 4.000 4.000 4.222 -0.222 26021 218 1 1 . 1 1 42 42 THR C C 42 176.633 176.633 176.600 0.033 26021 219 1 1 . 1 1 42 42 THR CA C 42 66.574 66.574 64.669 1.905 26021 220 1 1 . 1 1 42 42 THR CB C 42 67.924 67.924 68.467 -0.543 26021 221 1 1 . 1 1 42 42 THR H H 42 7.863 7.863 7.648 0.215 26021 222 1 1 . 1 1 43 43 MET N N 43 122.839 122.839 122.352 0.487 26021 223 1 1 . 1 1 43 43 MET HA H 43 4.022 4.022 3.988 0.034 26021 224 1 1 . 1 1 43 43 MET C C 43 177.290 177.290 178.266 -0.976 26021 225 1 1 . 1 1 43 43 MET CA C 43 59.731 59.731 60.306 -0.575 26021 226 1 1 . 1 1 43 43 MET CB C 43 33.610 33.610 32.211 1.399 26021 227 1 1 . 1 1 43 43 MET H H 43 8.714 8.714 8.705 0.009 26021 228 1 1 . 1 1 44 44 ASN N N 44 118.049 118.049 117.363 0.686 26021 229 1 1 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.267 0.107 26021 230 1 1 . 1 1 44 44 ASN C C 44 176.297 176.297 177.725 -1.428 26021 231 1 1 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.686 0.208 26021 232 1 1 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.474 0.932 26021 233 1 1 . 1 1 44 44 ASN H H 44 8.988 8.988 8.194 0.794 26021 234 1 1 . 1 1 45 45 ALA N N 45 119.260 119.260 121.708 -2.448 26021 235 1 1 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.041 0.025 26021 236 1 1 . 1 1 45 45 ALA C C 45 180.476 180.476 179.208 1.268 26021 237 1 1 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.618 0.650 26021 238 1 1 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.053 -0.365 26021 239 1 1 . 1 1 45 45 ALA H H 45 7.675 7.675 7.540 0.135 26021 240 1 1 . 1 1 46 46 ALA N N 46 121.126 121.126 121.610 -0.484 26021 241 1 1 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.109 0.007 26021 242 1 1 . 1 1 46 46 ALA C C 46 179.314 179.314 179.029 0.285 26021 243 1 1 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.101 -0.115 26021 244 1 1 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.656 -0.434 26021 245 1 1 . 1 1 46 46 ALA H H 46 7.872 7.872 7.838 0.034 26021 246 1 1 . 1 1 47 47 LEU N N 47 119.328 119.328 116.700 2.628 26021 247 1 1 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.050 0.141 26021 248 1 1 . 1 1 47 47 LEU C C 47 180.403 180.403 178.363 2.040 26021 249 1 1 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.781 0.265 26021 250 1 1 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.348 0.602 26021 251 1 1 . 1 1 47 47 LEU H H 47 8.529 8.529 7.654 0.875 26021 252 1 1 . 1 1 48 48 ILE N N 48 121.653 121.653 118.153 3.500 26021 253 1 1 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.724 -0.022 26021 254 1 1 . 1 1 48 48 ILE C C 48 178.730 178.730 177.793 0.937 26021 255 1 1 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.490 0.420 26021 256 1 1 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.629 0.283 26021 257 1 1 . 1 1 48 48 ILE H H 48 8.386 8.386 7.368 1.018 26021 258 1 1 . 1 1 49 49 LYS N N 49 119.896 119.896 118.525 1.371 26021 259 1 1 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.195 -0.152 26021 260 1 1 . 1 1 49 49 LYS C C 49 179.999 179.999 179.119 0.880 26021 261 1 1 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.061 -0.004 26021 262 1 1 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.536 -0.575 26021 263 1 1 . 1 1 49 49 LYS H H 49 7.456 7.456 7.436 0.020 26021 264 1 1 . 1 1 50 50 ILE N N 50 119.964 119.964 115.590 4.374 26021 265 1 1 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.093 -0.357 26021 266 1 1 . 1 1 50 50 ILE C C 50 177.960 177.960 177.614 0.346 26021 267 1 1 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.799 0.550 26021 268 1 1 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.603 0.529 26021 269 1 1 . 1 1 50 50 ILE H H 50 8.154 8.154 8.772 -0.618 26021 270 1 1 . 1 1 51 51 GLY N N 51 106.709 106.709 107.922 -1.213 26021 271 1 1 . 1 1 51 51 GLY C C 51 174.461 174.461 175.018 -0.557 26021 272 1 1 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.378 -0.469 26021 273 1 1 . 1 1 51 51 GLY H H 51 7.932 7.932 7.874 0.058 26021 274 1 1 . 1 1 52 52 GLU N N 52 118.736 118.736 119.310 -0.574 26021 275 1 1 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.187 0.133 26021 276 1 1 . 1 1 52 52 GLU C C 52 176.789 176.789 177.061 -0.272 26021 277 1 1 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.376 -1.102 26021 278 1 1 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.148 -0.037 26021 279 1 1 . 1 1 52 52 GLU H H 52 7.597 7.597 7.518 0.079 26021 280 1 1 . 1 1 53 53 VAL N N 53 122.982 122.982 118.699 4.283 26021 281 1 1 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.403 -0.142 26021 282 1 1 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.880 1.505 26021 283 1 1 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.886 1.936 26021 284 1 1 . 1 1 53 53 VAL H H 53 7.511 7.511 7.610 -0.099 26021 285 1 1 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.798 -0.152 26021 286 1 1 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.588 -0.010 26021 287 1 1 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.077 0.458 26021 288 1 1 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.346 -0.155 26021 289 1 1 . 1 1 55 55 PRO C C 55 178.258 178.258 176.755 1.503 26021 290 1 1 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.317 1.111 26021 291 1 1 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.993 -0.147 26021 292 1 1 . 1 1 56 56 ASP N N 56 114.117 114.117 116.388 -2.271 26021 293 1 1 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.483 0.008 26021 294 1 1 . 1 1 56 56 ASP C C 56 176.696 176.696 177.668 -0.972 26021 295 1 1 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.594 -0.456 26021 296 1 1 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.704 -0.978 26021 297 1 1 . 1 1 56 56 ASP H H 56 8.489 8.489 8.192 0.297 26021 298 1 1 . 1 1 57 57 GLN N N 57 117.641 117.641 116.351 1.290 26021 299 1 1 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.217 0.157 26021 300 1 1 . 1 1 57 57 GLN C C 57 175.765 175.765 176.882 -1.117 26021 301 1 1 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.982 -0.692 26021 302 1 1 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.346 0.300 26021 303 1 1 . 1 1 57 57 GLN H H 57 8.206 8.206 7.639 0.567 26021 304 1 1 . 1 1 58 58 LEU N N 58 122.141 122.141 121.983 0.158 26021 305 1 1 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.245 0.205 26021 306 1 1 . 1 1 58 58 LEU C C 58 176.849 176.849 176.175 0.674 26021 307 1 1 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.252 -0.257 26021 308 1 1 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.232 0.999 26021 309 1 1 . 1 1 58 58 LEU H H 58 7.152 7.152 7.673 -0.521 26021 310 1 1 . 1 1 59 59 ASP N N 59 125.643 125.643 120.301 5.342 26021 311 1 1 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.840 -0.121 26021 312 1 1 . 1 1 59 59 ASP C C 59 177.249 177.249 177.136 0.113 26021 313 1 1 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.262 0.141 26021 314 1 1 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.209 -0.977 26021 315 1 1 . 1 1 59 59 ASP H H 59 9.312 9.312 7.989 1.323 26021 316 1 1 . 1 1 60 60 SER N N 60 116.550 116.550 114.622 1.928 26021 317 1 1 . 1 1 60 60 SER HA H 60 4.124 4.124 4.230 -0.106 26021 318 1 1 . 1 1 60 60 SER C C 60 176.840 176.840 176.306 0.534 26021 319 1 1 . 1 1 60 60 SER CA C 60 61.722 61.722 61.067 0.655 26021 320 1 1 . 1 1 60 60 SER CB C 60 62.815 62.815 63.395 -0.580 26021 321 1 1 . 1 1 60 60 SER H H 60 8.647 8.647 8.437 0.210 26021 322 1 1 . 1 1 61 61 GLN N N 61 121.394 121.394 119.558 1.836 26021 323 1 1 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.299 -0.168 26021 324 1 1 . 1 1 61 61 GLN C C 61 178.629 178.629 177.648 0.981 26021 325 1 1 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.678 0.075 26021 326 1 1 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.590 -0.338 26021 327 1 1 . 1 1 61 61 GLN H H 61 8.453 8.453 8.271 0.182 26021 328 1 1 . 1 1 62 62 ASP N N 62 122.187 122.187 119.788 2.399 26021 329 1 1 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.452 0.167 26021 330 1 1 . 1 1 62 62 ASP C C 62 178.318 178.318 178.376 -0.058 26021 331 1 1 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.470 -0.008 26021 332 1 1 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.657 0.379 26021 333 1 1 . 1 1 62 62 ASP H H 62 8.311 8.311 8.475 -0.164 26021 334 1 1 . 1 1 63 63 LYS N N 63 120.325 120.325 118.533 1.792 26021 335 1 1 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.063 -0.054 26021 336 1 1 . 1 1 63 63 LYS C C 63 178.765 178.765 179.296 -0.531 26021 337 1 1 . 1 1 63 63 LYS CA C 63 59.753 59.753 59.337 0.416 26021 338 1 1 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.420 0.032 26021 339 1 1 . 1 1 63 63 LYS H H 63 7.923 7.923 7.665 0.258 26021 340 1 1 . 1 1 64 64 LEU N N 64 119.491 119.491 120.377 -0.886 26021 341 1 1 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.235 -0.009 26021 342 1 1 . 1 1 64 64 LEU C C 64 179.526 179.526 178.300 1.226 26021 343 1 1 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.946 -0.148 26021 344 1 1 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.585 0.190 26021 345 1 1 . 1 1 64 64 LEU H H 64 7.820 7.820 7.827 -0.007 26021 346 1 1 . 1 1 65 65 TRP N N 65 120.674 120.674 122.107 -1.433 26021 347 1 1 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.169 0.139 26021 348 1 1 . 1 1 65 65 TRP C C 65 177.379 177.379 177.534 -0.155 26021 349 1 1 . 1 1 65 65 TRP CA C 65 61.802 61.802 61.262 0.540 26021 350 1 1 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.745 -0.334 26021 351 1 1 . 1 1 65 65 TRP H H 65 8.196 8.196 7.939 0.257 26021 352 1 1 . 1 1 66 66 ALA N N 66 120.606 120.606 119.648 0.958 26021 353 1 1 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.473 0.236 26021 354 1 1 . 1 1 66 66 ALA C C 66 180.376 180.376 179.042 1.334 26021 355 1 1 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.582 0.982 26021 356 1 1 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.931 -0.277 26021 357 1 1 . 1 1 66 66 ALA H H 66 8.305 8.305 7.555 0.750 26021 358 1 1 . 1 1 67 67 ASP N N 67 119.175 119.175 119.260 -0.085 26021 359 1 1 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.230 0.220 26021 360 1 1 . 1 1 67 67 ASP C C 67 178.757 178.757 178.195 0.562 26021 361 1 1 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.278 0.214 26021 362 1 1 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.723 -0.569 26021 363 1 1 . 1 1 67 67 ASP H H 67 7.945 7.945 7.774 0.171 26021 364 1 1 . 1 1 68 68 GLU N N 68 122.322 122.322 118.326 3.996 26021 365 1 1 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.217 -0.202 26021 366 1 1 . 1 1 68 68 GLU C C 68 180.055 180.055 179.049 1.006 26021 367 1 1 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.157 0.953 26021 368 1 1 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.796 -0.149 26021 369 1 1 . 1 1 68 68 GLU H H 68 8.168 8.168 8.448 -0.280 26021 370 1 1 . 1 1 69 69 VAL N N 69 122.135 122.135 118.240 3.895 26021 371 1 1 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.741 -0.489 26021 372 1 1 . 1 1 69 69 VAL C C 69 177.736 177.736 177.873 -0.137 26021 373 1 1 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.107 1.432 26021 374 1 1 . 1 1 69 69 VAL CB C 69 31.242 31.242 30.953 0.289 26021 375 1 1 . 1 1 69 69 VAL H H 69 8.424 8.424 7.365 1.059 26021 376 1 1 . 1 1 70 70 ARG N N 70 121.373 121.373 119.242 2.131 26021 377 1 1 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.890 -0.198 26021 378 1 1 . 1 1 70 70 ARG C C 70 179.117 179.117 178.975 0.142 26021 379 1 1 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.327 0.838 26021 380 1 1 . 1 1 70 70 ARG CB C 70 29.654 29.654 30.011 -0.357 26021 381 1 1 . 1 1 70 70 ARG H H 70 7.916 7.916 7.674 0.242 26021 382 1 1 . 1 1 71 71 GLU N N 71 119.075 119.075 119.816 -0.741 26021 383 1 1 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.953 0.110 26021 384 1 1 . 1 1 71 71 GLU C C 71 179.119 179.119 178.821 0.298 26021 385 1 1 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.883 0.805 26021 386 1 1 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.842 0.428 26021 387 1 1 . 1 1 71 71 GLU H H 71 8.031 8.031 8.463 -0.432 26021 388 1 1 . 1 1 72 72 LEU N N 72 120.503 120.503 121.033 -0.530 26021 389 1 1 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.015 0.042 26021 390 1 1 . 1 1 72 72 LEU C C 72 178.734 178.734 178.531 0.203 26021 391 1 1 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.031 0.391 26021 392 1 1 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.706 -0.298 26021 393 1 1 . 1 1 72 72 LEU H H 72 8.175 8.175 7.575 0.600 26021 394 1 1 . 1 1 73 73 SER N N 73 115.243 115.243 115.893 -0.650 26021 395 1 1 . 1 1 73 73 SER HA H 73 3.824 3.824 3.933 -0.109 26021 396 1 1 . 1 1 73 73 SER C C 73 175.697 175.697 176.429 -0.732 26021 397 1 1 . 1 1 73 73 SER CA C 73 62.384 62.384 61.157 1.227 26021 398 1 1 . 1 1 73 73 SER CB C 73 62.093 62.093 62.791 -0.698 26021 399 1 1 . 1 1 73 73 SER H H 73 8.411 8.411 7.800 0.611 26021 400 1 1 . 1 1 74 74 TYR N N 74 121.342 121.342 120.791 0.551 26021 401 1 1 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.250 0.241 26021 402 1 1 . 1 1 74 74 TYR C C 74 178.747 178.747 177.749 0.998 26021 403 1 1 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.763 -0.328 26021 404 1 1 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.130 -0.623 26021 405 1 1 . 1 1 74 74 TYR H H 74 7.314 7.314 7.778 -0.464 26021 406 1 1 . 1 1 75 75 VAL N N 75 120.779 120.779 118.251 2.528 26021 407 1 1 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.790 0.071 26021 408 1 1 . 1 1 75 75 VAL C C 75 179.788 179.788 178.116 1.672 26021 409 1 1 . 1 1 75 75 VAL CA C 75 66.048 66.048 64.662 1.386 26021 410 1 1 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.131 0.583 26021 411 1 1 . 1 1 75 75 VAL H H 75 7.740 7.740 7.892 -0.152 26021 412 1 1 . 1 1 76 76 ILE N N 76 120.598 120.598 120.231 0.367 26021 413 1 1 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.626 0.074 26021 414 1 1 . 1 1 76 76 ILE C C 76 177.066 177.066 178.174 -1.108 26021 415 1 1 . 1 1 76 76 ILE CA C 76 65.919 65.919 65.076 0.843 26021 416 1 1 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.170 0.215 26021 417 1 1 . 1 1 76 76 ILE H H 76 8.584 8.584 7.458 1.126 26021 418 1 1 . 1 1 77 77 GLU N N 77 120.468 120.468 119.273 1.195 26021 419 1 1 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.961 -0.312 26021 420 1 1 . 1 1 77 77 GLU C C 77 177.502 177.502 178.771 -1.269 26021 421 1 1 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.538 1.324 26021 422 1 1 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.734 0.618 26021 423 1 1 . 1 1 77 77 GLU H H 77 8.445 8.445 7.941 0.504 26021 424 1 1 . 1 1 78 78 ASP N N 78 117.382 117.382 119.165 -1.783 26021 425 1 1 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.469 -0.078 26021 426 1 1 . 1 1 78 78 ASP C C 78 177.382 177.382 177.829 -0.447 26021 427 1 1 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.455 1.040 26021 428 1 1 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.584 1.351 26021 429 1 1 . 1 1 78 78 ASP H H 78 7.885 7.885 7.987 -0.102 26021 430 1 1 . 1 1 79 79 ALA N N 79 120.171 120.171 121.894 -1.723 26021 431 1 1 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.001 0.049 26021 432 1 1 . 1 1 79 79 ALA C C 79 181.193 181.193 178.873 2.320 26021 433 1 1 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.241 -0.186 26021 434 1 1 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.338 0.082 26021 435 1 1 . 1 1 79 79 ALA H H 79 7.754 7.754 7.814 -0.060 26021 436 1 1 . 1 1 80 80 VAL N N 80 119.541 119.541 112.153 7.388 26021 437 1 1 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.907 -0.230 26021 438 1 1 . 1 1 80 80 VAL C C 80 177.096 177.096 177.415 -0.319 26021 439 1 1 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.318 2.766 26021 440 1 1 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.811 -0.368 26021 441 1 1 . 1 1 80 80 VAL H H 80 8.635 8.635 7.489 1.146 26021 442 1 1 . 1 1 81 81 ASP N N 81 121.140 121.140 122.154 -1.014 26021 443 1 1 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.352 0.117 26021 444 1 1 . 1 1 81 81 ASP C C 81 179.569 179.569 177.868 1.701 26021 445 1 1 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.675 0.254 26021 446 1 1 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.745 -0.810 26021 447 1 1 . 1 1 81 81 ASP H H 81 8.575 8.575 8.097 0.478 26021 448 1 1 . 1 1 82 82 LYS N N 82 118.159 118.159 119.513 -1.354 26021 449 1 1 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.022 -0.001 26021 450 1 1 . 1 1 82 82 LYS C C 82 178.890 178.890 178.255 0.635 26021 451 1 1 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.666 0.401 26021 452 1 1 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.070 0.517 26021 453 1 1 . 1 1 82 82 LYS H H 82 8.079 8.079 7.862 0.217 26021 454 1 1 . 1 1 83 83 PHE N N 83 120.900 120.900 119.149 1.751 26021 455 1 1 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.268 0.008 26021 456 1 1 . 1 1 83 83 PHE C C 83 177.269 177.269 176.889 0.380 26021 457 1 1 . 1 1 83 83 PHE CA C 83 60.943 60.943 61.452 -0.509 26021 458 1 1 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.368 0.379 26021 459 1 1 . 1 1 83 83 PHE H H 83 8.015 8.015 7.761 0.254 26021 460 1 1 . 1 1 84 84 LEU N N 84 118.209 118.209 118.344 -0.135 26021 461 1 1 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.039 -0.097 26021 462 1 1 . 1 1 84 84 LEU C C 84 178.774 178.774 178.496 0.278 26021 463 1 1 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.054 0.116 26021 464 1 1 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.565 0.628 26021 465 1 1 . 1 1 84 84 LEU H H 84 8.338 8.338 7.549 0.789 26021 466 1 1 . 1 1 85 85 VAL N N 85 116.078 116.078 117.382 -1.304 26021 467 1 1 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.505 0.486 26021 468 1 1 . 1 1 85 85 VAL C C 85 177.252 177.252 177.478 -0.226 26021 469 1 1 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.512 -1.332 26021 470 1 1 . 1 1 85 85 VAL CB C 85 31.890 31.890 30.928 0.962 26021 471 1 1 . 1 1 85 85 VAL H H 85 7.447 7.447 8.085 -0.638 26021 472 1 1 . 1 1 86 86 ARG N N 86 120.842 120.842 117.573 3.269 26021 473 1 1 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.089 0.138 26021 474 1 1 . 1 1 86 86 ARG C C 86 177.520 177.520 179.374 -1.854 26021 475 1 1 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.410 -1.351 26021 476 1 1 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.885 0.378 26021 477 1 1 . 1 1 86 86 ARG H H 86 7.598 7.598 7.301 0.297 26021 478 1 1 . 1 1 87 87 VAL N N 87 119.293 119.293 116.672 2.621 26021 479 1 1 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.818 0.007 26021 480 1 1 . 1 1 87 87 VAL C C 87 176.121 176.121 177.238 -1.117 26021 481 1 1 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.510 -2.072 26021 482 1 1 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.799 0.973 26021 483 1 1 . 1 1 87 87 VAL H H 87 7.994 7.994 7.851 0.143 26021 484 1 1 . 1 1 88 88 HIS N N 88 120.016 120.016 117.884 2.132 26021 485 1 1 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.382 0.255 26021 486 1 1 . 1 1 88 88 HIS C C 88 175.639 175.639 176.186 -0.547 26021 487 1 1 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.409 -0.058 26021 488 1 1 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.349 -0.668 26021 489 1 1 . 1 1 88 88 HIS H H 88 7.969 7.969 7.838 0.131 26021 490 1 1 . 1 1 89 89 GLY N N 89 109.587 109.587 106.882 2.705 26021 491 1 1 . 1 1 89 89 GLY C C 89 173.730 173.730 174.535 -0.805 26021 492 1 1 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.284 -0.115 26021 493 1 1 . 1 1 89 89 GLY H H 89 8.083 8.083 8.198 -0.115 26021 494 1 1 . 1 1 90 90 VAL N N 90 118.224 118.224 122.464 -4.240 26021 495 1 1 . 1 1 90 90 VAL HA H 90 4.138 4.138 3.965 0.173 26021 496 1 1 . 1 1 90 90 VAL C C 90 176.018 176.018 175.584 0.434 26021 497 1 1 . 1 1 90 90 VAL CA C 90 62.425 62.425 62.956 -0.531 26021 498 1 1 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.564 0.052 26021 499 1 1 . 1 1 90 90 VAL H H 90 7.944 7.944 7.915 0.029 26021 500 1 1 . 1 1 91 91 GLU N N 91 124.313 124.313 123.826 0.487 26021 501 1 1 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.747 -0.141 26021 502 1 1 . 1 1 91 91 GLU CA C 91 54.176 54.176 53.088 1.088 26021 503 1 1 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.697 0.063 26021 504 1 1 . 1 1 91 91 GLU H H 91 8.423 8.423 8.247 0.176 26021 505 1 1 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.494 -0.157 26021 506 1 1 . 1 1 92 92 PRO C C 92 176.504 176.504 175.712 0.792 26021 507 1 1 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.129 0.243 26021 508 1 1 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.140 0.027 26021 509 1 1 . 1 1 93 93 ASP N N 93 120.275 120.275 121.671 -1.396 26021 510 1 1 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.732 -0.160 26021 511 1 1 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.535 0.435 26021 512 1 1 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.350 -2.836 26021 513 1 1 . 1 1 93 93 ASP H H 93 8.286 8.286 8.266 0.020 26021 514 1 1 . 1 1 94 94 ASP N N 94 121.181 121.181 125.285 -4.104 26021 515 1 1 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.399 0.166 26021 516 1 1 . 1 1 94 94 ASP C C 94 176.474 176.474 177.333 -0.859 26021 517 1 1 . 1 1 94 94 ASP CA C 94 54.373 54.373 57.360 -2.987 26021 518 1 1 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.141 0.084 26021 519 1 1 . 1 1 94 94 ASP H H 94 8.259 8.259 8.830 -0.571 26021 520 1 1 . 1 1 95 95 ASN N N 95 118.728 118.728 117.553 1.175 26021 521 1 1 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.730 -0.036 26021 522 1 1 . 1 1 95 95 ASN C C 95 176.272 176.272 177.812 -1.540 26021 523 1 1 . 1 1 95 95 ASN CA C 95 53.986 53.986 56.122 -2.136 26021 524 1 1 . 1 1 95 95 ASN CB C 95 38.729 38.729 39.079 -0.350 26021 525 1 1 . 1 1 95 95 ASN H H 95 8.474 8.474 8.241 0.233 26021 526 1 1 . 1 1 96 96 THR N N 96 113.868 113.868 115.888 -2.020 26021 527 1 1 . 1 1 96 96 THR HA H 96 4.220 4.220 3.991 0.229 26021 528 1 1 . 1 1 96 96 THR C C 96 175.107 175.107 175.953 -0.846 26021 529 1 1 . 1 1 96 96 THR CA C 96 63.200 63.200 65.293 -2.093 26021 530 1 1 . 1 1 96 96 THR CB C 96 69.475 69.475 68.504 0.971 26021 531 1 1 . 1 1 96 96 THR H H 96 8.263 8.263 8.131 0.132 26021 532 1 1 . 1 1 97 97 ASN N N 97 119.954 119.954 119.012 0.942 26021 533 1 1 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.429 0.187 26021 534 1 1 . 1 1 97 97 ASN C C 97 176.275 176.275 176.460 -0.185 26021 535 1 1 . 1 1 97 97 ASN CA C 97 53.956 53.956 55.181 -1.225 26021 536 1 1 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.781 -0.089 26021 537 1 1 . 1 1 97 97 ASN H H 97 8.431 8.431 8.174 0.257 26021 538 1 1 . 1 1 98 98 GLY N N 98 108.847 108.847 107.141 1.706 26021 539 1 1 . 1 1 98 98 GLY C C 98 175.533 175.533 175.495 0.038 26021 540 1 1 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.026 -0.015 26021 541 1 1 . 1 1 98 98 GLY H H 98 8.338 8.338 7.827 0.511 26021 542 1 1 . 1 1 99 99 PHE N N 99 118.492 118.492 120.955 -2.463 26021 543 1 1 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.048 0.200 26021 544 1 1 . 1 1 99 99 PHE CA C 99 60.959 60.959 61.657 -0.698 26021 545 1 1 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.295 -1.136 26021 546 1 1 . 1 1 99 99 PHE H H 99 8.370 8.370 7.603 0.767 26021 547 1 1 . 1 1 100 100 LYS N N 100 120.987 120.987 118.667 2.320 26021 548 1 1 . 1 1 100 100 LYS H H 100 8.256 8.256 8.653 -0.397 26021 549 1 1 . 1 1 101 101 GLY N N 101 108.186 108.186 106.940 1.246 26021 550 1 1 . 1 1 101 101 GLY C C 101 177.075 177.075 175.848 1.227 26021 551 1 1 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.563 0.339 26021 552 1 1 . 1 1 101 101 GLY H H 101 8.300 8.300 8.181 0.119 26021 553 1 1 . 1 1 102 102 LEU N N 102 121.439 121.439 122.701 -1.262 26021 554 1 1 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.033 0.064 26021 555 1 1 . 1 1 102 102 LEU C C 102 179.836 179.836 178.532 1.304 26021 556 1 1 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.245 0.113 26021 557 1 1 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.569 0.201 26021 558 1 1 . 1 1 102 102 LEU H H 102 7.777 7.777 7.246 0.531 26021 559 1 1 . 1 1 103 103 MET N N 103 122.290 122.290 118.209 4.081 26021 560 1 1 . 1 1 103 103 MET HA H 103 4.220 4.220 4.203 0.017 26021 561 1 1 . 1 1 103 103 MET C C 103 177.739 177.739 178.114 -0.375 26021 562 1 1 . 1 1 103 103 MET CA C 103 58.739 58.739 57.807 0.932 26021 563 1 1 . 1 1 103 103 MET CB C 103 31.895 31.895 32.502 -0.607 26021 564 1 1 . 1 1 103 103 MET H H 103 8.409 8.409 8.582 -0.173 26021 565 1 1 . 1 1 104 104 LYS N N 104 119.750 119.750 118.211 1.539 26021 566 1 1 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.138 -0.071 26021 567 1 1 . 1 1 104 104 LYS C C 104 179.301 179.301 179.592 -0.291 26021 568 1 1 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.575 1.189 26021 569 1 1 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.906 0.141 26021 570 1 1 . 1 1 104 104 LYS H H 104 7.916 7.916 7.663 0.253 26021 571 1 1 . 1 1 105 105 ARG N N 105 117.967 117.967 118.423 -0.456 26021 572 1 1 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.138 -0.112 26021 573 1 1 . 1 1 105 105 ARG C C 105 178.777 178.777 178.546 0.231 26021 574 1 1 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.750 -0.386 26021 575 1 1 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.314 0.683 26021 576 1 1 . 1 1 105 105 ARG H H 105 7.719 7.719 7.796 -0.077 26021 577 1 1 . 1 1 106 106 THR N N 106 117.211 117.211 112.779 4.432 26021 578 1 1 . 1 1 106 106 THR HA H 106 4.301 4.301 4.186 0.115 26021 579 1 1 . 1 1 106 106 THR C C 106 176.254 176.254 176.418 -0.164 26021 580 1 1 . 1 1 106 106 THR CA C 106 67.860 67.860 66.036 1.824 26021 581 1 1 . 1 1 106 106 THR CB C 106 67.860 67.860 68.426 -0.566 26021 582 1 1 . 1 1 106 106 THR H H 106 8.152 8.152 8.117 0.035 26021 583 1 1 . 1 1 107 107 THR N N 107 117.939 117.939 117.176 0.763 26021 584 1 1 . 1 1 107 107 THR HA H 107 3.971 3.971 3.978 -0.007 26021 585 1 1 . 1 1 107 107 THR C C 107 176.780 176.780 176.361 0.419 26021 586 1 1 . 1 1 107 107 THR CA C 107 66.822 66.822 66.580 0.242 26021 587 1 1 . 1 1 107 107 THR CB C 107 68.818 68.818 68.403 0.416 26021 588 1 1 . 1 1 107 107 THR H H 107 8.651 8.651 8.100 0.551 26021 589 1 1 . 1 1 108 108 LYS N N 108 120.867 120.867 120.799 0.068 26021 590 1 1 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.141 -0.119 26021 591 1 1 . 1 1 108 108 LYS C C 108 179.045 179.045 178.872 0.173 26021 592 1 1 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.019 0.815 26021 593 1 1 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.233 0.240 26021 594 1 1 . 1 1 108 108 LYS H H 108 7.694 7.694 7.614 0.080 26021 595 1 1 . 1 1 109 109 LEU N N 109 119.472 119.472 118.795 0.677 26021 596 1 1 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.224 0.097 26021 597 1 1 . 1 1 109 109 LEU C C 109 179.974 179.974 178.812 1.162 26021 598 1 1 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.259 0.334 26021 599 1 1 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.175 -0.315 26021 600 1 1 . 1 1 109 109 LEU H H 109 7.559 7.559 7.625 -0.066 26021 601 1 1 . 1 1 110 110 LEU N N 110 121.832 121.832 120.042 1.790 26021 602 1 1 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.103 0.088 26021 603 1 1 . 1 1 110 110 LEU C C 110 178.101 178.101 179.142 -1.041 26021 604 1 1 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.679 0.213 26021 605 1 1 . 1 1 110 110 LEU CB C 110 41.884 41.884 40.655 1.229 26021 606 1 1 . 1 1 110 110 LEU H H 110 8.567 8.567 8.705 -0.138 26021 607 1 1 . 1 1 111 111 LYS N N 111 117.972 117.972 116.702 1.270 26021 608 1 1 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.051 -0.072 26021 609 1 1 . 1 1 111 111 LYS C C 111 177.677 177.677 178.469 -0.792 26021 610 1 1 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.569 0.216 26021 611 1 1 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.920 0.289 26021 612 1 1 . 1 1 111 111 LYS H H 111 7.965 7.965 8.181 -0.216 26021 613 1 1 . 1 1 112 112 LYS N N 112 115.433 115.433 117.610 -2.177 26021 614 1 1 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.152 -0.042 26021 615 1 1 . 1 1 112 112 LYS C C 112 178.270 178.270 178.288 -0.018 26021 616 1 1 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.071 0.880 26021 617 1 1 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.680 0.111 26021 618 1 1 . 1 1 112 112 LYS H H 112 7.334 7.334 7.437 -0.103 26021 619 1 1 . 1 1 113 113 VAL N N 113 114.861 114.861 119.724 -4.863 26021 620 1 1 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.770 0.061 26021 621 1 1 . 1 1 113 113 VAL C C 113 176.999 176.999 177.865 -0.866 26021 622 1 1 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.246 -1.741 26021 623 1 1 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.390 -0.103 26021 624 1 1 . 1 1 113 113 VAL H H 113 7.298 7.298 7.608 -0.310 26021 625 1 1 . 1 1 114 114 VAL N N 114 121.457 121.457 117.991 3.466 26021 626 1 1 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.800 -0.078 26021 627 1 1 . 1 1 114 114 VAL C C 114 177.737 177.737 176.941 0.796 26021 628 1 1 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.037 -0.813 26021 629 1 1 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.160 0.593 26021 630 1 1 . 1 1 114 114 VAL H H 114 7.855 7.855 8.164 -0.309 26021 631 1 1 . 1 1 115 115 ASP N N 115 120.804 120.804 119.683 1.121 26021 632 1 1 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.488 -0.033 26021 633 1 1 . 1 1 115 115 ASP C C 115 177.380 177.380 176.934 0.446 26021 634 1 1 . 1 1 115 115 ASP CA C 115 55.921 55.921 55.877 0.044 26021 635 1 1 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.613 -0.241 26021 636 1 1 . 1 1 115 115 ASP H H 115 8.311 8.311 7.931 0.380 26021 637 1 1 . 1 1 116 116 LYS N N 116 119.582 119.582 118.080 1.502 26021 638 1 1 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.066 0.029 26021 639 1 1 . 1 1 116 116 LYS C C 116 177.077 177.077 177.919 -0.842 26021 640 1 1 . 1 1 116 116 LYS CA C 116 57.711 57.711 58.185 -0.474 26021 641 1 1 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.767 -0.279 26021 642 1 1 . 1 1 116 116 LYS H H 116 7.639 7.639 7.889 -0.250 26021 643 1 1 . 1 1 117 117 HIS N N 117 115.246 115.246 112.569 2.677 26021 644 1 1 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.795 -0.170 26021 645 1 1 . 1 1 117 117 HIS C C 117 175.497 175.497 175.722 -0.225 26021 646 1 1 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.366 -0.191 26021 647 1 1 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.112 -1.637 26021 648 1 1 . 1 1 117 117 HIS H H 117 8.108 8.108 7.691 0.417 26021 649 1 1 . 1 1 118 118 GLY N N 118 109.944 109.944 108.912 1.032 26021 650 1 1 . 1 1 118 118 GLY C C 118 174.093 174.093 174.035 0.058 26021 651 1 1 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.934 1.130 26021 652 1 1 . 1 1 118 118 GLY H H 118 8.153 8.153 7.723 0.430 26021 653 1 1 . 1 1 119 119 ILE N N 119 118.468 118.468 122.100 -3.632 26021 654 1 1 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.889 0.233 26021 655 1 1 . 1 1 119 119 ILE C C 119 174.777 174.777 176.070 -1.293 26021 656 1 1 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.468 -0.367 26021 657 1 1 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.494 2.137 26021 658 1 1 . 1 1 119 119 ILE H H 119 7.828 7.828 7.997 -0.169 26021 659 1 2 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.740 0.009 26021 660 1 2 . 1 1 4 4 ASN C C 4 175.260 175.260 176.004 -0.744 26021 661 1 2 . 1 1 4 4 ASN CA C 4 53.831 53.831 53.576 0.255 26021 662 1 2 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.941 -0.261 26021 663 1 2 . 1 1 5 5 ALA N N 5 123.648 123.648 121.720 1.928 26021 664 1 2 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.622 -0.332 26021 665 1 2 . 1 1 5 5 ALA C C 5 178.256 178.256 179.022 -0.766 26021 666 1 2 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.972 1.109 26021 667 1 2 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.345 0.680 26021 668 1 2 . 1 1 5 5 ALA H H 5 8.520 8.520 8.423 0.097 26021 669 1 2 . 1 1 6 6 GLY N N 6 107.044 107.044 108.377 -1.333 26021 670 1 2 . 1 1 6 6 GLY C C 6 174.961 174.961 175.638 -0.677 26021 671 1 2 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.729 -0.899 26021 672 1 2 . 1 1 6 6 GLY H H 6 8.350 8.350 8.495 -0.145 26021 673 1 2 . 1 1 7 7 ALA N N 7 123.366 123.366 123.145 0.221 26021 674 1 2 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.100 0.116 26021 675 1 2 . 1 1 7 7 ALA C C 7 179.006 179.006 178.608 0.398 26021 676 1 2 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.648 -0.945 26021 677 1 2 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.642 0.202 26021 678 1 2 . 1 1 7 7 ALA H H 7 8.078 8.078 7.949 0.130 26021 679 1 2 . 1 1 8 8 ILE N N 8 117.376 117.376 118.111 -0.735 26021 680 1 2 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.789 -0.009 26021 681 1 2 . 1 1 8 8 ILE C C 8 177.032 177.032 178.261 -1.229 26021 682 1 2 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.179 -1.021 26021 683 1 2 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.841 -1.552 26021 684 1 2 . 1 1 8 8 ILE H H 8 7.943 7.943 7.822 0.121 26021 685 1 2 . 1 1 9 9 ALA N N 9 121.414 121.414 122.673 -1.259 26021 686 1 2 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.073 -0.140 26021 687 1 2 . 1 1 9 9 ALA C C 9 180.515 180.515 179.206 1.309 26021 688 1 2 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.694 0.404 26021 689 1 2 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.205 -0.044 26021 690 1 2 . 1 1 9 9 ALA H H 9 8.062 8.062 8.258 -0.196 26021 691 1 2 . 1 1 10 10 LYS N N 10 114.594 114.594 119.122 -4.528 26021 692 1 2 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.157 0.007 26021 693 1 2 . 1 1 10 10 LYS C C 10 178.099 178.099 177.875 0.224 26021 694 1 2 . 1 1 10 10 LYS CA C 10 57.840 57.840 57.538 0.302 26021 695 1 2 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.081 0.388 26021 696 1 2 . 1 1 10 10 LYS H H 10 7.554 7.554 7.901 -0.347 26021 697 1 2 . 1 1 11 11 LEU N N 11 119.662 119.662 118.434 1.228 26021 698 1 2 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.186 -0.108 26021 699 1 2 . 1 1 11 11 LEU C C 11 177.930 177.930 178.013 -0.083 26021 700 1 2 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.072 0.484 26021 701 1 2 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.754 1.334 26021 702 1 2 . 1 1 11 11 LEU H H 11 7.814 7.814 7.304 0.510 26021 703 1 2 . 1 1 12 12 ILE N N 12 117.945 117.945 120.726 -2.781 26021 704 1 2 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.912 -0.220 26021 705 1 2 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.065 1.564 26021 706 1 2 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.748 1.662 26021 707 1 2 . 1 1 12 12 ILE H H 12 7.426 7.426 7.613 -0.187 26021 708 1 2 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.317 0.086 26021 709 1 2 . 1 1 13 13 PRO C C 13 179.030 179.030 178.814 0.216 26021 710 1 2 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.138 0.106 26021 711 1 2 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.028 -0.219 26021 712 1 2 . 1 1 14 14 LYS N N 14 117.855 117.855 118.634 -0.779 26021 713 1 2 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.100 0.045 26021 714 1 2 . 1 1 14 14 LYS C C 14 178.565 178.565 178.642 -0.077 26021 715 1 2 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.040 0.393 26021 716 1 2 . 1 1 14 14 LYS CB C 14 32.925 32.925 31.860 1.065 26021 717 1 2 . 1 1 14 14 LYS H H 14 6.685 6.685 7.424 -0.739 26021 718 1 2 . 1 1 15 15 LEU N N 15 118.008 118.008 116.474 1.534 26021 719 1 2 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.415 -0.412 26021 720 1 2 . 1 1 15 15 LEU C C 15 178.662 178.662 179.222 -0.560 26021 721 1 2 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.418 1.294 26021 722 1 2 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.132 -0.133 26021 723 1 2 . 1 1 15 15 LEU H H 15 8.148 8.148 7.558 0.590 26021 724 1 2 . 1 1 16 16 GLY N N 16 103.895 103.895 108.702 -4.807 26021 725 1 2 . 1 1 16 16 GLY C C 16 176.838 176.838 176.392 0.446 26021 726 1 2 . 1 1 16 16 GLY CA C 16 47.365 47.365 46.981 0.384 26021 727 1 2 . 1 1 16 16 GLY H H 16 8.104 8.104 7.746 0.358 26021 728 1 2 . 1 1 17 17 GLU N N 17 121.655 121.655 122.347 -0.692 26021 729 1 2 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.114 0.019 26021 730 1 2 . 1 1 17 17 GLU C C 17 179.007 179.007 177.998 1.009 26021 731 1 2 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.078 -0.267 26021 732 1 2 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.755 -0.622 26021 733 1 2 . 1 1 17 17 GLU H H 17 7.817 7.817 7.754 0.063 26021 734 1 2 . 1 1 18 18 LEU N N 18 117.834 117.834 117.901 -0.067 26021 735 1 2 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.468 -0.350 26021 736 1 2 . 1 1 18 18 LEU C C 18 177.658 177.658 177.709 -0.051 26021 737 1 2 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.438 1.591 26021 738 1 2 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.862 -0.192 26021 739 1 2 . 1 1 18 18 LEU H H 18 7.389 7.389 7.761 -0.372 26021 740 1 2 . 1 1 19 19 LEU N N 19 113.694 113.694 118.300 -4.606 26021 741 1 2 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.451 -0.289 26021 742 1 2 . 1 1 19 19 LEU C C 19 178.123 178.123 178.310 -0.187 26021 743 1 2 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.188 0.664 26021 744 1 2 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.831 0.389 26021 745 1 2 . 1 1 19 19 LEU H H 19 7.269 7.269 7.866 -0.597 26021 746 1 2 . 1 1 20 20 VAL N N 20 112.778 112.778 115.645 -2.867 26021 747 1 2 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.087 0.356 26021 748 1 2 . 1 1 20 20 VAL C C 20 177.021 177.021 177.168 -0.147 26021 749 1 2 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.491 -1.636 26021 750 1 2 . 1 1 20 20 VAL CB C 20 32.778 32.778 31.685 1.093 26021 751 1 2 . 1 1 20 20 VAL H H 20 7.356 7.356 7.493 -0.137 26021 752 1 2 . 1 1 21 21 GLY N N 21 108.962 108.962 109.834 -0.872 26021 753 1 2 . 1 1 21 21 GLY C C 21 173.813 173.813 173.921 -0.108 26021 754 1 2 . 1 1 21 21 GLY CA C 21 45.046 45.046 45.256 -0.210 26021 755 1 2 . 1 1 21 21 GLY H H 21 7.925 7.925 8.557 -0.632 26021 756 1 2 . 1 1 22 22 GLU N N 22 120.607 120.607 120.113 0.494 26021 757 1 2 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.423 -0.145 26021 758 1 2 . 1 1 22 22 GLU C C 22 175.869 175.869 174.970 0.899 26021 759 1 2 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.314 0.716 26021 760 1 2 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.144 -0.463 26021 761 1 2 . 1 1 22 22 GLU H H 22 8.300 8.300 8.502 -0.202 26021 762 1 2 . 1 1 23 23 TYR N N 23 120.738 120.738 121.027 -0.289 26021 763 1 2 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.429 0.128 26021 764 1 2 . 1 1 23 23 TYR C C 23 175.264 175.264 175.112 0.152 26021 765 1 2 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.253 0.308 26021 766 1 2 . 1 1 23 23 TYR CB C 23 39.246 39.246 40.509 -1.263 26021 767 1 2 . 1 1 23 23 TYR H H 23 7.756 7.756 7.787 -0.031 26021 768 1 2 . 1 1 24 24 LYS N N 24 122.095 122.095 123.130 -1.035 26021 769 1 2 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.641 -0.458 26021 770 1 2 . 1 1 24 24 LYS C C 24 175.742 175.742 175.280 0.462 26021 771 1 2 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.106 0.012 26021 772 1 2 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.978 -0.259 26021 773 1 2 . 1 1 24 24 LYS H H 24 8.692 8.692 8.648 0.044 26021 774 1 2 . 1 1 25 25 LEU N N 25 121.123 121.123 117.040 4.083 26021 775 1 2 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.772 -0.280 26021 776 1 2 . 1 1 25 25 LEU C C 25 177.487 177.487 176.071 1.416 26021 777 1 2 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.978 0.356 26021 778 1 2 . 1 1 25 25 LEU CB C 25 43.758 43.758 42.521 1.237 26021 779 1 2 . 1 1 25 25 LEU H H 25 8.088 8.088 7.432 0.656 26021 780 1 2 . 1 1 26 26 HIS N N 26 122.993 122.993 119.020 3.973 26021 781 1 2 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.561 -0.060 26021 782 1 2 . 1 1 26 26 HIS C C 26 176.716 176.716 176.581 0.135 26021 783 1 2 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.532 0.665 26021 784 1 2 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.958 0.399 26021 785 1 2 . 1 1 26 26 HIS H H 26 8.882 8.882 8.481 0.401 26021 786 1 2 . 1 1 27 27 LYS N N 27 124.894 124.894 126.474 -1.580 26021 787 1 2 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.102 -0.154 26021 788 1 2 . 1 1 27 27 LYS C C 27 178.873 178.873 178.458 0.415 26021 789 1 2 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.361 1.650 26021 790 1 2 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.265 0.177 26021 791 1 2 . 1 1 27 27 LYS H H 27 8.699 8.699 8.253 0.446 26021 792 1 2 . 1 1 28 28 GLY N N 28 111.258 111.258 107.319 3.939 26021 793 1 2 . 1 1 28 28 GLY C C 28 176.131 176.131 175.832 0.299 26021 794 1 2 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.940 -0.449 26021 795 1 2 . 1 1 28 28 GLY H H 28 9.814 9.814 8.116 1.698 26021 796 1 2 . 1 1 29 29 VAL N N 29 122.719 122.719 120.921 1.798 26021 797 1 2 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.674 0.218 26021 798 1 2 . 1 1 29 29 VAL C C 29 177.628 177.628 177.605 0.023 26021 799 1 2 . 1 1 29 29 VAL CA C 29 65.520 65.520 64.860 0.660 26021 800 1 2 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.276 0.466 26021 801 1 2 . 1 1 29 29 VAL H H 29 7.431 7.431 7.382 0.049 26021 802 1 2 . 1 1 30 30 LYS N N 30 119.791 119.791 119.077 0.714 26021 803 1 2 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.978 -0.343 26021 804 1 2 . 1 1 30 30 LYS C C 30 177.666 177.666 178.541 -0.875 26021 805 1 2 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.642 1.382 26021 806 1 2 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.995 0.410 26021 807 1 2 . 1 1 30 30 LYS H H 30 8.255 8.255 8.125 0.130 26021 808 1 2 . 1 1 31 31 LYS N N 31 117.918 117.918 118.206 -0.288 26021 809 1 2 . 1 1 31 31 LYS HA H 31 4.116 4.116 3.908 0.208 26021 810 1 2 . 1 1 31 31 LYS C C 31 177.784 177.784 178.946 -1.162 26021 811 1 2 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.248 -0.545 26021 812 1 2 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.964 -0.119 26021 813 1 2 . 1 1 31 31 LYS H H 31 7.689 7.689 7.614 0.075 26021 814 1 2 . 1 1 32 32 ASN N N 32 116.347 116.347 116.127 0.220 26021 815 1 2 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.051 0.469 26021 816 1 2 . 1 1 32 32 ASN C C 32 177.764 177.764 176.901 0.863 26021 817 1 2 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.904 0.411 26021 818 1 2 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.326 0.306 26021 819 1 2 . 1 1 32 32 ASN H H 32 7.556 7.556 7.403 0.153 26021 820 1 2 . 1 1 33 33 ILE N N 33 120.592 120.592 119.734 0.858 26021 821 1 2 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.793 -0.511 26021 822 1 2 . 1 1 33 33 ILE C C 33 177.074 177.074 177.504 -0.430 26021 823 1 2 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.105 2.783 26021 824 1 2 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.089 0.089 26021 825 1 2 . 1 1 33 33 ILE H H 33 8.236 8.236 7.168 1.068 26021 826 1 2 . 1 1 34 34 GLU N N 34 120.595 120.595 119.814 0.781 26021 827 1 2 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.869 -0.081 26021 828 1 2 . 1 1 34 34 GLU C C 34 179.739 179.739 178.759 0.980 26021 829 1 2 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.738 0.501 26021 830 1 2 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.875 0.970 26021 831 1 2 . 1 1 34 34 GLU H H 34 8.551 8.551 8.796 -0.245 26021 832 1 2 . 1 1 35 35 ASP N N 35 120.600 120.600 120.579 0.021 26021 833 1 2 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.475 -0.063 26021 834 1 2 . 1 1 35 35 ASP C C 35 178.681 178.681 178.529 0.152 26021 835 1 2 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.791 0.671 26021 836 1 2 . 1 1 35 35 ASP CB C 35 39.750 39.750 41.083 -1.333 26021 837 1 2 . 1 1 35 35 ASP H H 35 8.670 8.670 7.698 0.972 26021 838 1 2 . 1 1 36 36 LEU N N 36 123.004 123.004 121.185 1.819 26021 839 1 2 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.464 -0.369 26021 840 1 2 . 1 1 36 36 LEU C C 36 178.035 178.035 178.876 -0.841 26021 841 1 2 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.256 0.772 26021 842 1 2 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.246 -0.370 26021 843 1 2 . 1 1 36 36 LEU H H 36 8.166 8.166 7.903 0.263 26021 844 1 2 . 1 1 37 37 LEU N N 37 120.178 120.178 120.211 -0.033 26021 845 1 2 . 1 1 37 37 LEU HA H 37 3.856 3.856 3.997 -0.141 26021 846 1 2 . 1 1 37 37 LEU C C 37 178.128 178.128 178.454 -0.326 26021 847 1 2 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.012 0.663 26021 848 1 2 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.555 0.600 26021 849 1 2 . 1 1 37 37 LEU H H 37 8.736 8.736 7.985 0.751 26021 850 1 2 . 1 1 38 38 LYS N N 38 118.110 118.110 119.425 -1.315 26021 851 1 2 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.895 0.038 26021 852 1 2 . 1 1 38 38 LYS C C 38 179.533 179.533 178.930 0.603 26021 853 1 2 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.085 0.188 26021 854 1 2 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.277 -0.000 26021 855 1 2 . 1 1 38 38 LYS H H 38 7.770 7.770 8.240 -0.470 26021 856 1 2 . 1 1 39 39 GLU N N 39 119.265 119.265 119.440 -0.175 26021 857 1 2 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.094 0.208 26021 858 1 2 . 1 1 39 39 GLU C C 39 179.720 179.720 179.060 0.660 26021 859 1 2 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.016 -0.258 26021 860 1 2 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.741 -0.151 26021 861 1 2 . 1 1 39 39 GLU H H 39 7.709 7.709 7.566 0.143 26021 862 1 2 . 1 1 40 40 LEU N N 40 119.007 119.007 120.299 -1.292 26021 863 1 2 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.108 -0.058 26021 864 1 2 . 1 1 40 40 LEU C C 40 179.690 179.690 178.949 0.741 26021 865 1 2 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.644 0.007 26021 866 1 2 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.928 0.757 26021 867 1 2 . 1 1 40 40 LEU H H 40 8.851 8.851 8.242 0.609 26021 868 1 2 . 1 1 41 41 LYS N N 41 120.500 120.500 118.334 2.166 26021 869 1 2 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.027 -0.075 26021 870 1 2 . 1 1 41 41 LYS C C 41 180.223 180.223 178.825 1.398 26021 871 1 2 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.939 0.952 26021 872 1 2 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.087 -0.020 26021 873 1 2 . 1 1 41 41 LYS H H 41 8.482 8.482 8.410 0.072 26021 874 1 2 . 1 1 42 42 THR N N 42 119.555 119.555 112.378 7.177 26021 875 1 2 . 1 1 42 42 THR HA H 42 4.000 4.000 4.138 -0.138 26021 876 1 2 . 1 1 42 42 THR C C 42 176.633 176.633 176.666 -0.033 26021 877 1 2 . 1 1 42 42 THR CA C 42 66.574 66.574 65.249 1.325 26021 878 1 2 . 1 1 42 42 THR CB C 42 67.924 67.924 68.477 -0.553 26021 879 1 2 . 1 1 42 42 THR H H 42 7.863 7.863 7.596 0.267 26021 880 1 2 . 1 1 43 43 MET N N 43 122.839 122.839 121.435 1.404 26021 881 1 2 . 1 1 43 43 MET HA H 43 4.022 4.022 3.945 0.077 26021 882 1 2 . 1 1 43 43 MET C C 43 177.290 177.290 177.951 -0.661 26021 883 1 2 . 1 1 43 43 MET CA C 43 59.731 59.731 59.858 -0.127 26021 884 1 2 . 1 1 43 43 MET CB C 43 33.610 33.610 32.242 1.368 26021 885 1 2 . 1 1 43 43 MET H H 43 8.714 8.714 7.900 0.814 26021 886 1 2 . 1 1 44 44 ASN N N 44 118.049 118.049 118.039 0.010 26021 887 1 2 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.276 0.098 26021 888 1 2 . 1 1 44 44 ASN C C 44 176.297 176.297 177.360 -1.063 26021 889 1 2 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.541 0.353 26021 890 1 2 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.891 0.515 26021 891 1 2 . 1 1 44 44 ASN H H 44 8.988 8.988 8.401 0.587 26021 892 1 2 . 1 1 45 45 ALA N N 45 119.260 119.260 121.519 -2.259 26021 893 1 2 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.186 -0.120 26021 894 1 2 . 1 1 45 45 ALA C C 45 180.476 180.476 179.165 1.311 26021 895 1 2 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.362 0.906 26021 896 1 2 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.351 -0.663 26021 897 1 2 . 1 1 45 45 ALA H H 45 7.675 7.675 7.471 0.204 26021 898 1 2 . 1 1 46 46 ALA N N 46 121.126 121.126 123.384 -2.258 26021 899 1 2 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.105 0.011 26021 900 1 2 . 1 1 46 46 ALA C C 46 179.314 179.314 179.170 0.144 26021 901 1 2 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.064 -0.078 26021 902 1 2 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.544 -0.322 26021 903 1 2 . 1 1 46 46 ALA H H 46 7.872 7.872 7.921 -0.049 26021 904 1 2 . 1 1 47 47 LEU N N 47 119.328 119.328 115.927 3.401 26021 905 1 2 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.964 0.227 26021 906 1 2 . 1 1 47 47 LEU C C 47 180.403 180.403 178.266 2.137 26021 907 1 2 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.070 -0.024 26021 908 1 2 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.391 0.559 26021 909 1 2 . 1 1 47 47 LEU H H 47 8.529 8.529 7.730 0.799 26021 910 1 2 . 1 1 48 48 ILE N N 48 121.653 121.653 119.270 2.383 26021 911 1 2 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.625 0.077 26021 912 1 2 . 1 1 48 48 ILE C C 48 178.730 178.730 178.445 0.285 26021 913 1 2 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.804 0.106 26021 914 1 2 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.591 0.321 26021 915 1 2 . 1 1 48 48 ILE H H 48 8.386 8.386 7.240 1.146 26021 916 1 2 . 1 1 49 49 LYS N N 49 119.896 119.896 119.877 0.019 26021 917 1 2 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.077 -0.034 26021 918 1 2 . 1 1 49 49 LYS C C 49 179.999 179.999 179.241 0.758 26021 919 1 2 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.632 -0.575 26021 920 1 2 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.475 -0.514 26021 921 1 2 . 1 1 49 49 LYS H H 49 7.456 7.456 7.673 -0.217 26021 922 1 2 . 1 1 50 50 ILE N N 50 119.964 119.964 114.412 5.552 26021 923 1 2 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.117 -0.381 26021 924 1 2 . 1 1 50 50 ILE C C 50 177.960 177.960 177.684 0.276 26021 925 1 2 . 1 1 50 50 ILE CA C 50 64.349 64.349 64.011 0.338 26021 926 1 2 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.821 0.311 26021 927 1 2 . 1 1 50 50 ILE H H 50 8.154 8.154 8.583 -0.429 26021 928 1 2 . 1 1 51 51 GLY N N 51 106.709 106.709 107.137 -0.428 26021 929 1 2 . 1 1 51 51 GLY C C 51 174.461 174.461 175.146 -0.685 26021 930 1 2 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.677 0.232 26021 931 1 2 . 1 1 51 51 GLY H H 51 7.932 7.932 7.669 0.263 26021 932 1 2 . 1 1 52 52 GLU N N 52 118.736 118.736 119.597 -0.861 26021 933 1 2 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.204 0.116 26021 934 1 2 . 1 1 52 52 GLU C C 52 176.789 176.789 177.204 -0.415 26021 935 1 2 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.470 -1.196 26021 936 1 2 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.229 -0.117 26021 937 1 2 . 1 1 52 52 GLU H H 52 7.597 7.597 7.815 -0.218 26021 938 1 2 . 1 1 53 53 VAL N N 53 122.982 122.982 116.503 6.479 26021 939 1 2 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.019 0.242 26021 940 1 2 . 1 1 53 53 VAL CA C 53 60.385 60.385 60.353 0.032 26021 941 1 2 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.604 1.218 26021 942 1 2 . 1 1 53 53 VAL H H 53 7.511 7.511 7.347 0.164 26021 943 1 2 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.704 -0.059 26021 944 1 2 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.477 0.101 26021 945 1 2 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.014 0.521 26021 946 1 2 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.335 -0.144 26021 947 1 2 . 1 1 55 55 PRO C C 55 178.258 178.258 176.884 1.374 26021 948 1 2 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.340 1.088 26021 949 1 2 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.997 -0.151 26021 950 1 2 . 1 1 56 56 ASP N N 56 114.117 114.117 116.680 -2.563 26021 951 1 2 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.518 -0.026 26021 952 1 2 . 1 1 56 56 ASP C C 56 176.696 176.696 177.489 -0.793 26021 953 1 2 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.760 -0.621 26021 954 1 2 . 1 1 56 56 ASP CB C 56 39.726 39.726 41.064 -1.338 26021 955 1 2 . 1 1 56 56 ASP H H 56 8.489 8.489 8.451 0.038 26021 956 1 2 . 1 1 57 57 GLN N N 57 117.641 117.641 116.683 0.958 26021 957 1 2 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.334 0.040 26021 958 1 2 . 1 1 57 57 GLN C C 57 175.765 175.765 176.420 -0.655 26021 959 1 2 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.817 -0.527 26021 960 1 2 . 1 1 57 57 GLN CB C 57 29.646 29.646 30.283 -0.637 26021 961 1 2 . 1 1 57 57 GLN H H 57 8.206 8.206 7.514 0.692 26021 962 1 2 . 1 1 58 58 LEU N N 58 122.141 122.141 123.864 -1.723 26021 963 1 2 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.152 0.298 26021 964 1 2 . 1 1 58 58 LEU C C 58 176.849 176.849 175.852 0.997 26021 965 1 2 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.680 -0.685 26021 966 1 2 . 1 1 58 58 LEU CB C 58 43.231 43.231 41.414 1.817 26021 967 1 2 . 1 1 58 58 LEU H H 58 7.152 7.152 7.455 -0.303 26021 968 1 2 . 1 1 59 59 ASP N N 59 125.643 125.643 123.714 1.929 26021 969 1 2 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.792 -0.073 26021 970 1 2 . 1 1 59 59 ASP C C 59 177.249 177.249 176.424 0.825 26021 971 1 2 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.082 1.321 26021 972 1 2 . 1 1 59 59 ASP CB C 59 42.232 42.232 42.190 0.042 26021 973 1 2 . 1 1 59 59 ASP H H 59 9.312 9.312 7.793 1.519 26021 974 1 2 . 1 1 60 60 SER N N 60 116.550 116.550 114.574 1.976 26021 975 1 2 . 1 1 60 60 SER HA H 60 4.124 4.124 4.133 -0.009 26021 976 1 2 . 1 1 60 60 SER C C 60 176.840 176.840 176.084 0.756 26021 977 1 2 . 1 1 60 60 SER CA C 60 61.722 61.722 61.257 0.465 26021 978 1 2 . 1 1 60 60 SER CB C 60 62.815 62.815 63.109 -0.294 26021 979 1 2 . 1 1 60 60 SER H H 60 8.647 8.647 8.587 0.060 26021 980 1 2 . 1 1 61 61 GLN N N 61 121.394 121.394 119.569 1.825 26021 981 1 2 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.069 0.062 26021 982 1 2 . 1 1 61 61 GLN C C 61 178.629 178.629 177.846 0.783 26021 983 1 2 . 1 1 61 61 GLN CA C 61 58.753 58.753 59.115 -0.363 26021 984 1 2 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.294 -0.041 26021 985 1 2 . 1 1 61 61 GLN H H 61 8.453 8.453 8.582 -0.129 26021 986 1 2 . 1 1 62 62 ASP N N 62 122.187 122.187 118.968 3.219 26021 987 1 2 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.630 -0.011 26021 988 1 2 . 1 1 62 62 ASP C C 62 178.318 178.318 178.425 -0.107 26021 989 1 2 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.620 -0.158 26021 990 1 2 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.882 0.154 26021 991 1 2 . 1 1 62 62 ASP H H 62 8.311 8.311 8.074 0.237 26021 992 1 2 . 1 1 63 63 LYS N N 63 120.325 120.325 120.034 0.291 26021 993 1 2 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.101 -0.092 26021 994 1 2 . 1 1 63 63 LYS C C 63 178.765 178.765 179.434 -0.669 26021 995 1 2 . 1 1 63 63 LYS CA C 63 59.753 59.753 59.189 0.564 26021 996 1 2 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.433 0.020 26021 997 1 2 . 1 1 63 63 LYS H H 63 7.923 7.923 7.598 0.325 26021 998 1 2 . 1 1 64 64 LEU N N 64 119.491 119.491 119.878 -0.387 26021 999 1 2 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.222 0.004 26021 1000 1 2 . 1 1 64 64 LEU C C 64 179.526 179.526 178.995 0.531 26021 1001 1 2 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.782 0.016 26021 1002 1 2 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.129 0.646 26021 1003 1 2 . 1 1 64 64 LEU H H 64 7.820 7.820 7.678 0.142 26021 1004 1 2 . 1 1 65 65 TRP N N 65 120.674 120.674 121.902 -1.228 26021 1005 1 2 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.391 -0.083 26021 1006 1 2 . 1 1 65 65 TRP C C 65 177.379 177.379 178.040 -0.661 26021 1007 1 2 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.206 1.596 26021 1008 1 2 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.897 -0.486 26021 1009 1 2 . 1 1 65 65 TRP H H 65 8.196 8.196 8.682 -0.486 26021 1010 1 2 . 1 1 66 66 ALA N N 66 120.606 120.606 120.362 0.244 26021 1011 1 2 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.510 0.199 26021 1012 1 2 . 1 1 66 66 ALA C C 66 180.376 180.376 179.248 1.128 26021 1013 1 2 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.843 0.722 26021 1014 1 2 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.928 -0.274 26021 1015 1 2 . 1 1 66 66 ALA H H 66 8.305 8.305 8.249 0.056 26021 1016 1 2 . 1 1 67 67 ASP N N 67 119.175 119.175 118.555 0.620 26021 1017 1 2 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.321 0.129 26021 1018 1 2 . 1 1 67 67 ASP C C 67 178.757 178.757 178.121 0.636 26021 1019 1 2 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.899 0.593 26021 1020 1 2 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.758 -0.604 26021 1021 1 2 . 1 1 67 67 ASP H H 67 7.945 7.945 7.929 0.016 26021 1022 1 2 . 1 1 68 68 GLU N N 68 122.322 122.322 118.824 3.498 26021 1023 1 2 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.259 -0.244 26021 1024 1 2 . 1 1 68 68 GLU C C 68 180.055 180.055 178.917 1.138 26021 1025 1 2 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.337 0.773 26021 1026 1 2 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.748 -0.101 26021 1027 1 2 . 1 1 68 68 GLU H H 68 8.168 8.168 7.714 0.454 26021 1028 1 2 . 1 1 69 69 VAL N N 69 122.135 122.135 117.132 5.003 26021 1029 1 2 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.746 -0.494 26021 1030 1 2 . 1 1 69 69 VAL C C 69 177.736 177.736 177.493 0.243 26021 1031 1 2 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.072 1.467 26021 1032 1 2 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.169 0.073 26021 1033 1 2 . 1 1 69 69 VAL H H 69 8.424 8.424 7.102 1.322 26021 1034 1 2 . 1 1 70 70 ARG N N 70 121.373 121.373 119.204 2.169 26021 1035 1 2 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.057 -0.365 26021 1036 1 2 . 1 1 70 70 ARG C C 70 179.117 179.117 178.927 0.190 26021 1037 1 2 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.277 0.888 26021 1038 1 2 . 1 1 70 70 ARG CB C 70 29.654 29.654 30.020 -0.366 26021 1039 1 2 . 1 1 70 70 ARG H H 70 7.916 7.916 7.366 0.550 26021 1040 1 2 . 1 1 71 71 GLU N N 71 119.075 119.075 120.478 -1.403 26021 1041 1 2 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.064 -0.001 26021 1042 1 2 . 1 1 71 71 GLU C C 71 179.119 179.119 179.083 0.036 26021 1043 1 2 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.996 0.691 26021 1044 1 2 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.731 0.539 26021 1045 1 2 . 1 1 71 71 GLU H H 71 8.031 8.031 8.407 -0.376 26021 1046 1 2 . 1 1 72 72 LEU N N 72 120.503 120.503 120.874 -0.371 26021 1047 1 2 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.051 0.006 26021 1048 1 2 . 1 1 72 72 LEU C C 72 178.734 178.734 179.258 -0.524 26021 1049 1 2 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.257 0.165 26021 1050 1 2 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.565 -0.157 26021 1051 1 2 . 1 1 72 72 LEU H H 72 8.175 8.175 7.707 0.468 26021 1052 1 2 . 1 1 73 73 SER N N 73 115.243 115.243 115.403 -0.160 26021 1053 1 2 . 1 1 73 73 SER HA H 73 3.824 3.824 4.108 -0.284 26021 1054 1 2 . 1 1 73 73 SER C C 73 175.697 175.697 176.282 -0.585 26021 1055 1 2 . 1 1 73 73 SER CA C 73 62.384 62.384 61.415 0.969 26021 1056 1 2 . 1 1 73 73 SER CB C 73 62.093 62.093 62.961 -0.868 26021 1057 1 2 . 1 1 73 73 SER H H 73 8.411 8.411 8.103 0.308 26021 1058 1 2 . 1 1 74 74 TYR N N 74 121.342 121.342 121.639 -0.297 26021 1059 1 2 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.259 0.232 26021 1060 1 2 . 1 1 74 74 TYR C C 74 178.747 178.747 177.175 1.572 26021 1061 1 2 . 1 1 74 74 TYR CA C 74 60.435 60.435 61.001 -0.566 26021 1062 1 2 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.508 -1.001 26021 1063 1 2 . 1 1 74 74 TYR H H 74 7.314 7.314 7.943 -0.629 26021 1064 1 2 . 1 1 75 75 VAL N N 75 120.779 120.779 117.372 3.407 26021 1065 1 2 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.576 0.285 26021 1066 1 2 . 1 1 75 75 VAL C C 75 179.788 179.788 177.987 1.801 26021 1067 1 2 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.401 0.647 26021 1068 1 2 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.951 -0.237 26021 1069 1 2 . 1 1 75 75 VAL H H 75 7.740 7.740 7.742 -0.002 26021 1070 1 2 . 1 1 76 76 ILE N N 76 120.598 120.598 120.757 -0.159 26021 1071 1 2 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.604 0.096 26021 1072 1 2 . 1 1 76 76 ILE C C 76 177.066 177.066 177.869 -0.803 26021 1073 1 2 . 1 1 76 76 ILE CA C 76 65.919 65.919 65.155 0.764 26021 1074 1 2 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.205 0.180 26021 1075 1 2 . 1 1 76 76 ILE H H 76 8.584 8.584 7.570 1.014 26021 1076 1 2 . 1 1 77 77 GLU N N 77 120.468 120.468 120.665 -0.197 26021 1077 1 2 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.788 -0.139 26021 1078 1 2 . 1 1 77 77 GLU C C 77 177.502 177.502 178.033 -0.531 26021 1079 1 2 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.719 1.143 26021 1080 1 2 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.987 0.365 26021 1081 1 2 . 1 1 77 77 GLU H H 77 8.445 8.445 7.815 0.630 26021 1082 1 2 . 1 1 78 78 ASP N N 78 117.382 117.382 119.906 -2.524 26021 1083 1 2 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.300 0.091 26021 1084 1 2 . 1 1 78 78 ASP C C 78 177.382 177.382 177.868 -0.486 26021 1085 1 2 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.879 0.616 26021 1086 1 2 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.642 1.294 26021 1087 1 2 . 1 1 78 78 ASP H H 78 7.885 7.885 7.882 0.003 26021 1088 1 2 . 1 1 79 79 ALA N N 79 120.171 120.171 121.927 -1.756 26021 1089 1 2 . 1 1 79 79 ALA HA H 79 4.050 4.050 3.977 0.073 26021 1090 1 2 . 1 1 79 79 ALA C C 79 181.193 181.193 179.173 2.020 26021 1091 1 2 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.122 -0.067 26021 1092 1 2 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.457 -0.037 26021 1093 1 2 . 1 1 79 79 ALA H H 79 7.754 7.754 7.989 -0.235 26021 1094 1 2 . 1 1 80 80 VAL N N 80 119.541 119.541 117.539 2.002 26021 1095 1 2 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.967 -0.290 26021 1096 1 2 . 1 1 80 80 VAL C C 80 177.096 177.096 177.035 0.061 26021 1097 1 2 . 1 1 80 80 VAL CA C 80 67.084 67.084 63.999 3.085 26021 1098 1 2 . 1 1 80 80 VAL CB C 80 31.443 31.443 32.308 -0.865 26021 1099 1 2 . 1 1 80 80 VAL H H 80 8.635 8.635 7.560 1.075 26021 1100 1 2 . 1 1 81 81 ASP N N 81 121.140 121.140 120.658 0.482 26021 1101 1 2 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.284 0.185 26021 1102 1 2 . 1 1 81 81 ASP C C 81 179.569 179.569 177.947 1.622 26021 1103 1 2 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.218 0.711 26021 1104 1 2 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.816 -0.881 26021 1105 1 2 . 1 1 81 81 ASP H H 81 8.575 8.575 8.104 0.471 26021 1106 1 2 . 1 1 82 82 LYS N N 82 118.159 118.159 117.347 0.812 26021 1107 1 2 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.104 -0.083 26021 1108 1 2 . 1 1 82 82 LYS C C 82 178.890 178.890 179.075 -0.185 26021 1109 1 2 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.292 0.775 26021 1110 1 2 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.092 0.496 26021 1111 1 2 . 1 1 82 82 LYS H H 82 8.079 8.079 7.605 0.474 26021 1112 1 2 . 1 1 83 83 PHE N N 83 120.900 120.900 121.719 -0.819 26021 1113 1 2 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.340 -0.064 26021 1114 1 2 . 1 1 83 83 PHE C C 83 177.269 177.269 176.847 0.422 26021 1115 1 2 . 1 1 83 83 PHE CA C 83 60.943 60.943 59.407 1.536 26021 1116 1 2 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.098 0.649 26021 1117 1 2 . 1 1 83 83 PHE H H 83 8.015 8.015 7.769 0.246 26021 1118 1 2 . 1 1 84 84 LEU N N 84 118.209 118.209 118.649 -0.440 26021 1119 1 2 . 1 1 84 84 LEU HA H 84 3.942 3.942 3.862 0.080 26021 1120 1 2 . 1 1 84 84 LEU C C 84 178.774 178.774 178.058 0.716 26021 1121 1 2 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.515 0.655 26021 1122 1 2 . 1 1 84 84 LEU CB C 84 42.193 42.193 40.959 1.234 26021 1123 1 2 . 1 1 84 84 LEU H H 84 8.338 8.338 7.912 0.426 26021 1124 1 2 . 1 1 85 85 VAL N N 85 116.078 116.078 120.694 -4.616 26021 1125 1 2 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.694 0.297 26021 1126 1 2 . 1 1 85 85 VAL C C 85 177.252 177.252 177.168 0.084 26021 1127 1 2 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.695 -1.515 26021 1128 1 2 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.431 0.459 26021 1129 1 2 . 1 1 85 85 VAL H H 85 7.447 7.447 7.308 0.139 26021 1130 1 2 . 1 1 86 86 ARG N N 86 120.842 120.842 117.688 3.154 26021 1131 1 2 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.075 0.152 26021 1132 1 2 . 1 1 86 86 ARG C C 86 177.520 177.520 179.130 -1.610 26021 1133 1 2 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.946 -1.887 26021 1134 1 2 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.944 0.319 26021 1135 1 2 . 1 1 86 86 ARG H H 86 7.598 7.598 7.394 0.204 26021 1136 1 2 . 1 1 87 87 VAL N N 87 119.293 119.293 116.148 3.145 26021 1137 1 2 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.850 -0.025 26021 1138 1 2 . 1 1 87 87 VAL C C 87 176.121 176.121 177.281 -1.160 26021 1139 1 2 . 1 1 87 87 VAL CA C 87 63.438 63.438 64.683 -1.245 26021 1140 1 2 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.185 0.587 26021 1141 1 2 . 1 1 87 87 VAL H H 87 7.994 7.994 7.843 0.151 26021 1142 1 2 . 1 1 88 88 HIS N N 88 120.016 120.016 117.840 2.176 26021 1143 1 2 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.362 0.275 26021 1144 1 2 . 1 1 88 88 HIS C C 88 175.639 175.639 176.187 -0.548 26021 1145 1 2 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.352 -0.001 26021 1146 1 2 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.076 -0.395 26021 1147 1 2 . 1 1 88 88 HIS H H 88 7.969 7.969 8.321 -0.352 26021 1148 1 2 . 1 1 89 89 GLY N N 89 109.587 109.587 108.617 0.970 26021 1149 1 2 . 1 1 89 89 GLY C C 89 173.730 173.730 174.325 -0.595 26021 1150 1 2 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.709 -0.540 26021 1151 1 2 . 1 1 89 89 GLY H H 89 8.083 8.083 7.679 0.404 26021 1152 1 2 . 1 1 90 90 VAL N N 90 118.224 118.224 120.870 -2.646 26021 1153 1 2 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.112 0.026 26021 1154 1 2 . 1 1 90 90 VAL C C 90 176.018 176.018 175.501 0.517 26021 1155 1 2 . 1 1 90 90 VAL CA C 90 62.425 62.425 61.257 1.169 26021 1156 1 2 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.861 -0.245 26021 1157 1 2 . 1 1 90 90 VAL H H 90 7.944 7.944 7.280 0.664 26021 1158 1 2 . 1 1 91 91 GLU N N 91 124.313 124.313 126.933 -2.620 26021 1159 1 2 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.248 0.358 26021 1160 1 2 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.581 -0.405 26021 1161 1 2 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.852 0.908 26021 1162 1 2 . 1 1 91 91 GLU H H 91 8.423 8.423 8.391 0.032 26021 1163 1 2 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.382 -0.045 26021 1164 1 2 . 1 1 92 92 PRO C C 92 176.504 176.504 175.624 0.880 26021 1165 1 2 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.428 -0.056 26021 1166 1 2 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.095 0.072 26021 1167 1 2 . 1 1 93 93 ASP N N 93 120.275 120.275 122.260 -1.985 26021 1168 1 2 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.822 -0.250 26021 1169 1 2 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.043 0.927 26021 1170 1 2 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.668 -3.153 26021 1171 1 2 . 1 1 93 93 ASP H H 93 8.286 8.286 7.992 0.294 26021 1172 1 2 . 1 1 94 94 ASP N N 94 121.181 121.181 120.077 1.104 26021 1173 1 2 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.709 -0.144 26021 1174 1 2 . 1 1 94 94 ASP C C 94 176.474 176.474 177.205 -0.731 26021 1175 1 2 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.385 -1.012 26021 1176 1 2 . 1 1 94 94 ASP CB C 94 41.225 41.225 42.236 -1.011 26021 1177 1 2 . 1 1 94 94 ASP H H 94 8.259 8.259 8.685 -0.426 26021 1178 1 2 . 1 1 95 95 ASN N N 95 118.728 118.728 118.545 0.183 26021 1179 1 2 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.527 0.167 26021 1180 1 2 . 1 1 95 95 ASN C C 95 176.272 176.272 177.240 -0.968 26021 1181 1 2 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.597 -1.611 26021 1182 1 2 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.570 0.159 26021 1183 1 2 . 1 1 95 95 ASN H H 95 8.474 8.474 8.225 0.249 26021 1184 1 2 . 1 1 96 96 THR N N 96 113.868 113.868 109.295 4.573 26021 1185 1 2 . 1 1 96 96 THR HA H 96 4.220 4.220 4.083 0.137 26021 1186 1 2 . 1 1 96 96 THR C C 96 175.107 175.107 175.357 -0.250 26021 1187 1 2 . 1 1 96 96 THR CA C 96 63.200 63.200 64.309 -1.109 26021 1188 1 2 . 1 1 96 96 THR CB C 96 69.475 69.475 68.371 1.105 26021 1189 1 2 . 1 1 96 96 THR H H 96 8.263 8.263 7.997 0.266 26021 1190 1 2 . 1 1 97 97 ASN N N 97 119.954 119.954 119.774 0.180 26021 1191 1 2 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.737 -0.121 26021 1192 1 2 . 1 1 97 97 ASN C C 97 176.275 176.275 176.561 -0.286 26021 1193 1 2 . 1 1 97 97 ASN CA C 97 53.956 53.956 55.435 -1.479 26021 1194 1 2 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.918 -0.226 26021 1195 1 2 . 1 1 97 97 ASN H H 97 8.431 8.431 7.838 0.593 26021 1196 1 2 . 1 1 98 98 GLY N N 98 108.847 108.847 106.813 2.034 26021 1197 1 2 . 1 1 98 98 GLY C C 98 175.533 175.533 175.276 0.257 26021 1198 1 2 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.393 -0.382 26021 1199 1 2 . 1 1 98 98 GLY H H 98 8.338 8.338 7.667 0.671 26021 1200 1 2 . 1 1 99 99 PHE N N 99 118.492 118.492 119.205 -0.713 26021 1201 1 2 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.106 0.142 26021 1202 1 2 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.689 0.270 26021 1203 1 2 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.192 -1.033 26021 1204 1 2 . 1 1 99 99 PHE H H 99 8.370 8.370 8.685 -0.315 26021 1205 1 2 . 1 1 100 100 LYS N N 100 120.987 120.987 119.233 1.754 26021 1206 1 2 . 1 1 100 100 LYS H H 100 8.256 8.256 8.415 -0.159 26021 1207 1 2 . 1 1 101 101 GLY N N 101 108.186 108.186 106.378 1.808 26021 1208 1 2 . 1 1 101 101 GLY C C 101 177.075 177.075 176.027 1.048 26021 1209 1 2 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.101 0.801 26021 1210 1 2 . 1 1 101 101 GLY H H 101 8.300 8.300 7.619 0.681 26021 1211 1 2 . 1 1 102 102 LEU N N 102 121.439 121.439 123.639 -2.200 26021 1212 1 2 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.964 0.133 26021 1213 1 2 . 1 1 102 102 LEU C C 102 179.836 179.836 178.116 1.720 26021 1214 1 2 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.453 -0.095 26021 1215 1 2 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.846 -0.076 26021 1216 1 2 . 1 1 102 102 LEU H H 102 7.777 7.777 7.961 -0.184 26021 1217 1 2 . 1 1 103 103 MET N N 103 122.290 122.290 117.406 4.884 26021 1218 1 2 . 1 1 103 103 MET HA H 103 4.220 4.220 3.737 0.483 26021 1219 1 2 . 1 1 103 103 MET C C 103 177.739 177.739 177.699 0.040 26021 1220 1 2 . 1 1 103 103 MET CA C 103 58.739 58.739 58.261 0.478 26021 1221 1 2 . 1 1 103 103 MET CB C 103 31.895 31.895 31.854 0.041 26021 1222 1 2 . 1 1 103 103 MET H H 103 8.409 8.409 8.027 0.382 26021 1223 1 2 . 1 1 104 104 LYS N N 104 119.750 119.750 117.378 2.372 26021 1224 1 2 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.019 0.048 26021 1225 1 2 . 1 1 104 104 LYS C C 104 179.301 179.301 179.658 -0.357 26021 1226 1 2 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.820 0.944 26021 1227 1 2 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.578 0.469 26021 1228 1 2 . 1 1 104 104 LYS H H 104 7.916 7.916 7.377 0.539 26021 1229 1 2 . 1 1 105 105 ARG N N 105 117.967 117.967 119.671 -1.704 26021 1230 1 2 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.163 -0.137 26021 1231 1 2 . 1 1 105 105 ARG C C 105 178.777 178.777 178.902 -0.125 26021 1232 1 2 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.499 -0.135 26021 1233 1 2 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.292 0.705 26021 1234 1 2 . 1 1 105 105 ARG H H 105 7.719 7.719 7.921 -0.202 26021 1235 1 2 . 1 1 106 106 THR N N 106 117.211 117.211 113.079 4.132 26021 1236 1 2 . 1 1 106 106 THR HA H 106 4.301 4.301 4.192 0.109 26021 1237 1 2 . 1 1 106 106 THR C C 106 176.254 176.254 176.030 0.224 26021 1238 1 2 . 1 1 106 106 THR CA C 106 67.860 67.860 66.211 1.649 26021 1239 1 2 . 1 1 106 106 THR CB C 106 67.860 67.860 68.602 -0.742 26021 1240 1 2 . 1 1 106 106 THR H H 106 8.152 8.152 7.993 0.159 26021 1241 1 2 . 1 1 107 107 THR N N 107 117.939 117.939 116.817 1.122 26021 1242 1 2 . 1 1 107 107 THR HA H 107 3.971 3.971 3.925 0.046 26021 1243 1 2 . 1 1 107 107 THR C C 107 176.780 176.780 176.497 0.283 26021 1244 1 2 . 1 1 107 107 THR CA C 107 66.822 66.822 66.361 0.461 26021 1245 1 2 . 1 1 107 107 THR CB C 107 68.818 68.818 68.608 0.210 26021 1246 1 2 . 1 1 107 107 THR H H 107 8.651 8.651 7.965 0.686 26021 1247 1 2 . 1 1 108 108 LYS N N 108 120.867 120.867 119.890 0.977 26021 1248 1 2 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.095 -0.073 26021 1249 1 2 . 1 1 108 108 LYS C C 108 179.045 179.045 178.634 0.411 26021 1250 1 2 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.272 0.562 26021 1251 1 2 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.347 0.126 26021 1252 1 2 . 1 1 108 108 LYS H H 108 7.694 7.694 7.591 0.103 26021 1253 1 2 . 1 1 109 109 LEU N N 109 119.472 119.472 119.193 0.279 26021 1254 1 2 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.232 0.089 26021 1255 1 2 . 1 1 109 109 LEU C C 109 179.974 179.974 179.423 0.551 26021 1256 1 2 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.228 0.365 26021 1257 1 2 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.419 -0.559 26021 1258 1 2 . 1 1 109 109 LEU H H 109 7.559 7.559 7.629 -0.070 26021 1259 1 2 . 1 1 110 110 LEU N N 110 121.832 121.832 119.882 1.950 26021 1260 1 2 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.040 0.151 26021 1261 1 2 . 1 1 110 110 LEU C C 110 178.101 178.101 178.335 -0.234 26021 1262 1 2 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.512 0.380 26021 1263 1 2 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.402 0.482 26021 1264 1 2 . 1 1 110 110 LEU H H 110 8.567 8.567 8.480 0.087 26021 1265 1 2 . 1 1 111 111 LYS N N 111 117.972 117.972 118.413 -0.441 26021 1266 1 2 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.011 -0.032 26021 1267 1 2 . 1 1 111 111 LYS C C 111 177.677 177.677 177.930 -0.253 26021 1268 1 2 . 1 1 111 111 LYS CA C 111 58.785 58.785 59.434 -0.649 26021 1269 1 2 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.122 0.087 26021 1270 1 2 . 1 1 111 111 LYS H H 111 7.965 7.965 7.878 0.087 26021 1271 1 2 . 1 1 112 112 LYS N N 112 115.433 115.433 116.967 -1.534 26021 1272 1 2 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.100 0.010 26021 1273 1 2 . 1 1 112 112 LYS C C 112 178.270 178.270 177.937 0.333 26021 1274 1 2 . 1 1 112 112 LYS CA C 112 58.951 58.951 59.015 -0.064 26021 1275 1 2 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.583 0.208 26021 1276 1 2 . 1 1 112 112 LYS H H 112 7.334 7.334 7.440 -0.106 26021 1277 1 2 . 1 1 113 113 VAL N N 113 114.861 114.861 119.840 -4.979 26021 1278 1 2 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.949 -0.118 26021 1279 1 2 . 1 1 113 113 VAL C C 113 176.999 176.999 177.713 -0.714 26021 1280 1 2 . 1 1 113 113 VAL CA C 113 63.505 63.505 64.846 -1.341 26021 1281 1 2 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.632 0.655 26021 1282 1 2 . 1 1 113 113 VAL H H 113 7.298 7.298 7.252 0.046 26021 1283 1 2 . 1 1 114 114 VAL N N 114 121.457 121.457 119.767 1.690 26021 1284 1 2 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.805 -0.083 26021 1285 1 2 . 1 1 114 114 VAL C C 114 177.737 177.737 177.082 0.655 26021 1286 1 2 . 1 1 114 114 VAL CA C 114 65.224 65.224 64.938 0.286 26021 1287 1 2 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.144 0.609 26021 1288 1 2 . 1 1 114 114 VAL H H 114 7.855 7.855 8.480 -0.625 26021 1289 1 2 . 1 1 115 115 ASP N N 115 120.804 120.804 120.317 0.487 26021 1290 1 2 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.456 -0.001 26021 1291 1 2 . 1 1 115 115 ASP C C 115 177.380 177.380 177.555 -0.175 26021 1292 1 2 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.824 -0.903 26021 1293 1 2 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.975 -0.603 26021 1294 1 2 . 1 1 115 115 ASP H H 115 8.311 8.311 8.428 -0.117 26021 1295 1 2 . 1 1 116 116 LYS N N 116 119.582 119.582 118.132 1.450 26021 1296 1 2 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.341 -0.246 26021 1297 1 2 . 1 1 116 116 LYS C C 116 177.077 177.077 178.738 -1.661 26021 1298 1 2 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.480 0.231 26021 1299 1 2 . 1 1 116 116 LYS CB C 116 33.488 33.488 32.858 0.630 26021 1300 1 2 . 1 1 116 116 LYS H H 116 7.639 7.639 8.021 -0.382 26021 1301 1 2 . 1 1 117 117 HIS N N 117 115.246 115.246 117.295 -2.049 26021 1302 1 2 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.415 0.210 26021 1303 1 2 . 1 1 117 117 HIS C C 117 175.497 175.497 176.611 -1.114 26021 1304 1 2 . 1 1 117 117 HIS CA C 117 56.175 56.175 57.433 -1.258 26021 1305 1 2 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.495 -0.020 26021 1306 1 2 . 1 1 117 117 HIS H H 117 8.108 8.108 8.003 0.105 26021 1307 1 2 . 1 1 118 118 GLY N N 118 109.944 109.944 107.859 2.085 26021 1308 1 2 . 1 1 118 118 GLY C C 118 174.093 174.093 174.796 -0.703 26021 1309 1 2 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.594 0.470 26021 1310 1 2 . 1 1 118 118 GLY H H 118 8.153 8.153 7.939 0.214 26021 1311 1 2 . 1 1 119 119 ILE N N 119 118.468 118.468 122.741 -4.273 26021 1312 1 2 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.863 0.259 26021 1313 1 2 . 1 1 119 119 ILE C C 119 174.777 174.777 175.432 -0.655 26021 1314 1 2 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.056 0.046 26021 1315 1 2 . 1 1 119 119 ILE CB C 119 38.631 38.631 35.477 3.155 26021 1316 1 2 . 1 1 119 119 ILE H H 119 7.828 7.828 7.457 0.371 26021 1317 1 3 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.589 0.160 26021 1318 1 3 . 1 1 4 4 ASN C C 4 175.260 175.260 175.440 -0.180 26021 1319 1 3 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.131 -0.300 26021 1320 1 3 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.358 0.323 26021 1321 1 3 . 1 1 5 5 ALA N N 5 123.648 123.648 121.940 1.708 26021 1322 1 3 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.632 -0.342 26021 1323 1 3 . 1 1 5 5 ALA C C 5 178.256 178.256 178.120 0.136 26021 1324 1 3 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.446 1.635 26021 1325 1 3 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.657 -0.632 26021 1326 1 3 . 1 1 5 5 ALA H H 5 8.520 8.520 7.870 0.650 26021 1327 1 3 . 1 1 6 6 GLY N N 6 107.044 107.044 108.102 -1.058 26021 1328 1 3 . 1 1 6 6 GLY C C 6 174.961 174.961 175.178 -0.217 26021 1329 1 3 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.990 -1.161 26021 1330 1 3 . 1 1 6 6 GLY H H 6 8.350 8.350 7.669 0.681 26021 1331 1 3 . 1 1 7 7 ALA N N 7 123.366 123.366 123.575 -0.209 26021 1332 1 3 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.070 0.146 26021 1333 1 3 . 1 1 7 7 ALA C C 7 179.006 179.006 178.706 0.300 26021 1334 1 3 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.799 -1.096 26021 1335 1 3 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.200 0.644 26021 1336 1 3 . 1 1 7 7 ALA H H 7 8.078 8.078 8.255 -0.177 26021 1337 1 3 . 1 1 8 8 ILE N N 8 117.376 117.376 118.179 -0.803 26021 1338 1 3 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.837 -0.057 26021 1339 1 3 . 1 1 8 8 ILE C C 8 177.032 177.032 178.113 -1.081 26021 1340 1 3 . 1 1 8 8 ILE CA C 8 63.158 63.158 63.855 -0.697 26021 1341 1 3 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.790 -1.501 26021 1342 1 3 . 1 1 8 8 ILE H H 8 7.943 7.943 7.619 0.324 26021 1343 1 3 . 1 1 9 9 ALA N N 9 121.414 121.414 122.872 -1.458 26021 1344 1 3 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.020 -0.087 26021 1345 1 3 . 1 1 9 9 ALA C C 9 180.515 180.515 179.261 1.254 26021 1346 1 3 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.719 0.379 26021 1347 1 3 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.131 0.030 26021 1348 1 3 . 1 1 9 9 ALA H H 9 8.062 8.062 7.885 0.177 26021 1349 1 3 . 1 1 10 10 LYS N N 10 114.594 114.594 118.931 -4.337 26021 1350 1 3 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.126 0.038 26021 1351 1 3 . 1 1 10 10 LYS C C 10 178.099 178.099 177.934 0.165 26021 1352 1 3 . 1 1 10 10 LYS CA C 10 57.840 57.840 57.606 0.234 26021 1353 1 3 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.118 0.351 26021 1354 1 3 . 1 1 10 10 LYS H H 10 7.554 7.554 7.818 -0.264 26021 1355 1 3 . 1 1 11 11 LEU N N 11 119.662 119.662 118.943 0.719 26021 1356 1 3 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.129 -0.051 26021 1357 1 3 . 1 1 11 11 LEU C C 11 177.930 177.930 178.253 -0.323 26021 1358 1 3 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.411 0.145 26021 1359 1 3 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.800 1.288 26021 1360 1 3 . 1 1 11 11 LEU H H 11 7.814 7.814 7.330 0.484 26021 1361 1 3 . 1 1 12 12 ILE N N 12 117.945 117.945 120.399 -2.454 26021 1362 1 3 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.898 -0.206 26021 1363 1 3 . 1 1 12 12 ILE CA C 12 67.629 67.629 65.900 1.729 26021 1364 1 3 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.782 1.628 26021 1365 1 3 . 1 1 12 12 ILE H H 12 7.426 7.426 7.578 -0.152 26021 1366 1 3 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.282 0.121 26021 1367 1 3 . 1 1 13 13 PRO C C 13 179.030 179.030 178.565 0.465 26021 1368 1 3 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.037 0.207 26021 1369 1 3 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.051 -0.242 26021 1370 1 3 . 1 1 14 14 LYS N N 14 117.855 117.855 117.692 0.163 26021 1371 1 3 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.051 0.094 26021 1372 1 3 . 1 1 14 14 LYS C C 14 178.565 178.565 177.990 0.575 26021 1373 1 3 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.194 0.239 26021 1374 1 3 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.112 0.813 26021 1375 1 3 . 1 1 14 14 LYS H H 14 6.685 6.685 7.449 -0.764 26021 1376 1 3 . 1 1 15 15 LEU N N 15 118.008 118.008 116.798 1.210 26021 1377 1 3 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.423 -0.420 26021 1378 1 3 . 1 1 15 15 LEU C C 15 178.662 178.662 178.806 -0.144 26021 1379 1 3 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.209 1.503 26021 1380 1 3 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.410 -0.411 26021 1381 1 3 . 1 1 15 15 LEU H H 15 8.148 8.148 7.430 0.718 26021 1382 1 3 . 1 1 16 16 GLY N N 16 103.895 103.895 108.557 -4.662 26021 1383 1 3 . 1 1 16 16 GLY C C 16 176.838 176.838 175.782 1.056 26021 1384 1 3 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.017 0.348 26021 1385 1 3 . 1 1 16 16 GLY H H 16 8.104 8.104 7.712 0.392 26021 1386 1 3 . 1 1 17 17 GLU N N 17 121.655 121.655 121.716 -0.061 26021 1387 1 3 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.086 0.047 26021 1388 1 3 . 1 1 17 17 GLU C C 17 179.007 179.007 178.082 0.925 26021 1389 1 3 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.135 -0.324 26021 1390 1 3 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.445 -0.312 26021 1391 1 3 . 1 1 17 17 GLU H H 17 7.817 7.817 7.700 0.117 26021 1392 1 3 . 1 1 18 18 LEU N N 18 117.834 117.834 116.348 1.486 26021 1393 1 3 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.400 -0.282 26021 1394 1 3 . 1 1 18 18 LEU C C 18 177.658 177.658 177.299 0.359 26021 1395 1 3 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.401 1.628 26021 1396 1 3 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.707 -0.037 26021 1397 1 3 . 1 1 18 18 LEU H H 18 7.389 7.389 7.621 -0.232 26021 1398 1 3 . 1 1 19 19 LEU N N 19 113.694 113.694 117.891 -4.197 26021 1399 1 3 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.477 -0.315 26021 1400 1 3 . 1 1 19 19 LEU C C 19 178.123 178.123 178.250 -0.127 26021 1401 1 3 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.292 0.560 26021 1402 1 3 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.648 -0.428 26021 1403 1 3 . 1 1 19 19 LEU H H 19 7.269 7.269 7.758 -0.489 26021 1404 1 3 . 1 1 20 20 VAL N N 20 112.778 112.778 114.239 -1.461 26021 1405 1 3 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.065 0.378 26021 1406 1 3 . 1 1 20 20 VAL C C 20 177.021 177.021 176.625 0.396 26021 1407 1 3 . 1 1 20 20 VAL CA C 20 61.855 61.855 64.448 -2.593 26021 1408 1 3 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.044 0.734 26021 1409 1 3 . 1 1 20 20 VAL H H 20 7.356 7.356 7.738 -0.382 26021 1410 1 3 . 1 1 21 21 GLY N N 21 108.962 108.962 109.485 -0.523 26021 1411 1 3 . 1 1 21 21 GLY C C 21 173.813 173.813 173.522 0.291 26021 1412 1 3 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.569 0.477 26021 1413 1 3 . 1 1 21 21 GLY H H 21 7.925 7.925 8.398 -0.473 26021 1414 1 3 . 1 1 22 22 GLU N N 22 120.607 120.607 121.859 -1.252 26021 1415 1 3 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.513 -0.235 26021 1416 1 3 . 1 1 22 22 GLU C C 22 175.869 175.869 175.280 0.589 26021 1417 1 3 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.156 0.874 26021 1418 1 3 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.444 -0.763 26021 1419 1 3 . 1 1 22 22 GLU H H 22 8.300 8.300 8.443 -0.143 26021 1420 1 3 . 1 1 23 23 TYR N N 23 120.738 120.738 120.005 0.733 26021 1421 1 3 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.031 -0.474 26021 1422 1 3 . 1 1 23 23 TYR C C 23 175.264 175.264 174.587 0.677 26021 1423 1 3 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.160 0.401 26021 1424 1 3 . 1 1 23 23 TYR CB C 23 39.246 39.246 38.841 0.405 26021 1425 1 3 . 1 1 23 23 TYR H H 23 7.756 7.756 7.303 0.453 26021 1426 1 3 . 1 1 24 24 LYS N N 24 122.095 122.095 121.643 0.452 26021 1427 1 3 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.639 -0.456 26021 1428 1 3 . 1 1 24 24 LYS C C 24 175.742 175.742 175.418 0.324 26021 1429 1 3 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.091 0.027 26021 1430 1 3 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.630 0.089 26021 1431 1 3 . 1 1 24 24 LYS H H 24 8.692 8.692 8.705 -0.013 26021 1432 1 3 . 1 1 25 25 LEU N N 25 121.123 121.123 119.643 1.480 26021 1433 1 3 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.743 -0.251 26021 1434 1 3 . 1 1 25 25 LEU C C 25 177.487 177.487 176.665 0.822 26021 1435 1 3 . 1 1 25 25 LEU CA C 25 54.334 54.334 54.070 0.264 26021 1436 1 3 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.392 -0.634 26021 1437 1 3 . 1 1 25 25 LEU H H 25 8.088 8.088 7.696 0.392 26021 1438 1 3 . 1 1 26 26 HIS N N 26 122.993 122.993 118.626 4.367 26021 1439 1 3 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.780 -0.279 26021 1440 1 3 . 1 1 26 26 HIS C C 26 176.716 176.716 176.372 0.344 26021 1441 1 3 . 1 1 26 26 HIS CA C 26 57.197 57.197 55.032 2.165 26021 1442 1 3 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.675 0.682 26021 1443 1 3 . 1 1 26 26 HIS H H 26 8.882 8.882 8.548 0.334 26021 1444 1 3 . 1 1 27 27 LYS N N 27 124.894 124.894 121.190 3.704 26021 1445 1 3 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.316 -0.368 26021 1446 1 3 . 1 1 27 27 LYS C C 27 178.873 178.873 178.803 0.070 26021 1447 1 3 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.257 1.754 26021 1448 1 3 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.406 0.037 26021 1449 1 3 . 1 1 27 27 LYS H H 27 8.699 8.699 8.500 0.199 26021 1450 1 3 . 1 1 28 28 GLY N N 28 111.258 111.258 106.587 4.671 26021 1451 1 3 . 1 1 28 28 GLY C C 28 176.131 176.131 175.886 0.245 26021 1452 1 3 . 1 1 28 28 GLY CA C 28 46.490 46.490 47.007 -0.517 26021 1453 1 3 . 1 1 28 28 GLY H H 28 9.814 9.814 8.655 1.159 26021 1454 1 3 . 1 1 29 29 VAL N N 29 122.719 122.719 120.684 2.035 26021 1455 1 3 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.706 0.186 26021 1456 1 3 . 1 1 29 29 VAL C C 29 177.628 177.628 177.581 0.047 26021 1457 1 3 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.443 0.077 26021 1458 1 3 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.217 0.525 26021 1459 1 3 . 1 1 29 29 VAL H H 29 7.431 7.431 7.448 -0.017 26021 1460 1 3 . 1 1 30 30 LYS N N 30 119.791 119.791 119.544 0.247 26021 1461 1 3 . 1 1 30 30 LYS HA H 30 3.635 3.635 4.008 -0.373 26021 1462 1 3 . 1 1 30 30 LYS C C 30 177.666 177.666 178.765 -1.099 26021 1463 1 3 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.872 1.152 26021 1464 1 3 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.934 0.471 26021 1465 1 3 . 1 1 30 30 LYS H H 30 8.255 8.255 8.149 0.106 26021 1466 1 3 . 1 1 31 31 LYS N N 31 117.918 117.918 118.549 -0.631 26021 1467 1 3 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.256 -0.140 26021 1468 1 3 . 1 1 31 31 LYS C C 31 177.784 177.784 178.683 -0.899 26021 1469 1 3 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.588 -0.885 26021 1470 1 3 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.176 -0.331 26021 1471 1 3 . 1 1 31 31 LYS H H 31 7.689 7.689 7.542 0.147 26021 1472 1 3 . 1 1 32 32 ASN N N 32 116.347 116.347 117.558 -1.211 26021 1473 1 3 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.236 0.284 26021 1474 1 3 . 1 1 32 32 ASN C C 32 177.764 177.764 177.080 0.684 26021 1475 1 3 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.758 0.557 26021 1476 1 3 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.694 -0.062 26021 1477 1 3 . 1 1 32 32 ASN H H 32 7.556 7.556 7.492 0.064 26021 1478 1 3 . 1 1 33 33 ILE N N 33 120.592 120.592 120.066 0.526 26021 1479 1 3 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.799 -0.517 26021 1480 1 3 . 1 1 33 33 ILE C C 33 177.074 177.074 177.713 -0.639 26021 1481 1 3 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.612 2.276 26021 1482 1 3 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.955 0.223 26021 1483 1 3 . 1 1 33 33 ILE H H 33 8.236 8.236 7.892 0.344 26021 1484 1 3 . 1 1 34 34 GLU N N 34 120.595 120.595 119.693 0.902 26021 1485 1 3 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.884 -0.096 26021 1486 1 3 . 1 1 34 34 GLU C C 34 179.739 179.739 178.806 0.933 26021 1487 1 3 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.705 0.534 26021 1488 1 3 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.857 0.988 26021 1489 1 3 . 1 1 34 34 GLU H H 34 8.551 8.551 8.571 -0.020 26021 1490 1 3 . 1 1 35 35 ASP N N 35 120.600 120.600 120.443 0.157 26021 1491 1 3 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.492 -0.080 26021 1492 1 3 . 1 1 35 35 ASP C C 35 178.681 178.681 178.564 0.117 26021 1493 1 3 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.387 1.075 26021 1494 1 3 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.742 -0.992 26021 1495 1 3 . 1 1 35 35 ASP H H 35 8.670 8.670 7.700 0.970 26021 1496 1 3 . 1 1 36 36 LEU N N 36 123.004 123.004 120.344 2.660 26021 1497 1 3 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.458 -0.363 26021 1498 1 3 . 1 1 36 36 LEU C C 36 178.035 178.035 179.334 -1.299 26021 1499 1 3 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.337 0.691 26021 1500 1 3 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.330 -0.454 26021 1501 1 3 . 1 1 36 36 LEU H H 36 8.166 8.166 7.887 0.279 26021 1502 1 3 . 1 1 37 37 LEU N N 37 120.178 120.178 120.242 -0.064 26021 1503 1 3 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.086 -0.230 26021 1504 1 3 . 1 1 37 37 LEU C C 37 178.128 178.128 178.112 0.016 26021 1505 1 3 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.638 1.037 26021 1506 1 3 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.533 0.622 26021 1507 1 3 . 1 1 37 37 LEU H H 37 8.736 8.736 8.170 0.566 26021 1508 1 3 . 1 1 38 38 LYS N N 38 118.110 118.110 119.542 -1.432 26021 1509 1 3 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.890 0.043 26021 1510 1 3 . 1 1 38 38 LYS C C 38 179.533 179.533 178.613 0.920 26021 1511 1 3 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.259 0.014 26021 1512 1 3 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.349 -0.072 26021 1513 1 3 . 1 1 38 38 LYS H H 38 7.770 7.770 8.267 -0.497 26021 1514 1 3 . 1 1 39 39 GLU N N 39 119.265 119.265 118.382 0.883 26021 1515 1 3 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.158 0.144 26021 1516 1 3 . 1 1 39 39 GLU C C 39 179.720 179.720 179.030 0.690 26021 1517 1 3 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.883 -0.125 26021 1518 1 3 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.321 0.269 26021 1519 1 3 . 1 1 39 39 GLU H H 39 7.709 7.709 7.682 0.027 26021 1520 1 3 . 1 1 40 40 LEU N N 40 119.007 119.007 121.602 -2.595 26021 1521 1 3 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.178 -0.128 26021 1522 1 3 . 1 1 40 40 LEU C C 40 179.690 179.690 178.791 0.899 26021 1523 1 3 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.033 0.618 26021 1524 1 3 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.338 0.347 26021 1525 1 3 . 1 1 40 40 LEU H H 40 8.851 8.851 7.950 0.901 26021 1526 1 3 . 1 1 41 41 LYS N N 41 120.500 120.500 119.066 1.434 26021 1527 1 3 . 1 1 41 41 LYS HA H 41 3.952 3.952 3.940 0.012 26021 1528 1 3 . 1 1 41 41 LYS C C 41 180.223 180.223 178.854 1.369 26021 1529 1 3 . 1 1 41 41 LYS CA C 41 60.891 60.891 60.211 0.680 26021 1530 1 3 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.191 -0.124 26021 1531 1 3 . 1 1 41 41 LYS H H 41 8.482 8.482 8.555 -0.073 26021 1532 1 3 . 1 1 42 42 THR N N 42 119.555 119.555 113.093 6.462 26021 1533 1 3 . 1 1 42 42 THR HA H 42 4.000 4.000 4.074 -0.074 26021 1534 1 3 . 1 1 42 42 THR C C 42 176.633 176.633 176.648 -0.015 26021 1535 1 3 . 1 1 42 42 THR CA C 42 66.574 66.574 65.392 1.182 26021 1536 1 3 . 1 1 42 42 THR CB C 42 67.924 67.924 68.201 -0.277 26021 1537 1 3 . 1 1 42 42 THR H H 42 7.863 7.863 7.601 0.262 26021 1538 1 3 . 1 1 43 43 MET N N 43 122.839 122.839 121.899 0.940 26021 1539 1 3 . 1 1 43 43 MET HA H 43 4.022 4.022 3.999 0.023 26021 1540 1 3 . 1 1 43 43 MET C C 43 177.290 177.290 178.036 -0.746 26021 1541 1 3 . 1 1 43 43 MET CA C 43 59.731 59.731 60.086 -0.355 26021 1542 1 3 . 1 1 43 43 MET CB C 43 33.610 33.610 32.287 1.323 26021 1543 1 3 . 1 1 43 43 MET H H 43 8.714 8.714 7.578 1.136 26021 1544 1 3 . 1 1 44 44 ASN N N 44 118.049 118.049 117.259 0.790 26021 1545 1 3 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.297 0.077 26021 1546 1 3 . 1 1 44 44 ASN C C 44 176.297 176.297 177.458 -1.161 26021 1547 1 3 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.105 0.790 26021 1548 1 3 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.984 0.422 26021 1549 1 3 . 1 1 44 44 ASN H H 44 8.988 8.988 8.186 0.802 26021 1550 1 3 . 1 1 45 45 ALA N N 45 119.260 119.260 121.984 -2.724 26021 1551 1 3 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.166 -0.100 26021 1552 1 3 . 1 1 45 45 ALA C C 45 180.476 180.476 179.103 1.373 26021 1553 1 3 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.514 0.754 26021 1554 1 3 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.316 -0.628 26021 1555 1 3 . 1 1 45 45 ALA H H 45 7.675 7.675 8.153 -0.478 26021 1556 1 3 . 1 1 46 46 ALA N N 46 121.126 121.126 123.105 -1.979 26021 1557 1 3 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.072 0.044 26021 1558 1 3 . 1 1 46 46 ALA C C 46 179.314 179.314 179.099 0.215 26021 1559 1 3 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.452 -0.466 26021 1560 1 3 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.565 -0.343 26021 1561 1 3 . 1 1 46 46 ALA H H 46 7.872 7.872 8.002 -0.130 26021 1562 1 3 . 1 1 47 47 LEU N N 47 119.328 119.328 115.052 4.276 26021 1563 1 3 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.982 0.209 26021 1564 1 3 . 1 1 47 47 LEU C C 47 180.403 180.403 177.940 2.463 26021 1565 1 3 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.822 0.224 26021 1566 1 3 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.554 0.396 26021 1567 1 3 . 1 1 47 47 LEU H H 47 8.529 8.529 7.475 1.054 26021 1568 1 3 . 1 1 48 48 ILE N N 48 121.653 121.653 118.667 2.986 26021 1569 1 3 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.796 -0.094 26021 1570 1 3 . 1 1 48 48 ILE C C 48 178.730 178.730 178.139 0.591 26021 1571 1 3 . 1 1 48 48 ILE CA C 48 64.910 64.910 63.054 1.856 26021 1572 1 3 . 1 1 48 48 ILE CB C 48 37.912 37.912 36.694 1.218 26021 1573 1 3 . 1 1 48 48 ILE H H 48 8.386 8.386 7.631 0.755 26021 1574 1 3 . 1 1 49 49 LYS N N 49 119.896 119.896 118.755 1.141 26021 1575 1 3 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.227 -0.184 26021 1576 1 3 . 1 1 49 49 LYS C C 49 179.999 179.999 179.701 0.298 26021 1577 1 3 . 1 1 49 49 LYS CA C 49 59.057 59.057 58.765 0.292 26021 1578 1 3 . 1 1 49 49 LYS CB C 49 31.961 31.961 33.048 -1.087 26021 1579 1 3 . 1 1 49 49 LYS H H 49 7.456 7.456 7.602 -0.146 26021 1580 1 3 . 1 1 50 50 ILE N N 50 119.964 119.964 116.203 3.761 26021 1581 1 3 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.107 -0.371 26021 1582 1 3 . 1 1 50 50 ILE C C 50 177.960 177.960 177.906 0.054 26021 1583 1 3 . 1 1 50 50 ILE CA C 50 64.349 64.349 64.103 0.246 26021 1584 1 3 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.687 0.445 26021 1585 1 3 . 1 1 50 50 ILE H H 50 8.154 8.154 8.738 -0.584 26021 1586 1 3 . 1 1 51 51 GLY N N 51 106.709 106.709 107.553 -0.844 26021 1587 1 3 . 1 1 51 51 GLY C C 51 174.461 174.461 174.998 -0.537 26021 1588 1 3 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.087 -0.177 26021 1589 1 3 . 1 1 51 51 GLY H H 51 7.932 7.932 7.805 0.127 26021 1590 1 3 . 1 1 52 52 GLU N N 52 118.736 118.736 119.397 -0.661 26021 1591 1 3 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.189 0.131 26021 1592 1 3 . 1 1 52 52 GLU C C 52 176.789 176.789 176.800 -0.011 26021 1593 1 3 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.617 -1.343 26021 1594 1 3 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.155 -0.043 26021 1595 1 3 . 1 1 52 52 GLU H H 52 7.597 7.597 7.576 0.021 26021 1596 1 3 . 1 1 53 53 VAL N N 53 122.982 122.982 117.390 5.592 26021 1597 1 3 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.569 -0.308 26021 1598 1 3 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.498 1.887 26021 1599 1 3 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.490 1.332 26021 1600 1 3 . 1 1 53 53 VAL H H 53 7.511 7.511 7.533 -0.022 26021 1601 1 3 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.811 -0.166 26021 1602 1 3 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.684 -0.106 26021 1603 1 3 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.027 0.508 26021 1604 1 3 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.412 -0.221 26021 1605 1 3 . 1 1 55 55 PRO C C 55 178.258 178.258 176.795 1.463 26021 1606 1 3 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.419 1.008 26021 1607 1 3 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.859 -0.013 26021 1608 1 3 . 1 1 56 56 ASP N N 56 114.117 114.117 117.048 -2.931 26021 1609 1 3 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.533 -0.042 26021 1610 1 3 . 1 1 56 56 ASP C C 56 176.696 176.696 177.607 -0.911 26021 1611 1 3 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.490 -0.352 26021 1612 1 3 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.648 -0.922 26021 1613 1 3 . 1 1 56 56 ASP H H 56 8.489 8.489 8.313 0.176 26021 1614 1 3 . 1 1 57 57 GLN N N 57 117.641 117.641 117.023 0.618 26021 1615 1 3 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.286 0.088 26021 1616 1 3 . 1 1 57 57 GLN C C 57 175.765 175.765 176.516 -0.751 26021 1617 1 3 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.830 -0.540 26021 1618 1 3 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.529 0.117 26021 1619 1 3 . 1 1 57 57 GLN H H 57 8.206 8.206 7.665 0.541 26021 1620 1 3 . 1 1 58 58 LEU N N 58 122.141 122.141 122.281 -0.140 26021 1621 1 3 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.439 0.011 26021 1622 1 3 . 1 1 58 58 LEU C C 58 176.849 176.849 176.875 -0.026 26021 1623 1 3 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.844 0.151 26021 1624 1 3 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.513 0.718 26021 1625 1 3 . 1 1 58 58 LEU H H 58 7.152 7.152 7.605 -0.453 26021 1626 1 3 . 1 1 59 59 ASP N N 59 125.643 125.643 119.988 5.655 26021 1627 1 3 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.870 -0.151 26021 1628 1 3 . 1 1 59 59 ASP C C 59 177.249 177.249 177.659 -0.410 26021 1629 1 3 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.242 0.161 26021 1630 1 3 . 1 1 59 59 ASP CB C 59 42.232 42.232 42.693 -0.461 26021 1631 1 3 . 1 1 59 59 ASP H H 59 9.312 9.312 8.274 1.038 26021 1632 1 3 . 1 1 60 60 SER N N 60 116.550 116.550 116.675 -0.125 26021 1633 1 3 . 1 1 60 60 SER HA H 60 4.124 4.124 4.132 -0.008 26021 1634 1 3 . 1 1 60 60 SER C C 60 176.840 176.840 176.321 0.519 26021 1635 1 3 . 1 1 60 60 SER CA C 60 61.722 61.722 60.988 0.734 26021 1636 1 3 . 1 1 60 60 SER CB C 60 62.815 62.815 63.321 -0.506 26021 1637 1 3 . 1 1 60 60 SER H H 60 8.647 8.647 8.581 0.066 26021 1638 1 3 . 1 1 61 61 GLN N N 61 121.394 121.394 120.251 1.143 26021 1639 1 3 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.174 -0.043 26021 1640 1 3 . 1 1 61 61 GLN C C 61 178.629 178.629 177.679 0.950 26021 1641 1 3 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.029 0.723 26021 1642 1 3 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.578 -0.325 26021 1643 1 3 . 1 1 61 61 GLN H H 61 8.453 8.453 8.305 0.148 26021 1644 1 3 . 1 1 62 62 ASP N N 62 122.187 122.187 120.859 1.328 26021 1645 1 3 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.422 0.197 26021 1646 1 3 . 1 1 62 62 ASP C C 62 178.318 178.318 178.201 0.117 26021 1647 1 3 . 1 1 62 62 ASP CA C 62 57.462 57.462 58.032 -0.570 26021 1648 1 3 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.778 0.258 26021 1649 1 3 . 1 1 62 62 ASP H H 62 8.311 8.311 8.318 -0.007 26021 1650 1 3 . 1 1 63 63 LYS N N 63 120.325 120.325 118.755 1.570 26021 1651 1 3 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.112 -0.103 26021 1652 1 3 . 1 1 63 63 LYS C C 63 178.765 178.765 179.171 -0.406 26021 1653 1 3 . 1 1 63 63 LYS CA C 63 59.753 59.753 59.353 0.399 26021 1654 1 3 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.158 0.295 26021 1655 1 3 . 1 1 63 63 LYS H H 63 7.923 7.923 7.922 0.001 26021 1656 1 3 . 1 1 64 64 LEU N N 64 119.491 119.491 119.496 -0.005 26021 1657 1 3 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.297 -0.071 26021 1658 1 3 . 1 1 64 64 LEU C C 64 179.526 179.526 178.721 0.805 26021 1659 1 3 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.185 0.613 26021 1660 1 3 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.056 0.719 26021 1661 1 3 . 1 1 64 64 LEU H H 64 7.820 7.820 7.346 0.474 26021 1662 1 3 . 1 1 65 65 TRP N N 65 120.674 120.674 122.806 -2.132 26021 1663 1 3 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.558 -0.250 26021 1664 1 3 . 1 1 65 65 TRP C C 65 177.379 177.379 178.043 -0.664 26021 1665 1 3 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.185 1.617 26021 1666 1 3 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.634 -0.223 26021 1667 1 3 . 1 1 65 65 TRP H H 65 8.196 8.196 8.459 -0.263 26021 1668 1 3 . 1 1 66 66 ALA N N 66 120.606 120.606 120.094 0.512 26021 1669 1 3 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.563 0.146 26021 1670 1 3 . 1 1 66 66 ALA C C 66 180.376 180.376 179.371 1.005 26021 1671 1 3 . 1 1 66 66 ALA CA C 66 55.564 55.564 55.031 0.533 26021 1672 1 3 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.924 -0.270 26021 1673 1 3 . 1 1 66 66 ALA H H 66 8.305 8.305 7.718 0.587 26021 1674 1 3 . 1 1 67 67 ASP N N 67 119.175 119.175 118.024 1.151 26021 1675 1 3 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.346 0.104 26021 1676 1 3 . 1 1 67 67 ASP C C 67 178.757 178.757 178.166 0.591 26021 1677 1 3 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.603 0.889 26021 1678 1 3 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.889 -0.735 26021 1679 1 3 . 1 1 67 67 ASP H H 67 7.945 7.945 7.712 0.233 26021 1680 1 3 . 1 1 68 68 GLU N N 68 122.322 122.322 119.200 3.122 26021 1681 1 3 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.081 -0.066 26021 1682 1 3 . 1 1 68 68 GLU C C 68 180.055 180.055 178.700 1.355 26021 1683 1 3 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.117 0.993 26021 1684 1 3 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.858 -0.211 26021 1685 1 3 . 1 1 68 68 GLU H H 68 8.168 8.168 7.880 0.288 26021 1686 1 3 . 1 1 69 69 VAL N N 69 122.135 122.135 117.430 4.705 26021 1687 1 3 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.733 -0.481 26021 1688 1 3 . 1 1 69 69 VAL C C 69 177.736 177.736 178.032 -0.296 26021 1689 1 3 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.563 0.976 26021 1690 1 3 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.569 -0.327 26021 1691 1 3 . 1 1 69 69 VAL H H 69 8.424 8.424 7.341 1.083 26021 1692 1 3 . 1 1 70 70 ARG N N 70 121.373 121.373 120.133 1.240 26021 1693 1 3 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.836 -0.144 26021 1694 1 3 . 1 1 70 70 ARG C C 70 179.117 179.117 178.137 0.980 26021 1695 1 3 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.040 1.125 26021 1696 1 3 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.282 0.372 26021 1697 1 3 . 1 1 70 70 ARG H H 70 7.916 7.916 7.452 0.464 26021 1698 1 3 . 1 1 71 71 GLU N N 71 119.075 119.075 117.728 1.347 26021 1699 1 3 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.179 -0.116 26021 1700 1 3 . 1 1 71 71 GLU C C 71 179.119 179.119 178.500 0.619 26021 1701 1 3 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.058 0.629 26021 1702 1 3 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.967 0.303 26021 1703 1 3 . 1 1 71 71 GLU H H 71 8.031 8.031 7.660 0.371 26021 1704 1 3 . 1 1 72 72 LEU N N 72 120.503 120.503 119.867 0.636 26021 1705 1 3 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.288 -0.231 26021 1706 1 3 . 1 1 72 72 LEU C C 72 178.734 178.734 179.097 -0.363 26021 1707 1 3 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.329 1.093 26021 1708 1 3 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.416 -0.008 26021 1709 1 3 . 1 1 72 72 LEU H H 72 8.175 8.175 7.958 0.217 26021 1710 1 3 . 1 1 73 73 SER N N 73 115.243 115.243 116.604 -1.361 26021 1711 1 3 . 1 1 73 73 SER HA H 73 3.824 3.824 4.011 -0.187 26021 1712 1 3 . 1 1 73 73 SER C C 73 175.697 175.697 176.273 -0.576 26021 1713 1 3 . 1 1 73 73 SER CA C 73 62.384 62.384 61.728 0.656 26021 1714 1 3 . 1 1 73 73 SER CB C 73 62.093 62.093 62.738 -0.645 26021 1715 1 3 . 1 1 73 73 SER H H 73 8.411 8.411 8.015 0.396 26021 1716 1 3 . 1 1 74 74 TYR N N 74 121.342 121.342 121.032 0.310 26021 1717 1 3 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.292 0.199 26021 1718 1 3 . 1 1 74 74 TYR C C 74 178.747 178.747 178.228 0.519 26021 1719 1 3 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.923 -0.488 26021 1720 1 3 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.130 -0.623 26021 1721 1 3 . 1 1 74 74 TYR H H 74 7.314 7.314 7.519 -0.205 26021 1722 1 3 . 1 1 75 75 VAL N N 75 120.779 120.779 118.807 1.972 26021 1723 1 3 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.690 0.171 26021 1724 1 3 . 1 1 75 75 VAL C C 75 179.788 179.788 177.801 1.987 26021 1725 1 3 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.764 0.284 26021 1726 1 3 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.641 0.073 26021 1727 1 3 . 1 1 75 75 VAL H H 75 7.740 7.740 7.918 -0.178 26021 1728 1 3 . 1 1 76 76 ILE N N 76 120.598 120.598 119.832 0.766 26021 1729 1 3 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.590 0.110 26021 1730 1 3 . 1 1 76 76 ILE C C 76 177.066 177.066 177.950 -0.884 26021 1731 1 3 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.773 1.146 26021 1732 1 3 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.251 0.134 26021 1733 1 3 . 1 1 76 76 ILE H H 76 8.584 8.584 7.448 1.136 26021 1734 1 3 . 1 1 77 77 GLU N N 77 120.468 120.468 119.631 0.837 26021 1735 1 3 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.915 -0.266 26021 1736 1 3 . 1 1 77 77 GLU C C 77 177.502 177.502 178.426 -0.924 26021 1737 1 3 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.519 1.343 26021 1738 1 3 . 1 1 77 77 GLU CB C 77 29.352 29.352 29.004 0.348 26021 1739 1 3 . 1 1 77 77 GLU H H 77 8.445 8.445 7.854 0.591 26021 1740 1 3 . 1 1 78 78 ASP N N 78 117.382 117.382 119.639 -2.257 26021 1741 1 3 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.558 -0.167 26021 1742 1 3 . 1 1 78 78 ASP C C 78 177.382 177.382 177.757 -0.375 26021 1743 1 3 . 1 1 78 78 ASP CA C 78 57.495 57.495 57.286 0.208 26021 1744 1 3 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.931 1.004 26021 1745 1 3 . 1 1 78 78 ASP H H 78 7.885 7.885 7.943 -0.058 26021 1746 1 3 . 1 1 79 79 ALA N N 79 120.171 120.171 121.633 -1.462 26021 1747 1 3 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.043 0.007 26021 1748 1 3 . 1 1 79 79 ALA C C 79 181.193 181.193 179.657 1.536 26021 1749 1 3 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.204 -0.149 26021 1750 1 3 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.680 -0.260 26021 1751 1 3 . 1 1 79 79 ALA H H 79 7.754 7.754 7.983 -0.229 26021 1752 1 3 . 1 1 80 80 VAL N N 80 119.541 119.541 114.251 5.290 26021 1753 1 3 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.871 -0.194 26021 1754 1 3 . 1 1 80 80 VAL C C 80 177.096 177.096 177.570 -0.474 26021 1755 1 3 . 1 1 80 80 VAL CA C 80 67.084 67.084 65.388 1.696 26021 1756 1 3 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.719 -0.276 26021 1757 1 3 . 1 1 80 80 VAL H H 80 8.635 8.635 7.511 1.124 26021 1758 1 3 . 1 1 81 81 ASP N N 81 121.140 121.140 121.252 -0.112 26021 1759 1 3 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.403 0.066 26021 1760 1 3 . 1 1 81 81 ASP C C 81 179.569 179.569 178.483 1.086 26021 1761 1 3 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.039 0.890 26021 1762 1 3 . 1 1 81 81 ASP CB C 81 39.935 39.935 39.980 -0.045 26021 1763 1 3 . 1 1 81 81 ASP H H 81 8.575 8.575 7.909 0.666 26021 1764 1 3 . 1 1 82 82 LYS N N 82 118.159 118.159 118.691 -0.532 26021 1765 1 3 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.061 -0.040 26021 1766 1 3 . 1 1 82 82 LYS C C 82 178.890 178.890 179.024 -0.134 26021 1767 1 3 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.715 0.352 26021 1768 1 3 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.002 0.586 26021 1769 1 3 . 1 1 82 82 LYS H H 82 8.079 8.079 7.709 0.370 26021 1770 1 3 . 1 1 83 83 PHE N N 83 120.900 120.900 120.588 0.312 26021 1771 1 3 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.379 -0.103 26021 1772 1 3 . 1 1 83 83 PHE C C 83 177.269 177.269 177.056 0.213 26021 1773 1 3 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.440 0.503 26021 1774 1 3 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.499 0.248 26021 1775 1 3 . 1 1 83 83 PHE H H 83 8.015 8.015 7.711 0.304 26021 1776 1 3 . 1 1 84 84 LEU N N 84 118.209 118.209 118.379 -0.170 26021 1777 1 3 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.247 -0.305 26021 1778 1 3 . 1 1 84 84 LEU C C 84 178.774 178.774 178.168 0.606 26021 1779 1 3 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.496 0.674 26021 1780 1 3 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.202 0.991 26021 1781 1 3 . 1 1 84 84 LEU H H 84 8.338 8.338 7.696 0.642 26021 1782 1 3 . 1 1 85 85 VAL N N 85 116.078 116.078 120.389 -4.311 26021 1783 1 3 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.716 0.275 26021 1784 1 3 . 1 1 85 85 VAL C C 85 177.252 177.252 177.322 -0.070 26021 1785 1 3 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.351 -1.171 26021 1786 1 3 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.754 0.136 26021 1787 1 3 . 1 1 85 85 VAL H H 85 7.447 7.447 7.329 0.118 26021 1788 1 3 . 1 1 86 86 ARG N N 86 120.842 120.842 118.297 2.545 26021 1789 1 3 . 1 1 86 86 ARG HA H 86 4.227 4.227 3.982 0.245 26021 1790 1 3 . 1 1 86 86 ARG C C 86 177.520 177.520 179.015 -1.495 26021 1791 1 3 . 1 1 86 86 ARG CA C 86 57.059 57.059 59.793 -2.734 26021 1792 1 3 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.940 0.323 26021 1793 1 3 . 1 1 86 86 ARG H H 86 7.598 7.598 7.413 0.185 26021 1794 1 3 . 1 1 87 87 VAL N N 87 119.293 119.293 116.820 2.473 26021 1795 1 3 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.841 -0.016 26021 1796 1 3 . 1 1 87 87 VAL C C 87 176.121 176.121 176.872 -0.751 26021 1797 1 3 . 1 1 87 87 VAL CA C 87 63.438 63.438 64.955 -1.517 26021 1798 1 3 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.392 1.379 26021 1799 1 3 . 1 1 87 87 VAL H H 87 7.994 7.994 7.750 0.244 26021 1800 1 3 . 1 1 88 88 HIS N N 88 120.016 120.016 118.541 1.475 26021 1801 1 3 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.458 0.179 26021 1802 1 3 . 1 1 88 88 HIS C C 88 175.639 175.639 175.920 -0.281 26021 1803 1 3 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.142 0.208 26021 1804 1 3 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.455 -0.774 26021 1805 1 3 . 1 1 88 88 HIS H H 88 7.969 7.969 7.894 0.075 26021 1806 1 3 . 1 1 89 89 GLY N N 89 109.587 109.587 107.284 2.303 26021 1807 1 3 . 1 1 89 89 GLY C C 89 173.730 173.730 174.228 -0.498 26021 1808 1 3 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.573 -0.404 26021 1809 1 3 . 1 1 89 89 GLY H H 89 8.083 8.083 8.292 -0.209 26021 1810 1 3 . 1 1 90 90 VAL N N 90 118.224 118.224 118.501 -0.277 26021 1811 1 3 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.525 -0.387 26021 1812 1 3 . 1 1 90 90 VAL C C 90 176.018 176.018 174.583 1.435 26021 1813 1 3 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.193 2.232 26021 1814 1 3 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.529 -0.913 26021 1815 1 3 . 1 1 90 90 VAL H H 90 7.944 7.944 7.501 0.443 26021 1816 1 3 . 1 1 91 91 GLU N N 91 124.313 124.313 118.119 6.194 26021 1817 1 3 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.585 0.021 26021 1818 1 3 . 1 1 91 91 GLU CA C 91 54.176 54.176 52.753 1.423 26021 1819 1 3 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.428 0.332 26021 1820 1 3 . 1 1 91 91 GLU H H 91 8.423 8.423 8.214 0.209 26021 1821 1 3 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.405 -0.068 26021 1822 1 3 . 1 1 92 92 PRO C C 92 176.504 176.504 176.002 0.502 26021 1823 1 3 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.186 0.186 26021 1824 1 3 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.115 0.052 26021 1825 1 3 . 1 1 93 93 ASP N N 93 120.275 120.275 119.756 0.519 26021 1826 1 3 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.753 -0.181 26021 1827 1 3 . 1 1 93 93 ASP CA C 93 53.970 53.970 52.803 1.167 26021 1828 1 3 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.069 -2.554 26021 1829 1 3 . 1 1 93 93 ASP H H 93 8.286 8.286 8.120 0.166 26021 1830 1 3 . 1 1 94 94 ASP N N 94 121.181 121.181 119.129 2.052 26021 1831 1 3 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.568 -0.003 26021 1832 1 3 . 1 1 94 94 ASP C C 94 176.474 176.474 177.607 -1.133 26021 1833 1 3 . 1 1 94 94 ASP CA C 94 54.373 54.373 56.706 -2.333 26021 1834 1 3 . 1 1 94 94 ASP CB C 94 41.225 41.225 40.911 0.314 26021 1835 1 3 . 1 1 94 94 ASP H H 94 8.259 8.259 8.756 -0.497 26021 1836 1 3 . 1 1 95 95 ASN N N 95 118.728 118.728 119.317 -0.589 26021 1837 1 3 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.562 0.132 26021 1838 1 3 . 1 1 95 95 ASN C C 95 176.272 176.272 177.260 -0.988 26021 1839 1 3 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.655 -1.669 26021 1840 1 3 . 1 1 95 95 ASN CB C 95 38.729 38.729 37.982 0.747 26021 1841 1 3 . 1 1 95 95 ASN H H 95 8.474 8.474 8.829 -0.355 26021 1842 1 3 . 1 1 96 96 THR N N 96 113.868 113.868 110.417 3.451 26021 1843 1 3 . 1 1 96 96 THR HA H 96 4.220 4.220 4.180 0.040 26021 1844 1 3 . 1 1 96 96 THR C C 96 175.107 175.107 175.846 -0.739 26021 1845 1 3 . 1 1 96 96 THR CA C 96 63.200 63.200 64.411 -1.211 26021 1846 1 3 . 1 1 96 96 THR CB C 96 69.475 69.475 68.528 0.947 26021 1847 1 3 . 1 1 96 96 THR H H 96 8.263 8.263 8.074 0.189 26021 1848 1 3 . 1 1 97 97 ASN N N 97 119.954 119.954 119.696 0.258 26021 1849 1 3 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.464 0.152 26021 1850 1 3 . 1 1 97 97 ASN C C 97 176.275 176.275 176.164 0.111 26021 1851 1 3 . 1 1 97 97 ASN CA C 97 53.956 53.956 55.406 -1.450 26021 1852 1 3 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.661 0.031 26021 1853 1 3 . 1 1 97 97 ASN H H 97 8.431 8.431 7.723 0.708 26021 1854 1 3 . 1 1 98 98 GLY N N 98 108.847 108.847 106.918 1.929 26021 1855 1 3 . 1 1 98 98 GLY C C 98 175.533 175.533 174.946 0.587 26021 1856 1 3 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.127 -0.116 26021 1857 1 3 . 1 1 98 98 GLY H H 98 8.338 8.338 7.673 0.665 26021 1858 1 3 . 1 1 99 99 PHE N N 99 118.492 118.492 118.967 -0.475 26021 1859 1 3 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.240 0.008 26021 1860 1 3 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.818 1.141 26021 1861 1 3 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.488 -1.329 26021 1862 1 3 . 1 1 99 99 PHE H H 99 8.370 8.370 8.684 -0.314 26021 1863 1 3 . 1 1 100 100 LYS N N 100 120.987 120.987 119.428 1.559 26021 1864 1 3 . 1 1 100 100 LYS H H 100 8.256 8.256 8.480 -0.224 26021 1865 1 3 . 1 1 101 101 GLY N N 101 108.186 108.186 106.394 1.792 26021 1866 1 3 . 1 1 101 101 GLY C C 101 177.075 177.075 175.732 1.343 26021 1867 1 3 . 1 1 101 101 GLY CA C 101 46.902 46.902 45.955 0.947 26021 1868 1 3 . 1 1 101 101 GLY H H 101 8.300 8.300 7.547 0.753 26021 1869 1 3 . 1 1 102 102 LEU N N 102 121.439 121.439 123.176 -1.737 26021 1870 1 3 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.956 0.141 26021 1871 1 3 . 1 1 102 102 LEU C C 102 179.836 179.836 178.008 1.828 26021 1872 1 3 . 1 1 102 102 LEU CA C 102 57.358 57.358 56.844 0.514 26021 1873 1 3 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.779 -0.009 26021 1874 1 3 . 1 1 102 102 LEU H H 102 7.777 7.777 7.330 0.447 26021 1875 1 3 . 1 1 103 103 MET N N 103 122.290 122.290 118.968 3.322 26021 1876 1 3 . 1 1 103 103 MET HA H 103 4.220 4.220 3.822 0.398 26021 1877 1 3 . 1 1 103 103 MET C C 103 177.739 177.739 177.855 -0.116 26021 1878 1 3 . 1 1 103 103 MET CA C 103 58.739 58.739 58.488 0.251 26021 1879 1 3 . 1 1 103 103 MET CB C 103 31.895 31.895 31.944 -0.049 26021 1880 1 3 . 1 1 103 103 MET H H 103 8.409 8.409 8.278 0.131 26021 1881 1 3 . 1 1 104 104 LYS N N 104 119.750 119.750 118.713 1.037 26021 1882 1 3 . 1 1 104 104 LYS HA H 104 4.067 4.067 3.997 0.070 26021 1883 1 3 . 1 1 104 104 LYS C C 104 179.301 179.301 179.113 0.188 26021 1884 1 3 . 1 1 104 104 LYS CA C 104 59.764 59.764 59.647 0.117 26021 1885 1 3 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.861 0.186 26021 1886 1 3 . 1 1 104 104 LYS H H 104 7.916 7.916 7.635 0.281 26021 1887 1 3 . 1 1 105 105 ARG N N 105 117.967 117.967 119.091 -1.124 26021 1888 1 3 . 1 1 105 105 ARG HA H 105 4.026 4.026 3.974 0.052 26021 1889 1 3 . 1 1 105 105 ARG C C 105 178.777 178.777 178.938 -0.161 26021 1890 1 3 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.666 -0.302 26021 1891 1 3 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.299 0.698 26021 1892 1 3 . 1 1 105 105 ARG H H 105 7.719 7.719 7.631 0.088 26021 1893 1 3 . 1 1 106 106 THR N N 106 117.211 117.211 111.556 5.655 26021 1894 1 3 . 1 1 106 106 THR HA H 106 4.301 4.301 4.221 0.080 26021 1895 1 3 . 1 1 106 106 THR C C 106 176.254 176.254 176.644 -0.390 26021 1896 1 3 . 1 1 106 106 THR CA C 106 67.860 67.860 65.622 2.238 26021 1897 1 3 . 1 1 106 106 THR CB C 106 67.860 67.860 69.088 -1.228 26021 1898 1 3 . 1 1 106 106 THR H H 106 8.152 8.152 7.904 0.247 26021 1899 1 3 . 1 1 107 107 THR N N 107 117.939 117.939 118.840 -0.901 26021 1900 1 3 . 1 1 107 107 THR HA H 107 3.971 3.971 3.828 0.143 26021 1901 1 3 . 1 1 107 107 THR C C 107 176.780 176.780 176.228 0.552 26021 1902 1 3 . 1 1 107 107 THR CA C 107 66.822 66.822 67.185 -0.363 26021 1903 1 3 . 1 1 107 107 THR CB C 107 68.818 68.818 68.668 0.150 26021 1904 1 3 . 1 1 107 107 THR H H 107 8.651 8.651 8.287 0.364 26021 1905 1 3 . 1 1 108 108 LYS N N 108 120.867 120.867 121.318 -0.451 26021 1906 1 3 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.053 -0.031 26021 1907 1 3 . 1 1 108 108 LYS C C 108 179.045 179.045 179.021 0.024 26021 1908 1 3 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.021 0.813 26021 1909 1 3 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.185 0.287 26021 1910 1 3 . 1 1 108 108 LYS H H 108 7.694 7.694 8.073 -0.379 26021 1911 1 3 . 1 1 109 109 LEU N N 109 119.472 119.472 118.817 0.655 26021 1912 1 3 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.213 0.108 26021 1913 1 3 . 1 1 109 109 LEU C C 109 179.974 179.974 178.752 1.222 26021 1914 1 3 . 1 1 109 109 LEU CA C 109 57.593 57.593 56.890 0.703 26021 1915 1 3 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.371 -0.511 26021 1916 1 3 . 1 1 109 109 LEU H H 109 7.559 7.559 7.652 -0.093 26021 1917 1 3 . 1 1 110 110 LEU N N 110 121.832 121.832 120.750 1.082 26021 1918 1 3 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.005 0.186 26021 1919 1 3 . 1 1 110 110 LEU C C 110 178.101 178.101 178.674 -0.573 26021 1920 1 3 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.807 0.085 26021 1921 1 3 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.150 0.734 26021 1922 1 3 . 1 1 110 110 LEU H H 110 8.567 8.567 7.950 0.617 26021 1923 1 3 . 1 1 111 111 LYS N N 111 117.972 117.972 118.155 -0.183 26021 1924 1 3 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.048 -0.069 26021 1925 1 3 . 1 1 111 111 LYS C C 111 177.677 177.677 178.275 -0.598 26021 1926 1 3 . 1 1 111 111 LYS CA C 111 58.785 58.785 59.092 -0.307 26021 1927 1 3 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.736 0.473 26021 1928 1 3 . 1 1 111 111 LYS H H 111 7.965 7.965 7.827 0.138 26021 1929 1 3 . 1 1 112 112 LYS N N 112 115.433 115.433 117.862 -2.429 26021 1930 1 3 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.113 -0.003 26021 1931 1 3 . 1 1 112 112 LYS C C 112 178.270 178.270 178.223 0.047 26021 1932 1 3 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.214 0.737 26021 1933 1 3 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.669 0.122 26021 1934 1 3 . 1 1 112 112 LYS H H 112 7.334 7.334 7.655 -0.321 26021 1935 1 3 . 1 1 113 113 VAL N N 113 114.861 114.861 119.339 -4.478 26021 1936 1 3 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.894 -0.063 26021 1937 1 3 . 1 1 113 113 VAL C C 113 176.999 176.999 177.860 -0.861 26021 1938 1 3 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.216 -1.711 26021 1939 1 3 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.387 -0.100 26021 1940 1 3 . 1 1 113 113 VAL H H 113 7.298 7.298 7.630 -0.332 26021 1941 1 3 . 1 1 114 114 VAL N N 114 121.457 121.457 118.083 3.374 26021 1942 1 3 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.810 -0.088 26021 1943 1 3 . 1 1 114 114 VAL C C 114 177.737 177.737 176.911 0.826 26021 1944 1 3 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.162 -0.938 26021 1945 1 3 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.095 0.658 26021 1946 1 3 . 1 1 114 114 VAL H H 114 7.855 7.855 8.329 -0.474 26021 1947 1 3 . 1 1 115 115 ASP N N 115 120.804 120.804 119.445 1.359 26021 1948 1 3 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.451 0.004 26021 1949 1 3 . 1 1 115 115 ASP C C 115 177.380 177.380 176.875 0.505 26021 1950 1 3 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.199 -0.278 26021 1951 1 3 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.643 -0.271 26021 1952 1 3 . 1 1 115 115 ASP H H 115 8.311 8.311 7.999 0.312 26021 1953 1 3 . 1 1 116 116 LYS N N 116 119.582 119.582 118.521 1.061 26021 1954 1 3 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.112 -0.017 26021 1955 1 3 . 1 1 116 116 LYS C C 116 177.077 177.077 177.841 -0.764 26021 1956 1 3 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.830 -0.118 26021 1957 1 3 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.511 -0.023 26021 1958 1 3 . 1 1 116 116 LYS H H 116 7.639 7.639 7.957 -0.318 26021 1959 1 3 . 1 1 117 117 HIS N N 117 115.246 115.246 112.573 2.673 26021 1960 1 3 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.830 -0.205 26021 1961 1 3 . 1 1 117 117 HIS C C 117 175.497 175.497 175.785 -0.288 26021 1962 1 3 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.364 -0.189 26021 1963 1 3 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.197 -1.722 26021 1964 1 3 . 1 1 117 117 HIS H H 117 8.108 8.108 7.702 0.406 26021 1965 1 3 . 1 1 118 118 GLY N N 118 109.944 109.944 108.924 1.020 26021 1966 1 3 . 1 1 118 118 GLY C C 118 174.093 174.093 174.037 0.056 26021 1967 1 3 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.946 1.118 26021 1968 1 3 . 1 1 118 118 GLY H H 118 8.153 8.153 7.741 0.412 26021 1969 1 3 . 1 1 119 119 ILE N N 119 118.468 118.468 122.012 -3.544 26021 1970 1 3 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.901 0.221 26021 1971 1 3 . 1 1 119 119 ILE C C 119 174.777 174.777 175.410 -0.633 26021 1972 1 3 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.921 -0.820 26021 1973 1 3 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.377 2.254 26021 1974 1 3 . 1 1 119 119 ILE H H 119 7.828 7.828 8.045 -0.217 26021 1975 1 4 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.628 0.121 26021 1976 1 4 . 1 1 4 4 ASN C C 4 175.260 175.260 175.687 -0.427 26021 1977 1 4 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.172 -0.341 26021 1978 1 4 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.387 0.294 26021 1979 1 4 . 1 1 5 5 ALA N N 5 123.648 123.648 122.564 1.084 26021 1980 1 4 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.653 -0.363 26021 1981 1 4 . 1 1 5 5 ALA C C 5 178.256 178.256 178.549 -0.293 26021 1982 1 4 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.727 1.354 26021 1983 1 4 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.190 -0.165 26021 1984 1 4 . 1 1 5 5 ALA H H 5 8.520 8.520 8.007 0.513 26021 1985 1 4 . 1 1 6 6 GLY N N 6 107.044 107.044 108.055 -1.011 26021 1986 1 4 . 1 1 6 6 GLY C C 6 174.961 174.961 175.495 -0.534 26021 1987 1 4 . 1 1 6 6 GLY CA C 6 45.830 45.830 47.017 -1.187 26021 1988 1 4 . 1 1 6 6 GLY H H 6 8.350 8.350 7.770 0.580 26021 1989 1 4 . 1 1 7 7 ALA N N 7 123.366 123.366 123.643 -0.277 26021 1990 1 4 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.130 0.086 26021 1991 1 4 . 1 1 7 7 ALA C C 7 179.006 179.006 178.946 0.060 26021 1992 1 4 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.531 -0.828 26021 1993 1 4 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.426 0.418 26021 1994 1 4 . 1 1 7 7 ALA H H 7 8.078 8.078 8.125 -0.047 26021 1995 1 4 . 1 1 8 8 ILE N N 8 117.376 117.376 118.223 -0.847 26021 1996 1 4 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.764 0.016 26021 1997 1 4 . 1 1 8 8 ILE C C 8 177.032 177.032 178.231 -1.199 26021 1998 1 4 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.113 -0.955 26021 1999 1 4 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.123 -1.834 26021 2000 1 4 . 1 1 8 8 ILE H H 8 7.943 7.943 7.497 0.446 26021 2001 1 4 . 1 1 9 9 ALA N N 9 121.414 121.414 123.005 -1.591 26021 2002 1 4 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.061 -0.128 26021 2003 1 4 . 1 1 9 9 ALA C C 9 180.515 180.515 179.074 1.441 26021 2004 1 4 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.713 0.385 26021 2005 1 4 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.174 -0.013 26021 2006 1 4 . 1 1 9 9 ALA H H 9 8.062 8.062 7.660 0.402 26021 2007 1 4 . 1 1 10 10 LYS N N 10 114.594 114.594 119.025 -4.431 26021 2008 1 4 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.119 0.045 26021 2009 1 4 . 1 1 10 10 LYS C C 10 178.099 178.099 178.091 0.008 26021 2010 1 4 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.451 -0.611 26021 2011 1 4 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.338 0.131 26021 2012 1 4 . 1 1 10 10 LYS H H 10 7.554 7.554 8.158 -0.604 26021 2013 1 4 . 1 1 11 11 LEU N N 11 119.662 119.662 118.952 0.710 26021 2014 1 4 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.134 -0.056 26021 2015 1 4 . 1 1 11 11 LEU C C 11 177.930 177.930 178.409 -0.479 26021 2016 1 4 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.433 0.123 26021 2017 1 4 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.887 1.201 26021 2018 1 4 . 1 1 11 11 LEU H H 11 7.814 7.814 7.331 0.483 26021 2019 1 4 . 1 1 12 12 ILE N N 12 117.945 117.945 120.332 -2.387 26021 2020 1 4 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.891 -0.199 26021 2021 1 4 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.003 1.626 26021 2022 1 4 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.751 1.659 26021 2023 1 4 . 1 1 12 12 ILE H H 12 7.426 7.426 7.592 -0.166 26021 2024 1 4 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.296 0.107 26021 2025 1 4 . 1 1 13 13 PRO C C 13 179.030 179.030 178.671 0.359 26021 2026 1 4 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.125 0.119 26021 2027 1 4 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.025 -0.216 26021 2028 1 4 . 1 1 14 14 LYS N N 14 117.855 117.855 117.958 -0.103 26021 2029 1 4 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.062 0.083 26021 2030 1 4 . 1 1 14 14 LYS C C 14 178.565 178.565 178.265 0.300 26021 2031 1 4 . 1 1 14 14 LYS CA C 14 59.433 59.433 58.784 0.649 26021 2032 1 4 . 1 1 14 14 LYS CB C 14 32.925 32.925 31.926 0.999 26021 2033 1 4 . 1 1 14 14 LYS H H 14 6.685 6.685 7.514 -0.829 26021 2034 1 4 . 1 1 15 15 LEU N N 15 118.008 118.008 116.980 1.028 26021 2035 1 4 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.362 -0.359 26021 2036 1 4 . 1 1 15 15 LEU C C 15 178.662 178.662 178.888 -0.226 26021 2037 1 4 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.431 1.281 26021 2038 1 4 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.250 -0.251 26021 2039 1 4 . 1 1 15 15 LEU H H 15 8.148 8.148 7.439 0.709 26021 2040 1 4 . 1 1 16 16 GLY N N 16 103.895 103.895 108.400 -4.505 26021 2041 1 4 . 1 1 16 16 GLY C C 16 176.838 176.838 175.484 1.354 26021 2042 1 4 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.014 0.351 26021 2043 1 4 . 1 1 16 16 GLY H H 16 8.104 8.104 7.688 0.416 26021 2044 1 4 . 1 1 17 17 GLU N N 17 121.655 121.655 121.190 0.465 26021 2045 1 4 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.057 0.076 26021 2046 1 4 . 1 1 17 17 GLU C C 17 179.007 179.007 177.395 1.612 26021 2047 1 4 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.058 -0.247 26021 2048 1 4 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.740 -0.607 26021 2049 1 4 . 1 1 17 17 GLU H H 17 7.817 7.817 7.663 0.154 26021 2050 1 4 . 1 1 18 18 LEU N N 18 117.834 117.834 116.802 1.032 26021 2051 1 4 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.253 -0.135 26021 2052 1 4 . 1 1 18 18 LEU C C 18 177.658 177.658 177.989 -0.331 26021 2053 1 4 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.666 1.363 26021 2054 1 4 . 1 1 18 18 LEU CB C 18 41.670 41.670 42.009 -0.339 26021 2055 1 4 . 1 1 18 18 LEU H H 18 7.389 7.389 7.582 -0.193 26021 2056 1 4 . 1 1 19 19 LEU N N 19 113.694 113.694 116.840 -3.146 26021 2057 1 4 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.191 -0.029 26021 2058 1 4 . 1 1 19 19 LEU C C 19 178.123 178.123 178.524 -0.401 26021 2059 1 4 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.857 -0.005 26021 2060 1 4 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.066 0.153 26021 2061 1 4 . 1 1 19 19 LEU H H 19 7.269 7.269 7.120 0.149 26021 2062 1 4 . 1 1 20 20 VAL N N 20 112.778 112.778 113.381 -0.603 26021 2063 1 4 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.004 0.439 26021 2064 1 4 . 1 1 20 20 VAL C C 20 177.021 177.021 176.884 0.137 26021 2065 1 4 . 1 1 20 20 VAL CA C 20 61.855 61.855 64.661 -2.806 26021 2066 1 4 . 1 1 20 20 VAL CB C 20 32.778 32.778 31.829 0.949 26021 2067 1 4 . 1 1 20 20 VAL H H 20 7.356 7.356 8.154 -0.798 26021 2068 1 4 . 1 1 21 21 GLY N N 21 108.962 108.962 108.688 0.274 26021 2069 1 4 . 1 1 21 21 GLY C C 21 173.813 173.813 174.489 -0.676 26021 2070 1 4 . 1 1 21 21 GLY CA C 21 45.046 45.046 45.074 -0.028 26021 2071 1 4 . 1 1 21 21 GLY H H 21 7.925 7.925 8.130 -0.205 26021 2072 1 4 . 1 1 22 22 GLU N N 22 120.607 120.607 123.708 -3.101 26021 2073 1 4 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.364 -0.086 26021 2074 1 4 . 1 1 22 22 GLU C C 22 175.869 175.869 175.568 0.301 26021 2075 1 4 . 1 1 22 22 GLU CA C 22 56.030 56.030 56.638 -0.608 26021 2076 1 4 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.445 0.236 26021 2077 1 4 . 1 1 22 22 GLU H H 22 8.300 8.300 8.480 -0.180 26021 2078 1 4 . 1 1 23 23 TYR N N 23 120.738 120.738 119.704 1.034 26021 2079 1 4 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.024 -0.467 26021 2080 1 4 . 1 1 23 23 TYR C C 23 175.264 175.264 174.004 1.260 26021 2081 1 4 . 1 1 23 23 TYR CA C 23 57.561 57.561 56.795 0.766 26021 2082 1 4 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.968 -0.722 26021 2083 1 4 . 1 1 23 23 TYR H H 23 7.756 7.756 7.820 -0.064 26021 2084 1 4 . 1 1 24 24 LYS N N 24 122.095 122.095 123.468 -1.373 26021 2085 1 4 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.516 -0.333 26021 2086 1 4 . 1 1 24 24 LYS C C 24 175.742 175.742 174.873 0.869 26021 2087 1 4 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.621 0.497 26021 2088 1 4 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.748 -0.029 26021 2089 1 4 . 1 1 24 24 LYS H H 24 8.692 8.692 8.725 -0.032 26021 2090 1 4 . 1 1 25 25 LEU N N 25 121.123 121.123 121.498 -0.375 26021 2091 1 4 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.650 -0.158 26021 2092 1 4 . 1 1 25 25 LEU C C 25 177.487 177.487 175.960 1.527 26021 2093 1 4 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.498 0.836 26021 2094 1 4 . 1 1 25 25 LEU CB C 25 43.758 43.758 45.137 -1.379 26021 2095 1 4 . 1 1 25 25 LEU H H 25 8.088 8.088 7.577 0.511 26021 2096 1 4 . 1 1 26 26 HIS N N 26 122.993 122.993 119.305 3.688 26021 2097 1 4 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.591 -0.090 26021 2098 1 4 . 1 1 26 26 HIS C C 26 176.716 176.716 175.762 0.954 26021 2099 1 4 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.498 0.699 26021 2100 1 4 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.916 0.441 26021 2101 1 4 . 1 1 26 26 HIS H H 26 8.882 8.882 8.539 0.343 26021 2102 1 4 . 1 1 27 27 LYS N N 27 124.894 124.894 121.458 3.436 26021 2103 1 4 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.247 -0.299 26021 2104 1 4 . 1 1 27 27 LYS C C 27 178.873 178.873 179.035 -0.162 26021 2105 1 4 . 1 1 27 27 LYS CA C 27 60.011 60.011 59.283 0.728 26021 2106 1 4 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.477 -0.035 26021 2107 1 4 . 1 1 27 27 LYS H H 27 8.699 8.699 7.794 0.905 26021 2108 1 4 . 1 1 28 28 GLY N N 28 111.258 111.258 107.537 3.721 26021 2109 1 4 . 1 1 28 28 GLY C C 28 176.131 176.131 176.124 0.007 26021 2110 1 4 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.894 -0.404 26021 2111 1 4 . 1 1 28 28 GLY H H 28 9.814 9.814 8.197 1.617 26021 2112 1 4 . 1 1 29 29 VAL N N 29 122.719 122.719 121.614 1.105 26021 2113 1 4 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.582 0.310 26021 2114 1 4 . 1 1 29 29 VAL C C 29 177.628 177.628 177.501 0.127 26021 2115 1 4 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.715 -0.195 26021 2116 1 4 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.122 0.620 26021 2117 1 4 . 1 1 29 29 VAL H H 29 7.431 7.431 7.816 -0.385 26021 2118 1 4 . 1 1 30 30 LYS N N 30 119.791 119.791 118.939 0.852 26021 2119 1 4 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.846 -0.211 26021 2120 1 4 . 1 1 30 30 LYS C C 30 177.666 177.666 178.496 -0.830 26021 2121 1 4 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.474 1.550 26021 2122 1 4 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.922 0.483 26021 2123 1 4 . 1 1 30 30 LYS H H 30 8.255 8.255 8.194 0.061 26021 2124 1 4 . 1 1 31 31 LYS N N 31 117.918 117.918 116.715 1.203 26021 2125 1 4 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.101 0.015 26021 2126 1 4 . 1 1 31 31 LYS C C 31 177.784 177.784 178.456 -0.672 26021 2127 1 4 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.337 -0.634 26021 2128 1 4 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.530 0.315 26021 2129 1 4 . 1 1 31 31 LYS H H 31 7.689 7.689 7.928 -0.239 26021 2130 1 4 . 1 1 32 32 ASN N N 32 116.347 116.347 118.405 -2.058 26021 2131 1 4 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.234 0.286 26021 2132 1 4 . 1 1 32 32 ASN C C 32 177.764 177.764 177.024 0.740 26021 2133 1 4 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.409 0.906 26021 2134 1 4 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.633 -0.001 26021 2135 1 4 . 1 1 32 32 ASN H H 32 7.556 7.556 7.509 0.047 26021 2136 1 4 . 1 1 33 33 ILE N N 33 120.592 120.592 120.242 0.350 26021 2137 1 4 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.631 -0.349 26021 2138 1 4 . 1 1 33 33 ILE C C 33 177.074 177.074 177.858 -0.784 26021 2139 1 4 . 1 1 33 33 ILE CA C 33 65.888 65.888 64.101 1.787 26021 2140 1 4 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.880 0.298 26021 2141 1 4 . 1 1 33 33 ILE H H 33 8.236 8.236 7.533 0.703 26021 2142 1 4 . 1 1 34 34 GLU N N 34 120.595 120.595 119.262 1.333 26021 2143 1 4 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.873 -0.085 26021 2144 1 4 . 1 1 34 34 GLU C C 34 179.739 179.739 178.971 0.768 26021 2145 1 4 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.721 0.518 26021 2146 1 4 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.839 1.006 26021 2147 1 4 . 1 1 34 34 GLU H H 34 8.551 8.551 8.690 -0.139 26021 2148 1 4 . 1 1 35 35 ASP N N 35 120.600 120.600 119.979 0.621 26021 2149 1 4 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.552 -0.140 26021 2150 1 4 . 1 1 35 35 ASP C C 35 178.681 178.681 178.428 0.253 26021 2151 1 4 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.744 0.718 26021 2152 1 4 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.711 -0.961 26021 2153 1 4 . 1 1 35 35 ASP H H 35 8.670 8.670 7.686 0.984 26021 2154 1 4 . 1 1 36 36 LEU N N 36 123.004 123.004 121.262 1.742 26021 2155 1 4 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.589 -0.494 26021 2156 1 4 . 1 1 36 36 LEU C C 36 178.035 178.035 179.104 -1.069 26021 2157 1 4 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.721 0.307 26021 2158 1 4 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.388 -0.512 26021 2159 1 4 . 1 1 36 36 LEU H H 36 8.166 8.166 7.737 0.429 26021 2160 1 4 . 1 1 37 37 LEU N N 37 120.178 120.178 120.478 -0.300 26021 2161 1 4 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.036 -0.180 26021 2162 1 4 . 1 1 37 37 LEU C C 37 178.128 178.128 178.095 0.033 26021 2163 1 4 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.878 0.797 26021 2164 1 4 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.571 0.584 26021 2165 1 4 . 1 1 37 37 LEU H H 37 8.736 8.736 8.279 0.457 26021 2166 1 4 . 1 1 38 38 LYS N N 38 118.110 118.110 119.316 -1.206 26021 2167 1 4 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.908 0.025 26021 2168 1 4 . 1 1 38 38 LYS C C 38 179.533 179.533 178.932 0.601 26021 2169 1 4 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.919 0.354 26021 2170 1 4 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.260 0.017 26021 2171 1 4 . 1 1 38 38 LYS H H 38 7.770 7.770 7.761 0.009 26021 2172 1 4 . 1 1 39 39 GLU N N 39 119.265 119.265 119.518 -0.253 26021 2173 1 4 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.121 0.181 26021 2174 1 4 . 1 1 39 39 GLU C C 39 179.720 179.720 179.003 0.717 26021 2175 1 4 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.233 -0.475 26021 2176 1 4 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.735 -0.145 26021 2177 1 4 . 1 1 39 39 GLU H H 39 7.709 7.709 7.583 0.126 26021 2178 1 4 . 1 1 40 40 LEU N N 40 119.007 119.007 119.975 -0.968 26021 2179 1 4 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.202 -0.152 26021 2180 1 4 . 1 1 40 40 LEU C C 40 179.690 179.690 179.071 0.619 26021 2181 1 4 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.207 0.444 26021 2182 1 4 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.824 0.861 26021 2183 1 4 . 1 1 40 40 LEU H H 40 8.851 8.851 8.137 0.714 26021 2184 1 4 . 1 1 41 41 LYS N N 41 120.500 120.500 118.445 2.055 26021 2185 1 4 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.088 -0.136 26021 2186 1 4 . 1 1 41 41 LYS C C 41 180.223 180.223 178.947 1.276 26021 2187 1 4 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.759 1.132 26021 2188 1 4 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.146 -0.079 26021 2189 1 4 . 1 1 41 41 LYS H H 41 8.482 8.482 8.417 0.065 26021 2190 1 4 . 1 1 42 42 THR N N 42 119.555 119.555 112.217 7.338 26021 2191 1 4 . 1 1 42 42 THR HA H 42 4.000 4.000 4.182 -0.182 26021 2192 1 4 . 1 1 42 42 THR C C 42 176.633 176.633 176.652 -0.019 26021 2193 1 4 . 1 1 42 42 THR CA C 42 66.574 66.574 65.397 1.177 26021 2194 1 4 . 1 1 42 42 THR CB C 42 67.924 67.924 68.900 -0.976 26021 2195 1 4 . 1 1 42 42 THR H H 42 7.863 7.863 7.415 0.448 26021 2196 1 4 . 1 1 43 43 MET N N 43 122.839 122.839 121.695 1.144 26021 2197 1 4 . 1 1 43 43 MET HA H 43 4.022 4.022 4.017 0.005 26021 2198 1 4 . 1 1 43 43 MET C C 43 177.290 177.290 177.920 -0.630 26021 2199 1 4 . 1 1 43 43 MET CA C 43 59.731 59.731 60.391 -0.660 26021 2200 1 4 . 1 1 43 43 MET CB C 43 33.610 33.610 32.379 1.231 26021 2201 1 4 . 1 1 43 43 MET H H 43 8.714 8.714 8.013 0.701 26021 2202 1 4 . 1 1 44 44 ASN N N 44 118.049 118.049 117.672 0.377 26021 2203 1 4 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.275 0.099 26021 2204 1 4 . 1 1 44 44 ASN C C 44 176.297 176.297 177.264 -0.967 26021 2205 1 4 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.478 0.416 26021 2206 1 4 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.873 0.533 26021 2207 1 4 . 1 1 44 44 ASN H H 44 8.988 8.988 8.366 0.622 26021 2208 1 4 . 1 1 45 45 ALA N N 45 119.260 119.260 121.518 -2.258 26021 2209 1 4 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.194 -0.128 26021 2210 1 4 . 1 1 45 45 ALA C C 45 180.476 180.476 179.197 1.279 26021 2211 1 4 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.377 0.891 26021 2212 1 4 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.341 -0.653 26021 2213 1 4 . 1 1 45 45 ALA H H 45 7.675 7.675 7.475 0.200 26021 2214 1 4 . 1 1 46 46 ALA N N 46 121.126 121.126 123.425 -2.299 26021 2215 1 4 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.253 -0.137 26021 2216 1 4 . 1 1 46 46 ALA C C 46 179.314 179.314 179.195 0.119 26021 2217 1 4 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.057 -0.071 26021 2218 1 4 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.791 -0.569 26021 2219 1 4 . 1 1 46 46 ALA H H 46 7.872 7.872 7.864 0.008 26021 2220 1 4 . 1 1 47 47 LEU N N 47 119.328 119.328 115.991 3.337 26021 2221 1 4 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.845 0.346 26021 2222 1 4 . 1 1 47 47 LEU C C 47 180.403 180.403 178.254 2.149 26021 2223 1 4 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.116 -0.070 26021 2224 1 4 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.415 0.535 26021 2225 1 4 . 1 1 47 47 LEU H H 47 8.529 8.529 7.801 0.728 26021 2226 1 4 . 1 1 48 48 ILE N N 48 121.653 121.653 118.118 3.535 26021 2227 1 4 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.695 0.007 26021 2228 1 4 . 1 1 48 48 ILE C C 48 178.730 178.730 178.376 0.354 26021 2229 1 4 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.859 0.051 26021 2230 1 4 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.550 0.362 26021 2231 1 4 . 1 1 48 48 ILE H H 48 8.386 8.386 7.146 1.240 26021 2232 1 4 . 1 1 49 49 LYS N N 49 119.896 119.896 119.566 0.330 26021 2233 1 4 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.115 -0.072 26021 2234 1 4 . 1 1 49 49 LYS C C 49 179.999 179.999 179.021 0.978 26021 2235 1 4 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.431 -0.374 26021 2236 1 4 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.622 -0.661 26021 2237 1 4 . 1 1 49 49 LYS H H 49 7.456 7.456 7.450 0.006 26021 2238 1 4 . 1 1 50 50 ILE N N 50 119.964 119.964 114.903 5.061 26021 2239 1 4 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.093 -0.357 26021 2240 1 4 . 1 1 50 50 ILE C C 50 177.960 177.960 177.455 0.505 26021 2241 1 4 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.958 0.391 26021 2242 1 4 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.713 0.419 26021 2243 1 4 . 1 1 50 50 ILE H H 50 8.154 8.154 8.530 -0.376 26021 2244 1 4 . 1 1 51 51 GLY N N 51 106.709 106.709 107.662 -0.953 26021 2245 1 4 . 1 1 51 51 GLY C C 51 174.461 174.461 174.880 -0.419 26021 2246 1 4 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.456 0.452 26021 2247 1 4 . 1 1 51 51 GLY H H 51 7.932 7.932 7.707 0.225 26021 2248 1 4 . 1 1 52 52 GLU N N 52 118.736 118.736 119.567 -0.831 26021 2249 1 4 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.193 0.127 26021 2250 1 4 . 1 1 52 52 GLU C C 52 176.789 176.789 177.231 -0.442 26021 2251 1 4 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.519 -1.245 26021 2252 1 4 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.115 -0.003 26021 2253 1 4 . 1 1 52 52 GLU H H 52 7.597 7.597 7.488 0.109 26021 2254 1 4 . 1 1 53 53 VAL N N 53 122.982 122.982 118.785 4.197 26021 2255 1 4 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.138 0.123 26021 2256 1 4 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.111 1.274 26021 2257 1 4 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.685 2.137 26021 2258 1 4 . 1 1 53 53 VAL H H 53 7.511 7.511 7.426 0.085 26021 2259 1 4 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.785 -0.140 26021 2260 1 4 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.546 0.032 26021 2261 1 4 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.032 0.503 26021 2262 1 4 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.328 -0.137 26021 2263 1 4 . 1 1 55 55 PRO C C 55 178.258 178.258 176.836 1.422 26021 2264 1 4 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.311 1.117 26021 2265 1 4 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.993 -0.147 26021 2266 1 4 . 1 1 56 56 ASP N N 56 114.117 114.117 116.438 -2.321 26021 2267 1 4 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.507 -0.016 26021 2268 1 4 . 1 1 56 56 ASP C C 56 176.696 176.696 177.592 -0.896 26021 2269 1 4 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.897 -0.759 26021 2270 1 4 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.959 -1.233 26021 2271 1 4 . 1 1 56 56 ASP H H 56 8.489 8.489 8.323 0.166 26021 2272 1 4 . 1 1 57 57 GLN N N 57 117.641 117.641 116.621 1.020 26021 2273 1 4 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.377 -0.003 26021 2274 1 4 . 1 1 57 57 GLN C C 57 175.765 175.765 177.018 -1.253 26021 2275 1 4 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.403 -0.113 26021 2276 1 4 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.952 -0.306 26021 2277 1 4 . 1 1 57 57 GLN H H 57 8.206 8.206 7.518 0.688 26021 2278 1 4 . 1 1 58 58 LEU N N 58 122.141 122.141 122.499 -0.358 26021 2279 1 4 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.132 0.318 26021 2280 1 4 . 1 1 58 58 LEU C C 58 176.849 176.849 176.246 0.603 26021 2281 1 4 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.673 -0.678 26021 2282 1 4 . 1 1 58 58 LEU CB C 58 43.231 43.231 41.903 1.328 26021 2283 1 4 . 1 1 58 58 LEU H H 58 7.152 7.152 7.663 -0.511 26021 2284 1 4 . 1 1 59 59 ASP N N 59 125.643 125.643 121.858 3.785 26021 2285 1 4 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.782 -0.063 26021 2286 1 4 . 1 1 59 59 ASP C C 59 177.249 177.249 176.769 0.480 26021 2287 1 4 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.431 0.972 26021 2288 1 4 . 1 1 59 59 ASP CB C 59 42.232 42.232 42.538 -0.306 26021 2289 1 4 . 1 1 59 59 ASP H H 59 9.312 9.312 8.123 1.189 26021 2290 1 4 . 1 1 60 60 SER N N 60 116.550 116.550 114.180 2.370 26021 2291 1 4 . 1 1 60 60 SER HA H 60 4.124 4.124 4.222 -0.098 26021 2292 1 4 . 1 1 60 60 SER C C 60 176.840 176.840 176.491 0.349 26021 2293 1 4 . 1 1 60 60 SER CA C 60 61.722 61.722 61.537 0.185 26021 2294 1 4 . 1 1 60 60 SER CB C 60 62.815 62.815 63.094 -0.279 26021 2295 1 4 . 1 1 60 60 SER H H 60 8.647 8.647 8.589 0.058 26021 2296 1 4 . 1 1 61 61 GLN N N 61 121.394 121.394 120.228 1.166 26021 2297 1 4 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.207 -0.076 26021 2298 1 4 . 1 1 61 61 GLN C C 61 178.629 178.629 177.680 0.949 26021 2299 1 4 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.484 0.269 26021 2300 1 4 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.741 -0.488 26021 2301 1 4 . 1 1 61 61 GLN H H 61 8.453 8.453 7.828 0.625 26021 2302 1 4 . 1 1 62 62 ASP N N 62 122.187 122.187 120.246 1.941 26021 2303 1 4 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.541 0.078 26021 2304 1 4 . 1 1 62 62 ASP C C 62 178.318 178.318 178.476 -0.158 26021 2305 1 4 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.440 0.022 26021 2306 1 4 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.872 0.164 26021 2307 1 4 . 1 1 62 62 ASP H H 62 8.311 8.311 8.257 0.054 26021 2308 1 4 . 1 1 63 63 LYS N N 63 120.325 120.325 118.283 2.042 26021 2309 1 4 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.122 -0.113 26021 2310 1 4 . 1 1 63 63 LYS C C 63 178.765 178.765 179.273 -0.508 26021 2311 1 4 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.534 1.219 26021 2312 1 4 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.087 0.367 26021 2313 1 4 . 1 1 63 63 LYS H H 63 7.923 7.923 7.638 0.285 26021 2314 1 4 . 1 1 64 64 LEU N N 64 119.491 119.491 119.737 -0.246 26021 2315 1 4 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.147 0.079 26021 2316 1 4 . 1 1 64 64 LEU C C 64 179.526 179.526 178.719 0.807 26021 2317 1 4 . 1 1 64 64 LEU CA C 64 57.798 57.798 58.042 -0.244 26021 2318 1 4 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.724 0.051 26021 2319 1 4 . 1 1 64 64 LEU H H 64 7.820 7.820 7.346 0.474 26021 2320 1 4 . 1 1 65 65 TRP N N 65 120.674 120.674 121.778 -1.104 26021 2321 1 4 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.212 0.096 26021 2322 1 4 . 1 1 65 65 TRP C C 65 177.379 177.379 177.551 -0.172 26021 2323 1 4 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.052 1.750 26021 2324 1 4 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.752 -0.341 26021 2325 1 4 . 1 1 65 65 TRP H H 65 8.196 8.196 7.851 0.345 26021 2326 1 4 . 1 1 66 66 ALA N N 66 120.606 120.606 119.648 0.958 26021 2327 1 4 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.533 0.176 26021 2328 1 4 . 1 1 66 66 ALA C C 66 180.376 180.376 179.128 1.248 26021 2329 1 4 . 1 1 66 66 ALA CA C 66 55.564 55.564 55.270 0.294 26021 2330 1 4 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.782 -0.128 26021 2331 1 4 . 1 1 66 66 ALA H H 66 8.305 8.305 7.725 0.580 26021 2332 1 4 . 1 1 67 67 ASP N N 67 119.175 119.175 117.990 1.185 26021 2333 1 4 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.392 0.058 26021 2334 1 4 . 1 1 67 67 ASP C C 67 178.757 178.757 178.144 0.613 26021 2335 1 4 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.886 0.606 26021 2336 1 4 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.846 -0.693 26021 2337 1 4 . 1 1 67 67 ASP H H 67 7.945 7.945 7.529 0.416 26021 2338 1 4 . 1 1 68 68 GLU N N 68 122.322 122.322 119.650 2.672 26021 2339 1 4 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.233 -0.218 26021 2340 1 4 . 1 1 68 68 GLU C C 68 180.055 180.055 179.359 0.696 26021 2341 1 4 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.494 0.616 26021 2342 1 4 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.842 -0.195 26021 2343 1 4 . 1 1 68 68 GLU H H 68 8.168 8.168 7.808 0.360 26021 2344 1 4 . 1 1 69 69 VAL N N 69 122.135 122.135 118.245 3.890 26021 2345 1 4 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.804 -0.552 26021 2346 1 4 . 1 1 69 69 VAL C C 69 177.736 177.736 177.732 0.004 26021 2347 1 4 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.967 0.572 26021 2348 1 4 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.303 -0.061 26021 2349 1 4 . 1 1 69 69 VAL H H 69 8.424 8.424 7.699 0.725 26021 2350 1 4 . 1 1 70 70 ARG N N 70 121.373 121.373 119.680 1.693 26021 2351 1 4 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.025 -0.333 26021 2352 1 4 . 1 1 70 70 ARG C C 70 179.117 179.117 178.898 0.219 26021 2353 1 4 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.024 1.141 26021 2354 1 4 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.862 -0.208 26021 2355 1 4 . 1 1 70 70 ARG H H 70 7.916 7.916 7.428 0.488 26021 2356 1 4 . 1 1 71 71 GLU N N 71 119.075 119.075 119.314 -0.239 26021 2357 1 4 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.036 0.027 26021 2358 1 4 . 1 1 71 71 GLU C C 71 179.119 179.119 179.183 -0.064 26021 2359 1 4 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.013 0.674 26021 2360 1 4 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.711 0.559 26021 2361 1 4 . 1 1 71 71 GLU H H 71 8.031 8.031 8.437 -0.406 26021 2362 1 4 . 1 1 72 72 LEU N N 72 120.503 120.503 121.175 -0.672 26021 2363 1 4 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.145 -0.088 26021 2364 1 4 . 1 1 72 72 LEU C C 72 178.734 178.734 178.896 -0.162 26021 2365 1 4 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.031 0.391 26021 2366 1 4 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.140 0.268 26021 2367 1 4 . 1 1 72 72 LEU H H 72 8.175 8.175 7.632 0.543 26021 2368 1 4 . 1 1 73 73 SER N N 73 115.243 115.243 115.649 -0.406 26021 2369 1 4 . 1 1 73 73 SER HA H 73 3.824 3.824 4.074 -0.250 26021 2370 1 4 . 1 1 73 73 SER C C 73 175.697 175.697 176.348 -0.651 26021 2371 1 4 . 1 1 73 73 SER CA C 73 62.384 62.384 61.354 1.030 26021 2372 1 4 . 1 1 73 73 SER CB C 73 62.093 62.093 62.799 -0.706 26021 2373 1 4 . 1 1 73 73 SER H H 73 8.411 8.411 8.219 0.192 26021 2374 1 4 . 1 1 74 74 TYR N N 74 121.342 121.342 122.387 -1.045 26021 2375 1 4 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.211 0.280 26021 2376 1 4 . 1 1 74 74 TYR C C 74 178.747 178.747 176.991 1.756 26021 2377 1 4 . 1 1 74 74 TYR CA C 74 60.435 60.435 61.153 -0.718 26021 2378 1 4 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.523 -1.016 26021 2379 1 4 . 1 1 74 74 TYR H H 74 7.314 7.314 7.772 -0.458 26021 2380 1 4 . 1 1 75 75 VAL N N 75 120.779 120.779 117.063 3.716 26021 2381 1 4 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.748 0.113 26021 2382 1 4 . 1 1 75 75 VAL C C 75 179.788 179.788 177.881 1.907 26021 2383 1 4 . 1 1 75 75 VAL CA C 75 66.048 66.048 64.232 1.816 26021 2384 1 4 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.398 0.316 26021 2385 1 4 . 1 1 75 75 VAL H H 75 7.740 7.740 7.936 -0.196 26021 2386 1 4 . 1 1 76 76 ILE N N 76 120.598 120.598 120.878 -0.280 26021 2387 1 4 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.666 0.034 26021 2388 1 4 . 1 1 76 76 ILE C C 76 177.066 177.066 177.994 -0.928 26021 2389 1 4 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.757 1.162 26021 2390 1 4 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.374 0.011 26021 2391 1 4 . 1 1 76 76 ILE H H 76 8.584 8.584 7.705 0.879 26021 2392 1 4 . 1 1 77 77 GLU N N 77 120.468 120.468 120.402 0.066 26021 2393 1 4 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.878 -0.229 26021 2394 1 4 . 1 1 77 77 GLU C C 77 177.502 177.502 178.269 -0.767 26021 2395 1 4 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.747 1.115 26021 2396 1 4 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.852 0.500 26021 2397 1 4 . 1 1 77 77 GLU H H 77 8.445 8.445 7.819 0.626 26021 2398 1 4 . 1 1 78 78 ASP N N 78 117.382 117.382 119.293 -1.911 26021 2399 1 4 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.362 0.029 26021 2400 1 4 . 1 1 78 78 ASP C C 78 177.382 177.382 178.065 -0.683 26021 2401 1 4 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.954 0.541 26021 2402 1 4 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.739 1.196 26021 2403 1 4 . 1 1 78 78 ASP H H 78 7.885 7.885 7.646 0.239 26021 2404 1 4 . 1 1 79 79 ALA N N 79 120.171 120.171 121.697 -1.526 26021 2405 1 4 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.077 -0.027 26021 2406 1 4 . 1 1 79 79 ALA C C 79 181.193 181.193 179.394 1.799 26021 2407 1 4 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.050 0.005 26021 2408 1 4 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.146 0.274 26021 2409 1 4 . 1 1 79 79 ALA H H 79 7.754 7.754 8.001 -0.247 26021 2410 1 4 . 1 1 80 80 VAL N N 80 119.541 119.541 111.650 7.891 26021 2411 1 4 . 1 1 80 80 VAL HA H 80 3.677 3.677 4.056 -0.379 26021 2412 1 4 . 1 1 80 80 VAL C C 80 177.096 177.096 177.687 -0.591 26021 2413 1 4 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.104 2.980 26021 2414 1 4 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.838 -0.395 26021 2415 1 4 . 1 1 80 80 VAL H H 80 8.635 8.635 7.297 1.338 26021 2416 1 4 . 1 1 81 81 ASP N N 81 121.140 121.140 121.577 -0.437 26021 2417 1 4 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.426 0.043 26021 2418 1 4 . 1 1 81 81 ASP C C 81 179.569 179.569 178.385 1.184 26021 2419 1 4 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.008 0.921 26021 2420 1 4 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.764 -0.828 26021 2421 1 4 . 1 1 81 81 ASP H H 81 8.575 8.575 8.587 -0.012 26021 2422 1 4 . 1 1 82 82 LYS N N 82 118.159 118.159 119.736 -1.577 26021 2423 1 4 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.069 -0.048 26021 2424 1 4 . 1 1 82 82 LYS C C 82 178.890 178.890 178.948 -0.058 26021 2425 1 4 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.505 0.562 26021 2426 1 4 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.216 0.371 26021 2427 1 4 . 1 1 82 82 LYS H H 82 8.079 8.079 8.125 -0.046 26021 2428 1 4 . 1 1 83 83 PHE N N 83 120.900 120.900 119.398 1.502 26021 2429 1 4 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.379 -0.103 26021 2430 1 4 . 1 1 83 83 PHE C C 83 177.269 177.269 176.631 0.638 26021 2431 1 4 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.526 0.417 26021 2432 1 4 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.491 0.256 26021 2433 1 4 . 1 1 83 83 PHE H H 83 8.015 8.015 7.595 0.420 26021 2434 1 4 . 1 1 84 84 LEU N N 84 118.209 118.209 118.927 -0.718 26021 2435 1 4 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.085 -0.143 26021 2436 1 4 . 1 1 84 84 LEU C C 84 178.774 178.774 177.780 0.994 26021 2437 1 4 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.184 0.986 26021 2438 1 4 . 1 1 84 84 LEU CB C 84 42.193 42.193 40.884 1.309 26021 2439 1 4 . 1 1 84 84 LEU H H 84 8.338 8.338 7.784 0.554 26021 2440 1 4 . 1 1 85 85 VAL N N 85 116.078 116.078 120.142 -4.064 26021 2441 1 4 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.659 0.332 26021 2442 1 4 . 1 1 85 85 VAL C C 85 177.252 177.252 177.092 0.160 26021 2443 1 4 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.553 -1.373 26021 2444 1 4 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.344 0.546 26021 2445 1 4 . 1 1 85 85 VAL H H 85 7.447 7.447 7.143 0.304 26021 2446 1 4 . 1 1 86 86 ARG N N 86 120.842 120.842 117.176 3.666 26021 2447 1 4 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.068 0.159 26021 2448 1 4 . 1 1 86 86 ARG C C 86 177.520 177.520 179.079 -1.559 26021 2449 1 4 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.314 -1.255 26021 2450 1 4 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.927 0.336 26021 2451 1 4 . 1 1 86 86 ARG H H 86 7.598 7.598 7.274 0.324 26021 2452 1 4 . 1 1 87 87 VAL N N 87 119.293 119.293 117.118 2.175 26021 2453 1 4 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.826 -0.001 26021 2454 1 4 . 1 1 87 87 VAL C C 87 176.121 176.121 177.717 -1.596 26021 2455 1 4 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.317 -1.879 26021 2456 1 4 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.153 0.619 26021 2457 1 4 . 1 1 87 87 VAL H H 87 7.994 7.994 8.046 -0.052 26021 2458 1 4 . 1 1 88 88 HIS N N 88 120.016 120.016 117.978 2.038 26021 2459 1 4 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.403 0.234 26021 2460 1 4 . 1 1 88 88 HIS C C 88 175.639 175.639 176.185 -0.546 26021 2461 1 4 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.282 0.069 26021 2462 1 4 . 1 1 88 88 HIS CB C 88 29.681 29.681 29.793 -0.112 26021 2463 1 4 . 1 1 88 88 HIS H H 88 7.969 7.969 8.342 -0.373 26021 2464 1 4 . 1 1 89 89 GLY N N 89 109.587 109.587 108.454 1.133 26021 2465 1 4 . 1 1 89 89 GLY C C 89 173.730 173.730 174.211 -0.481 26021 2466 1 4 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.638 -0.469 26021 2467 1 4 . 1 1 89 89 GLY H H 89 8.083 8.083 8.059 0.024 26021 2468 1 4 . 1 1 90 90 VAL N N 90 118.224 118.224 119.506 -1.282 26021 2469 1 4 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.341 -0.203 26021 2470 1 4 . 1 1 90 90 VAL C C 90 176.018 176.018 175.213 0.805 26021 2471 1 4 . 1 1 90 90 VAL CA C 90 62.425 62.425 61.221 1.204 26021 2472 1 4 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.283 -0.667 26021 2473 1 4 . 1 1 90 90 VAL H H 90 7.944 7.944 7.378 0.566 26021 2474 1 4 . 1 1 91 91 GLU N N 91 124.313 124.313 127.486 -3.173 26021 2475 1 4 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.504 0.102 26021 2476 1 4 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.628 -0.452 26021 2477 1 4 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.119 0.641 26021 2478 1 4 . 1 1 91 91 GLU H H 91 8.423 8.423 8.432 -0.009 26021 2479 1 4 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.410 -0.073 26021 2480 1 4 . 1 1 92 92 PRO C C 92 176.504 176.504 175.626 0.878 26021 2481 1 4 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.202 0.170 26021 2482 1 4 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.109 0.058 26021 2483 1 4 . 1 1 93 93 ASP N N 93 120.275 120.275 120.032 0.243 26021 2484 1 4 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.784 -0.212 26021 2485 1 4 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.714 0.256 26021 2486 1 4 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.784 -3.269 26021 2487 1 4 . 1 1 93 93 ASP H H 93 8.286 8.286 8.161 0.125 26021 2488 1 4 . 1 1 94 94 ASP N N 94 121.181 121.181 118.999 2.182 26021 2489 1 4 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.631 -0.066 26021 2490 1 4 . 1 1 94 94 ASP C C 94 176.474 176.474 177.404 -0.930 26021 2491 1 4 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.327 -0.954 26021 2492 1 4 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.699 -0.474 26021 2493 1 4 . 1 1 94 94 ASP H H 94 8.259 8.259 8.542 -0.283 26021 2494 1 4 . 1 1 95 95 ASN N N 95 118.728 118.728 118.758 -0.030 26021 2495 1 4 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.722 -0.028 26021 2496 1 4 . 1 1 95 95 ASN C C 95 176.272 176.272 177.240 -0.968 26021 2497 1 4 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.095 -1.109 26021 2498 1 4 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.036 0.693 26021 2499 1 4 . 1 1 95 95 ASN H H 95 8.474 8.474 8.646 -0.172 26021 2500 1 4 . 1 1 96 96 THR N N 96 113.868 113.868 113.134 0.734 26021 2501 1 4 . 1 1 96 96 THR HA H 96 4.220 4.220 4.054 0.166 26021 2502 1 4 . 1 1 96 96 THR C C 96 175.107 175.107 175.987 -0.880 26021 2503 1 4 . 1 1 96 96 THR CA C 96 63.200 63.200 65.312 -2.112 26021 2504 1 4 . 1 1 96 96 THR CB C 96 69.475 69.475 68.120 1.355 26021 2505 1 4 . 1 1 96 96 THR H H 96 8.263 8.263 8.336 -0.073 26021 2506 1 4 . 1 1 97 97 ASN N N 97 119.954 119.954 119.746 0.208 26021 2507 1 4 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.458 0.158 26021 2508 1 4 . 1 1 97 97 ASN C C 97 176.275 176.275 176.292 -0.017 26021 2509 1 4 . 1 1 97 97 ASN CA C 97 53.956 53.956 55.523 -1.567 26021 2510 1 4 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.702 -0.010 26021 2511 1 4 . 1 1 97 97 ASN H H 97 8.431 8.431 7.680 0.751 26021 2512 1 4 . 1 1 98 98 GLY N N 98 108.847 108.847 107.096 1.751 26021 2513 1 4 . 1 1 98 98 GLY C C 98 175.533 175.533 175.387 0.146 26021 2514 1 4 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.080 -0.068 26021 2515 1 4 . 1 1 98 98 GLY H H 98 8.338 8.338 8.306 0.032 26021 2516 1 4 . 1 1 99 99 PHE N N 99 118.492 118.492 119.942 -1.450 26021 2517 1 4 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.114 0.134 26021 2518 1 4 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.687 1.272 26021 2519 1 4 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.066 -0.907 26021 2520 1 4 . 1 1 99 99 PHE H H 99 8.370 8.370 8.448 -0.078 26021 2521 1 4 . 1 1 100 100 LYS N N 100 120.987 120.987 120.036 0.951 26021 2522 1 4 . 1 1 100 100 LYS H H 100 8.256 8.256 8.399 -0.143 26021 2523 1 4 . 1 1 101 101 GLY N N 101 108.186 108.186 106.561 1.625 26021 2524 1 4 . 1 1 101 101 GLY C C 101 177.075 177.075 176.122 0.953 26021 2525 1 4 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.322 0.580 26021 2526 1 4 . 1 1 101 101 GLY H H 101 8.300 8.300 7.717 0.583 26021 2527 1 4 . 1 1 102 102 LEU N N 102 121.439 121.439 123.815 -2.376 26021 2528 1 4 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.118 -0.021 26021 2529 1 4 . 1 1 102 102 LEU C C 102 179.836 179.836 178.227 1.609 26021 2530 1 4 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.586 -0.228 26021 2531 1 4 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.978 -0.208 26021 2532 1 4 . 1 1 102 102 LEU H H 102 7.777 7.777 8.173 -0.396 26021 2533 1 4 . 1 1 103 103 MET N N 103 122.290 122.290 117.456 4.834 26021 2534 1 4 . 1 1 103 103 MET HA H 103 4.220 4.220 3.986 0.234 26021 2535 1 4 . 1 1 103 103 MET C C 103 177.739 177.739 177.967 -0.228 26021 2536 1 4 . 1 1 103 103 MET CA C 103 58.739 58.739 58.038 0.701 26021 2537 1 4 . 1 1 103 103 MET CB C 103 31.895 31.895 31.834 0.061 26021 2538 1 4 . 1 1 103 103 MET H H 103 8.409 8.409 8.137 0.272 26021 2539 1 4 . 1 1 104 104 LYS N N 104 119.750 119.750 117.941 1.809 26021 2540 1 4 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.071 -0.004 26021 2541 1 4 . 1 1 104 104 LYS C C 104 179.301 179.301 179.552 -0.251 26021 2542 1 4 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.350 1.414 26021 2543 1 4 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.819 0.228 26021 2544 1 4 . 1 1 104 104 LYS H H 104 7.916 7.916 7.409 0.507 26021 2545 1 4 . 1 1 105 105 ARG N N 105 117.967 117.967 119.211 -1.244 26021 2546 1 4 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.088 -0.062 26021 2547 1 4 . 1 1 105 105 ARG C C 105 178.777 178.777 178.581 0.196 26021 2548 1 4 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.817 -0.453 26021 2549 1 4 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.447 0.550 26021 2550 1 4 . 1 1 105 105 ARG H H 105 7.719 7.719 8.234 -0.515 26021 2551 1 4 . 1 1 106 106 THR N N 106 117.211 117.211 112.504 4.707 26021 2552 1 4 . 1 1 106 106 THR HA H 106 4.301 4.301 4.140 0.161 26021 2553 1 4 . 1 1 106 106 THR C C 106 176.254 176.254 176.254 0.000 26021 2554 1 4 . 1 1 106 106 THR CA C 106 67.860 67.860 65.966 1.893 26021 2555 1 4 . 1 1 106 106 THR CB C 106 67.860 67.860 68.731 -0.871 26021 2556 1 4 . 1 1 106 106 THR H H 106 8.152 8.152 8.224 -0.072 26021 2557 1 4 . 1 1 107 107 THR N N 107 117.939 117.939 115.968 1.971 26021 2558 1 4 . 1 1 107 107 THR HA H 107 3.971 3.971 3.952 0.019 26021 2559 1 4 . 1 1 107 107 THR C C 107 176.780 176.780 176.247 0.533 26021 2560 1 4 . 1 1 107 107 THR CA C 107 66.822 66.822 65.934 0.888 26021 2561 1 4 . 1 1 107 107 THR CB C 107 68.818 68.818 68.641 0.177 26021 2562 1 4 . 1 1 107 107 THR H H 107 8.651 8.651 7.695 0.956 26021 2563 1 4 . 1 1 108 108 LYS N N 108 120.867 120.867 120.121 0.746 26021 2564 1 4 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.039 -0.017 26021 2565 1 4 . 1 1 108 108 LYS C C 108 179.045 179.045 179.273 -0.228 26021 2566 1 4 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.081 0.753 26021 2567 1 4 . 1 1 108 108 LYS CB C 108 32.473 32.473 31.882 0.591 26021 2568 1 4 . 1 1 108 108 LYS H H 108 7.694 7.694 7.591 0.103 26021 2569 1 4 . 1 1 109 109 LEU N N 109 119.472 119.472 119.551 -0.079 26021 2570 1 4 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.209 0.112 26021 2571 1 4 . 1 1 109 109 LEU C C 109 179.974 179.974 179.005 0.969 26021 2572 1 4 . 1 1 109 109 LEU CA C 109 57.593 57.593 56.809 0.784 26021 2573 1 4 . 1 1 109 109 LEU CB C 109 41.860 41.860 41.399 0.461 26021 2574 1 4 . 1 1 109 109 LEU H H 109 7.559 7.559 7.736 -0.177 26021 2575 1 4 . 1 1 110 110 LEU N N 110 121.832 121.832 119.464 2.368 26021 2576 1 4 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.055 0.136 26021 2577 1 4 . 1 1 110 110 LEU C C 110 178.101 178.101 179.076 -0.975 26021 2578 1 4 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.897 -0.005 26021 2579 1 4 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.212 0.672 26021 2580 1 4 . 1 1 110 110 LEU H H 110 8.567 8.567 8.064 0.503 26021 2581 1 4 . 1 1 111 111 LYS N N 111 117.972 117.972 117.134 0.838 26021 2582 1 4 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.120 -0.141 26021 2583 1 4 . 1 1 111 111 LYS C C 111 177.677 177.677 177.747 -0.070 26021 2584 1 4 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.023 0.763 26021 2585 1 4 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.107 0.102 26021 2586 1 4 . 1 1 111 111 LYS H H 111 7.965 7.965 7.882 0.083 26021 2587 1 4 . 1 1 112 112 LYS N N 112 115.433 115.433 118.277 -2.844 26021 2588 1 4 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.070 0.040 26021 2589 1 4 . 1 1 112 112 LYS C C 112 178.270 178.270 178.107 0.163 26021 2590 1 4 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.385 0.567 26021 2591 1 4 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.676 0.115 26021 2592 1 4 . 1 1 112 112 LYS H H 112 7.334 7.334 7.371 -0.037 26021 2593 1 4 . 1 1 113 113 VAL N N 113 114.861 114.861 119.686 -4.825 26021 2594 1 4 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.823 0.008 26021 2595 1 4 . 1 1 113 113 VAL C C 113 176.999 176.999 176.923 0.076 26021 2596 1 4 . 1 1 113 113 VAL CA C 113 63.505 63.505 64.734 -1.229 26021 2597 1 4 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.206 0.081 26021 2598 1 4 . 1 1 113 113 VAL H H 113 7.298 7.298 7.436 -0.138 26021 2599 1 4 . 1 1 114 114 VAL N N 114 121.457 121.457 119.428 2.029 26021 2600 1 4 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.790 -0.068 26021 2601 1 4 . 1 1 114 114 VAL C C 114 177.737 177.737 177.095 0.642 26021 2602 1 4 . 1 1 114 114 VAL CA C 114 65.224 65.224 64.931 0.293 26021 2603 1 4 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.363 0.390 26021 2604 1 4 . 1 1 114 114 VAL H H 114 7.855 7.855 7.617 0.238 26021 2605 1 4 . 1 1 115 115 ASP N N 115 120.804 120.804 120.207 0.597 26021 2606 1 4 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.438 0.017 26021 2607 1 4 . 1 1 115 115 ASP C C 115 177.380 177.380 177.567 -0.187 26021 2608 1 4 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.796 -0.875 26021 2609 1 4 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.968 -0.596 26021 2610 1 4 . 1 1 115 115 ASP H H 115 8.311 8.311 8.514 -0.203 26021 2611 1 4 . 1 1 116 116 LYS N N 116 119.582 119.582 117.961 1.621 26021 2612 1 4 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.342 -0.247 26021 2613 1 4 . 1 1 116 116 LYS C C 116 177.077 177.077 178.721 -1.644 26021 2614 1 4 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.644 0.067 26021 2615 1 4 . 1 1 116 116 LYS CB C 116 33.488 33.488 32.865 0.623 26021 2616 1 4 . 1 1 116 116 LYS H H 116 7.639 7.639 8.002 -0.363 26021 2617 1 4 . 1 1 117 117 HIS N N 117 115.246 115.246 117.184 -1.938 26021 2618 1 4 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.419 0.206 26021 2619 1 4 . 1 1 117 117 HIS C C 117 175.497 175.497 176.594 -1.097 26021 2620 1 4 . 1 1 117 117 HIS CA C 117 56.175 56.175 57.090 -0.915 26021 2621 1 4 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.469 0.006 26021 2622 1 4 . 1 1 117 117 HIS H H 117 8.108 8.108 7.990 0.118 26021 2623 1 4 . 1 1 118 118 GLY N N 118 109.944 109.944 107.723 2.221 26021 2624 1 4 . 1 1 118 118 GLY C C 118 174.093 174.093 174.844 -0.751 26021 2625 1 4 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.568 0.496 26021 2626 1 4 . 1 1 118 118 GLY H H 118 8.153 8.153 7.780 0.373 26021 2627 1 4 . 1 1 119 119 ILE N N 119 118.468 118.468 122.141 -3.673 26021 2628 1 4 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.785 0.337 26021 2629 1 4 . 1 1 119 119 ILE C C 119 174.777 174.777 174.954 -0.177 26021 2630 1 4 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.542 -0.441 26021 2631 1 4 . 1 1 119 119 ILE CB C 119 38.631 38.631 35.492 3.139 26021 2632 1 4 . 1 1 119 119 ILE H H 119 7.828 7.828 7.470 0.358 26021 2633 1 5 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.537 0.212 26021 2634 1 5 . 1 1 4 4 ASN C C 4 175.260 175.260 175.704 -0.444 26021 2635 1 5 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.642 -0.811 26021 2636 1 5 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.284 0.397 26021 2637 1 5 . 1 1 5 5 ALA N N 5 123.648 123.648 121.311 2.337 26021 2638 1 5 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.595 -0.305 26021 2639 1 5 . 1 1 5 5 ALA C C 5 178.256 178.256 178.326 -0.070 26021 2640 1 5 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.552 1.529 26021 2641 1 5 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.902 0.123 26021 2642 1 5 . 1 1 5 5 ALA H H 5 8.520 8.520 8.095 0.425 26021 2643 1 5 . 1 1 6 6 GLY N N 6 107.044 107.044 108.357 -1.313 26021 2644 1 5 . 1 1 6 6 GLY C C 6 174.961 174.961 175.168 -0.207 26021 2645 1 5 . 1 1 6 6 GLY CA C 6 45.830 45.830 47.319 -1.489 26021 2646 1 5 . 1 1 6 6 GLY H H 6 8.350 8.350 7.910 0.440 26021 2647 1 5 . 1 1 7 7 ALA N N 7 123.366 123.366 123.852 -0.486 26021 2648 1 5 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.107 0.109 26021 2649 1 5 . 1 1 7 7 ALA C C 7 179.006 179.006 178.940 0.066 26021 2650 1 5 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.630 -0.927 26021 2651 1 5 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.428 0.416 26021 2652 1 5 . 1 1 7 7 ALA H H 7 8.078 8.078 8.158 -0.080 26021 2653 1 5 . 1 1 8 8 ILE N N 8 117.376 117.376 118.185 -0.809 26021 2654 1 5 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.775 0.005 26021 2655 1 5 . 1 1 8 8 ILE C C 8 177.032 177.032 178.285 -1.253 26021 2656 1 5 . 1 1 8 8 ILE CA C 8 63.158 63.158 63.935 -0.777 26021 2657 1 5 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.115 -1.826 26021 2658 1 5 . 1 1 8 8 ILE H H 8 7.943 7.943 7.503 0.440 26021 2659 1 5 . 1 1 9 9 ALA N N 9 121.414 121.414 123.814 -2.400 26021 2660 1 5 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.100 -0.167 26021 2661 1 5 . 1 1 9 9 ALA C C 9 180.515 180.515 179.167 1.348 26021 2662 1 5 . 1 1 9 9 ALA CA C 9 55.098 55.098 55.147 -0.049 26021 2663 1 5 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.344 -0.183 26021 2664 1 5 . 1 1 9 9 ALA H H 9 8.062 8.062 7.825 0.237 26021 2665 1 5 . 1 1 10 10 LYS N N 10 114.594 114.594 118.203 -3.609 26021 2666 1 5 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.088 0.076 26021 2667 1 5 . 1 1 10 10 LYS C C 10 178.099 178.099 178.192 -0.093 26021 2668 1 5 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.620 -0.780 26021 2669 1 5 . 1 1 10 10 LYS CB C 10 32.469 32.469 31.772 0.697 26021 2670 1 5 . 1 1 10 10 LYS H H 10 7.554 7.554 8.222 -0.668 26021 2671 1 5 . 1 1 11 11 LEU N N 11 119.662 119.662 119.008 0.654 26021 2672 1 5 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.196 -0.118 26021 2673 1 5 . 1 1 11 11 LEU C C 11 177.930 177.930 178.037 -0.107 26021 2674 1 5 . 1 1 11 11 LEU CA C 11 56.556 56.556 55.864 0.692 26021 2675 1 5 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.760 1.328 26021 2676 1 5 . 1 1 11 11 LEU H H 11 7.814 7.814 7.379 0.435 26021 2677 1 5 . 1 1 12 12 ILE N N 12 117.945 117.945 120.541 -2.596 26021 2678 1 5 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.875 -0.183 26021 2679 1 5 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.129 1.500 26021 2680 1 5 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.726 1.684 26021 2681 1 5 . 1 1 12 12 ILE H H 12 7.426 7.426 7.816 -0.390 26021 2682 1 5 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.266 0.137 26021 2683 1 5 . 1 1 13 13 PRO C C 13 179.030 179.030 178.589 0.441 26021 2684 1 5 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.145 0.099 26021 2685 1 5 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.069 -0.260 26021 2686 1 5 . 1 1 14 14 LYS N N 14 117.855 117.855 118.307 -0.452 26021 2687 1 5 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.026 0.119 26021 2688 1 5 . 1 1 14 14 LYS C C 14 178.565 178.565 178.317 0.248 26021 2689 1 5 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.424 0.009 26021 2690 1 5 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.012 0.913 26021 2691 1 5 . 1 1 14 14 LYS H H 14 6.685 6.685 7.362 -0.677 26021 2692 1 5 . 1 1 15 15 LEU N N 15 118.008 118.008 116.230 1.778 26021 2693 1 5 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.377 -0.374 26021 2694 1 5 . 1 1 15 15 LEU C C 15 178.662 178.662 178.907 -0.245 26021 2695 1 5 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.340 1.372 26021 2696 1 5 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.330 -0.331 26021 2697 1 5 . 1 1 15 15 LEU H H 15 8.148 8.148 7.484 0.664 26021 2698 1 5 . 1 1 16 16 GLY N N 16 103.895 103.895 108.430 -4.535 26021 2699 1 5 . 1 1 16 16 GLY C C 16 176.838 176.838 175.722 1.116 26021 2700 1 5 . 1 1 16 16 GLY CA C 16 47.365 47.365 46.861 0.504 26021 2701 1 5 . 1 1 16 16 GLY H H 16 8.104 8.104 7.654 0.450 26021 2702 1 5 . 1 1 17 17 GLU N N 17 121.655 121.655 121.701 -0.046 26021 2703 1 5 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.080 0.053 26021 2704 1 5 . 1 1 17 17 GLU C C 17 179.007 179.007 178.408 0.599 26021 2705 1 5 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.147 -0.336 26021 2706 1 5 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.452 -0.319 26021 2707 1 5 . 1 1 17 17 GLU H H 17 7.817 7.817 7.764 0.053 26021 2708 1 5 . 1 1 18 18 LEU N N 18 117.834 117.834 116.483 1.351 26021 2709 1 5 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.408 -0.290 26021 2710 1 5 . 1 1 18 18 LEU C C 18 177.658 177.658 177.670 -0.012 26021 2711 1 5 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.703 1.326 26021 2712 1 5 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.660 0.010 26021 2713 1 5 . 1 1 18 18 LEU H H 18 7.389 7.389 7.561 -0.172 26021 2714 1 5 . 1 1 19 19 LEU N N 19 113.694 113.694 118.377 -4.683 26021 2715 1 5 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.280 -0.118 26021 2716 1 5 . 1 1 19 19 LEU C C 19 178.123 178.123 178.503 -0.380 26021 2717 1 5 . 1 1 19 19 LEU CA C 19 55.852 55.852 56.465 -0.613 26021 2718 1 5 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.060 0.160 26021 2719 1 5 . 1 1 19 19 LEU H H 19 7.269 7.269 7.566 -0.297 26021 2720 1 5 . 1 1 20 20 VAL N N 20 112.778 112.778 114.844 -2.066 26021 2721 1 5 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.138 0.305 26021 2722 1 5 . 1 1 20 20 VAL C C 20 177.021 177.021 176.318 0.703 26021 2723 1 5 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.246 -1.391 26021 2724 1 5 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.250 0.528 26021 2725 1 5 . 1 1 20 20 VAL H H 20 7.356 7.356 8.029 -0.673 26021 2726 1 5 . 1 1 21 21 GLY N N 21 108.962 108.962 109.210 -0.248 26021 2727 1 5 . 1 1 21 21 GLY C C 21 173.813 173.813 173.681 0.132 26021 2728 1 5 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.620 0.426 26021 2729 1 5 . 1 1 21 21 GLY H H 21 7.925 7.925 8.229 -0.304 26021 2730 1 5 . 1 1 22 22 GLU N N 22 120.607 120.607 122.437 -1.830 26021 2731 1 5 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.601 -0.323 26021 2732 1 5 . 1 1 22 22 GLU C C 22 175.869 175.869 175.168 0.701 26021 2733 1 5 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.032 0.998 26021 2734 1 5 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.482 -0.801 26021 2735 1 5 . 1 1 22 22 GLU H H 22 8.300 8.300 7.995 0.305 26021 2736 1 5 . 1 1 23 23 TYR N N 23 120.738 120.738 120.240 0.498 26021 2737 1 5 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.106 -0.549 26021 2738 1 5 . 1 1 23 23 TYR C C 23 175.264 175.264 174.237 1.027 26021 2739 1 5 . 1 1 23 23 TYR CA C 23 57.561 57.561 56.967 0.594 26021 2740 1 5 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.118 0.128 26021 2741 1 5 . 1 1 23 23 TYR H H 23 7.756 7.756 7.456 0.300 26021 2742 1 5 . 1 1 24 24 LYS N N 24 122.095 122.095 122.382 -0.287 26021 2743 1 5 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.571 -0.388 26021 2744 1 5 . 1 1 24 24 LYS C C 24 175.742 175.742 174.571 1.171 26021 2745 1 5 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.689 0.429 26021 2746 1 5 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.398 0.321 26021 2747 1 5 . 1 1 24 24 LYS H H 24 8.692 8.692 8.564 0.128 26021 2748 1 5 . 1 1 25 25 LEU N N 25 121.123 121.123 120.036 1.087 26021 2749 1 5 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.786 -0.294 26021 2750 1 5 . 1 1 25 25 LEU C C 25 177.487 177.487 176.469 1.018 26021 2751 1 5 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.947 0.387 26021 2752 1 5 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.829 -1.071 26021 2753 1 5 . 1 1 25 25 LEU H H 25 8.088 8.088 7.569 0.519 26021 2754 1 5 . 1 1 26 26 HIS N N 26 122.993 122.993 118.394 4.599 26021 2755 1 5 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.773 -0.272 26021 2756 1 5 . 1 1 26 26 HIS C C 26 176.716 176.716 176.268 0.448 26021 2757 1 5 . 1 1 26 26 HIS CA C 26 57.197 57.197 54.960 2.237 26021 2758 1 5 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.650 0.707 26021 2759 1 5 . 1 1 26 26 HIS H H 26 8.882 8.882 8.632 0.250 26021 2760 1 5 . 1 1 27 27 LYS N N 27 124.894 124.894 119.708 5.186 26021 2761 1 5 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.322 -0.374 26021 2762 1 5 . 1 1 27 27 LYS C C 27 178.873 178.873 178.665 0.208 26021 2763 1 5 . 1 1 27 27 LYS CA C 27 60.011 60.011 59.151 0.860 26021 2764 1 5 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.506 -0.064 26021 2765 1 5 . 1 1 27 27 LYS H H 27 8.699 8.699 8.513 0.186 26021 2766 1 5 . 1 1 28 28 GLY N N 28 111.258 111.258 105.025 6.233 26021 2767 1 5 . 1 1 28 28 GLY C C 28 176.131 176.131 175.185 0.946 26021 2768 1 5 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.409 0.081 26021 2769 1 5 . 1 1 28 28 GLY H H 28 9.814 9.814 8.600 1.214 26021 2770 1 5 . 1 1 29 29 VAL N N 29 122.719 122.719 121.184 1.535 26021 2771 1 5 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.748 0.144 26021 2772 1 5 . 1 1 29 29 VAL C C 29 177.628 177.628 177.647 -0.019 26021 2773 1 5 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.338 0.182 26021 2774 1 5 . 1 1 29 29 VAL CB C 29 31.742 31.742 32.025 -0.283 26021 2775 1 5 . 1 1 29 29 VAL H H 29 7.431 7.431 7.252 0.179 26021 2776 1 5 . 1 1 30 30 LYS N N 30 119.791 119.791 119.791 0.000 26021 2777 1 5 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.670 -0.035 26021 2778 1 5 . 1 1 30 30 LYS C C 30 177.666 177.666 178.166 -0.500 26021 2779 1 5 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.339 1.685 26021 2780 1 5 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.505 0.900 26021 2781 1 5 . 1 1 30 30 LYS H H 30 8.255 8.255 7.590 0.665 26021 2782 1 5 . 1 1 31 31 LYS N N 31 117.918 117.918 118.496 -0.578 26021 2783 1 5 . 1 1 31 31 LYS HA H 31 4.116 4.116 3.914 0.202 26021 2784 1 5 . 1 1 31 31 LYS C C 31 177.784 177.784 178.597 -0.813 26021 2785 1 5 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.450 -0.747 26021 2786 1 5 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.137 -0.292 26021 2787 1 5 . 1 1 31 31 LYS H H 31 7.689 7.689 7.644 0.045 26021 2788 1 5 . 1 1 32 32 ASN N N 32 116.347 116.347 116.406 -0.059 26021 2789 1 5 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.239 0.281 26021 2790 1 5 . 1 1 32 32 ASN C C 32 177.764 177.764 176.983 0.781 26021 2791 1 5 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.599 0.716 26021 2792 1 5 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.285 0.347 26021 2793 1 5 . 1 1 32 32 ASN H H 32 7.556 7.556 7.927 -0.371 26021 2794 1 5 . 1 1 33 33 ILE N N 33 120.592 120.592 120.141 0.451 26021 2795 1 5 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.657 -0.375 26021 2796 1 5 . 1 1 33 33 ILE C C 33 177.074 177.074 177.401 -0.327 26021 2797 1 5 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.347 2.541 26021 2798 1 5 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.044 0.134 26021 2799 1 5 . 1 1 33 33 ILE H H 33 8.236 8.236 7.591 0.645 26021 2800 1 5 . 1 1 34 34 GLU N N 34 120.595 120.595 119.805 0.790 26021 2801 1 5 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.871 -0.083 26021 2802 1 5 . 1 1 34 34 GLU C C 34 179.739 179.739 178.937 0.802 26021 2803 1 5 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.720 0.519 26021 2804 1 5 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.860 0.985 26021 2805 1 5 . 1 1 34 34 GLU H H 34 8.551 8.551 8.279 0.272 26021 2806 1 5 . 1 1 35 35 ASP N N 35 120.600 120.600 120.356 0.244 26021 2807 1 5 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.492 -0.080 26021 2808 1 5 . 1 1 35 35 ASP C C 35 178.681 178.681 178.475 0.206 26021 2809 1 5 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.920 0.542 26021 2810 1 5 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.528 -0.778 26021 2811 1 5 . 1 1 35 35 ASP H H 35 8.670 8.670 7.737 0.933 26021 2812 1 5 . 1 1 36 36 LEU N N 36 123.004 123.004 121.148 1.856 26021 2813 1 5 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.486 -0.391 26021 2814 1 5 . 1 1 36 36 LEU C C 36 178.035 178.035 179.212 -1.177 26021 2815 1 5 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.734 0.293 26021 2816 1 5 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.201 -0.325 26021 2817 1 5 . 1 1 36 36 LEU H H 36 8.166 8.166 7.523 0.643 26021 2818 1 5 . 1 1 37 37 LEU N N 37 120.178 120.178 120.217 -0.039 26021 2819 1 5 . 1 1 37 37 LEU HA H 37 3.856 3.856 3.968 -0.112 26021 2820 1 5 . 1 1 37 37 LEU C C 37 178.128 178.128 178.253 -0.125 26021 2821 1 5 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.055 0.620 26021 2822 1 5 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.377 0.778 26021 2823 1 5 . 1 1 37 37 LEU H H 37 8.736 8.736 8.209 0.527 26021 2824 1 5 . 1 1 38 38 LYS N N 38 118.110 118.110 119.169 -1.059 26021 2825 1 5 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.876 0.057 26021 2826 1 5 . 1 1 38 38 LYS C C 38 179.533 179.533 179.195 0.338 26021 2827 1 5 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.283 -0.010 26021 2828 1 5 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.205 0.072 26021 2829 1 5 . 1 1 38 38 LYS H H 38 7.770 7.770 7.725 0.045 26021 2830 1 5 . 1 1 39 39 GLU N N 39 119.265 119.265 119.267 -0.002 26021 2831 1 5 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.131 0.171 26021 2832 1 5 . 1 1 39 39 GLU C C 39 179.720 179.720 179.144 0.576 26021 2833 1 5 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.111 -0.353 26021 2834 1 5 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.702 -0.112 26021 2835 1 5 . 1 1 39 39 GLU H H 39 7.709 7.709 7.545 0.164 26021 2836 1 5 . 1 1 40 40 LEU N N 40 119.007 119.007 120.775 -1.768 26021 2837 1 5 . 1 1 40 40 LEU HA H 40 4.050 4.050 3.994 0.056 26021 2838 1 5 . 1 1 40 40 LEU C C 40 179.690 179.690 178.599 1.091 26021 2839 1 5 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.747 -0.096 26021 2840 1 5 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.853 0.832 26021 2841 1 5 . 1 1 40 40 LEU H H 40 8.851 8.851 8.601 0.250 26021 2842 1 5 . 1 1 41 41 LYS N N 41 120.500 120.500 118.403 2.097 26021 2843 1 5 . 1 1 41 41 LYS HA H 41 3.952 3.952 3.999 -0.047 26021 2844 1 5 . 1 1 41 41 LYS C C 41 180.223 180.223 178.839 1.384 26021 2845 1 5 . 1 1 41 41 LYS CA C 41 60.891 60.891 60.006 0.885 26021 2846 1 5 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.122 -0.055 26021 2847 1 5 . 1 1 41 41 LYS H H 41 8.482 8.482 8.497 -0.015 26021 2848 1 5 . 1 1 42 42 THR N N 42 119.555 119.555 111.379 8.176 26021 2849 1 5 . 1 1 42 42 THR HA H 42 4.000 4.000 4.194 -0.194 26021 2850 1 5 . 1 1 42 42 THR C C 42 176.633 176.633 176.635 -0.002 26021 2851 1 5 . 1 1 42 42 THR CA C 42 66.574 66.574 65.155 1.419 26021 2852 1 5 . 1 1 42 42 THR CB C 42 67.924 67.924 68.685 -0.761 26021 2853 1 5 . 1 1 42 42 THR H H 42 7.863 7.863 7.382 0.481 26021 2854 1 5 . 1 1 43 43 MET N N 43 122.839 122.839 121.960 0.879 26021 2855 1 5 . 1 1 43 43 MET HA H 43 4.022 4.022 4.096 -0.074 26021 2856 1 5 . 1 1 43 43 MET C C 43 177.290 177.290 178.124 -0.834 26021 2857 1 5 . 1 1 43 43 MET CA C 43 59.731 59.731 58.637 1.094 26021 2858 1 5 . 1 1 43 43 MET CB C 43 33.610 33.610 32.234 1.376 26021 2859 1 5 . 1 1 43 43 MET H H 43 8.714 8.714 7.936 0.778 26021 2860 1 5 . 1 1 44 44 ASN N N 44 118.049 118.049 117.966 0.083 26021 2861 1 5 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.327 0.047 26021 2862 1 5 . 1 1 44 44 ASN C C 44 176.297 176.297 177.446 -1.149 26021 2863 1 5 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.553 0.341 26021 2864 1 5 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.473 0.933 26021 2865 1 5 . 1 1 44 44 ASN H H 44 8.988 8.988 8.281 0.707 26021 2866 1 5 . 1 1 45 45 ALA N N 45 119.260 119.260 121.047 -1.787 26021 2867 1 5 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.203 -0.137 26021 2868 1 5 . 1 1 45 45 ALA C C 45 180.476 180.476 179.240 1.236 26021 2869 1 5 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.367 0.901 26021 2870 1 5 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.247 -0.559 26021 2871 1 5 . 1 1 45 45 ALA H H 45 7.675 7.675 7.404 0.271 26021 2872 1 5 . 1 1 46 46 ALA N N 46 121.126 121.126 122.566 -1.440 26021 2873 1 5 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.039 0.077 26021 2874 1 5 . 1 1 46 46 ALA C C 46 179.314 179.314 179.214 0.100 26021 2875 1 5 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.066 -0.080 26021 2876 1 5 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.299 -0.077 26021 2877 1 5 . 1 1 46 46 ALA H H 46 7.872 7.872 7.916 -0.044 26021 2878 1 5 . 1 1 47 47 LEU N N 47 119.328 119.328 116.303 3.025 26021 2879 1 5 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.895 0.296 26021 2880 1 5 . 1 1 47 47 LEU C C 47 180.403 180.403 178.469 1.934 26021 2881 1 5 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.962 0.084 26021 2882 1 5 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.287 0.663 26021 2883 1 5 . 1 1 47 47 LEU H H 47 8.529 8.529 7.731 0.798 26021 2884 1 5 . 1 1 48 48 ILE N N 48 121.653 121.653 118.330 3.323 26021 2885 1 5 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.696 0.006 26021 2886 1 5 . 1 1 48 48 ILE C C 48 178.730 178.730 177.758 0.972 26021 2887 1 5 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.289 0.621 26021 2888 1 5 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.691 0.221 26021 2889 1 5 . 1 1 48 48 ILE H H 48 8.386 8.386 7.135 1.251 26021 2890 1 5 . 1 1 49 49 LYS N N 49 119.896 119.896 119.068 0.828 26021 2891 1 5 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.139 -0.096 26021 2892 1 5 . 1 1 49 49 LYS C C 49 179.999 179.999 179.321 0.678 26021 2893 1 5 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.228 -0.171 26021 2894 1 5 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.921 -0.960 26021 2895 1 5 . 1 1 49 49 LYS H H 49 7.456 7.456 7.582 -0.126 26021 2896 1 5 . 1 1 50 50 ILE N N 50 119.964 119.964 114.724 5.240 26021 2897 1 5 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.371 -0.635 26021 2898 1 5 . 1 1 50 50 ILE C C 50 177.960 177.960 177.674 0.286 26021 2899 1 5 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.386 0.963 26021 2900 1 5 . 1 1 50 50 ILE CB C 50 38.132 38.132 38.179 -0.047 26021 2901 1 5 . 1 1 50 50 ILE H H 50 8.154 8.154 8.506 -0.352 26021 2902 1 5 . 1 1 51 51 GLY N N 51 106.709 106.709 106.289 0.420 26021 2903 1 5 . 1 1 51 51 GLY C C 51 174.461 174.461 174.559 -0.098 26021 2904 1 5 . 1 1 51 51 GLY CA C 51 45.909 45.909 44.892 1.017 26021 2905 1 5 . 1 1 51 51 GLY H H 51 7.932 7.932 7.630 0.302 26021 2906 1 5 . 1 1 52 52 GLU N N 52 118.736 118.736 119.607 -0.871 26021 2907 1 5 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.451 -0.131 26021 2908 1 5 . 1 1 52 52 GLU C C 52 176.789 176.789 177.290 -0.501 26021 2909 1 5 . 1 1 52 52 GLU CA C 52 56.274 56.274 56.018 0.256 26021 2910 1 5 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.853 -0.741 26021 2911 1 5 . 1 1 52 52 GLU H H 52 7.597 7.597 7.773 -0.176 26021 2912 1 5 . 1 1 53 53 VAL N N 53 122.982 122.982 119.457 3.525 26021 2913 1 5 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.211 0.050 26021 2914 1 5 . 1 1 53 53 VAL CA C 53 60.385 60.385 60.271 0.114 26021 2915 1 5 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.440 1.382 26021 2916 1 5 . 1 1 53 53 VAL H H 53 7.511 7.511 7.478 0.033 26021 2917 1 5 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.771 -0.126 26021 2918 1 5 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.547 0.031 26021 2919 1 5 . 1 1 54 54 PRO CB C 54 31.535 31.535 30.941 0.594 26021 2920 1 5 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.338 -0.147 26021 2921 1 5 . 1 1 55 55 PRO C C 55 178.258 178.258 176.787 1.471 26021 2922 1 5 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.249 1.179 26021 2923 1 5 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.996 -0.150 26021 2924 1 5 . 1 1 56 56 ASP N N 56 114.117 114.117 116.537 -2.420 26021 2925 1 5 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.530 -0.039 26021 2926 1 5 . 1 1 56 56 ASP C C 56 176.696 176.696 177.540 -0.844 26021 2927 1 5 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.834 -0.696 26021 2928 1 5 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.956 -1.230 26021 2929 1 5 . 1 1 56 56 ASP H H 56 8.489 8.489 8.340 0.149 26021 2930 1 5 . 1 1 57 57 GLN N N 57 117.641 117.641 117.413 0.228 26021 2931 1 5 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.359 0.015 26021 2932 1 5 . 1 1 57 57 GLN C C 57 175.765 175.765 177.005 -1.240 26021 2933 1 5 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.584 -0.294 26021 2934 1 5 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.649 -0.003 26021 2935 1 5 . 1 1 57 57 GLN H H 57 8.206 8.206 7.656 0.550 26021 2936 1 5 . 1 1 58 58 LEU N N 58 122.141 122.141 123.184 -1.043 26021 2937 1 5 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.109 0.341 26021 2938 1 5 . 1 1 58 58 LEU C C 58 176.849 176.849 176.792 0.057 26021 2939 1 5 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.631 -0.636 26021 2940 1 5 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.340 0.891 26021 2941 1 5 . 1 1 58 58 LEU H H 58 7.152 7.152 7.652 -0.500 26021 2942 1 5 . 1 1 59 59 ASP N N 59 125.643 125.643 120.761 4.882 26021 2943 1 5 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.826 -0.107 26021 2944 1 5 . 1 1 59 59 ASP C C 59 177.249 177.249 176.821 0.428 26021 2945 1 5 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.157 0.246 26021 2946 1 5 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.638 -1.406 26021 2947 1 5 . 1 1 59 59 ASP H H 59 9.312 9.312 8.236 1.076 26021 2948 1 5 . 1 1 60 60 SER N N 60 116.550 116.550 115.255 1.295 26021 2949 1 5 . 1 1 60 60 SER HA H 60 4.124 4.124 4.257 -0.133 26021 2950 1 5 . 1 1 60 60 SER C C 60 176.840 176.840 175.863 0.977 26021 2951 1 5 . 1 1 60 60 SER CA C 60 61.722 61.722 60.924 0.798 26021 2952 1 5 . 1 1 60 60 SER CB C 60 62.815 62.815 63.300 -0.485 26021 2953 1 5 . 1 1 60 60 SER H H 60 8.647 8.647 8.648 -0.001 26021 2954 1 5 . 1 1 61 61 GLN N N 61 121.394 121.394 120.000 1.394 26021 2955 1 5 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.254 -0.123 26021 2956 1 5 . 1 1 61 61 GLN C C 61 178.629 178.629 177.474 1.155 26021 2957 1 5 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.283 0.470 26021 2958 1 5 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.991 -0.738 26021 2959 1 5 . 1 1 61 61 GLN H H 61 8.453 8.453 7.976 0.477 26021 2960 1 5 . 1 1 62 62 ASP N N 62 122.187 122.187 119.297 2.890 26021 2961 1 5 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.500 0.119 26021 2962 1 5 . 1 1 62 62 ASP C C 62 178.318 178.318 178.491 -0.173 26021 2963 1 5 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.475 -0.013 26021 2964 1 5 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.711 0.325 26021 2965 1 5 . 1 1 62 62 ASP H H 62 8.311 8.311 8.558 -0.247 26021 2966 1 5 . 1 1 63 63 LYS N N 63 120.325 120.325 118.277 2.048 26021 2967 1 5 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.174 -0.165 26021 2968 1 5 . 1 1 63 63 LYS C C 63 178.765 178.765 179.249 -0.484 26021 2969 1 5 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.789 0.964 26021 2970 1 5 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.449 0.004 26021 2971 1 5 . 1 1 63 63 LYS H H 63 7.923 7.923 7.585 0.338 26021 2972 1 5 . 1 1 64 64 LEU N N 64 119.491 119.491 119.083 0.408 26021 2973 1 5 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.063 0.163 26021 2974 1 5 . 1 1 64 64 LEU C C 64 179.526 179.526 178.949 0.577 26021 2975 1 5 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.081 0.717 26021 2976 1 5 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.549 0.226 26021 2977 1 5 . 1 1 64 64 LEU H H 64 7.820 7.820 7.465 0.355 26021 2978 1 5 . 1 1 65 65 TRP N N 65 120.674 120.674 121.921 -1.247 26021 2979 1 5 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.711 -0.403 26021 2980 1 5 . 1 1 65 65 TRP C C 65 177.379 177.379 177.555 -0.176 26021 2981 1 5 . 1 1 65 65 TRP CA C 65 61.802 61.802 58.938 2.864 26021 2982 1 5 . 1 1 65 65 TRP CB C 65 28.411 28.411 29.035 -0.624 26021 2983 1 5 . 1 1 65 65 TRP H H 65 8.196 8.196 7.777 0.419 26021 2984 1 5 . 1 1 66 66 ALA N N 66 120.606 120.606 120.315 0.291 26021 2985 1 5 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.463 0.246 26021 2986 1 5 . 1 1 66 66 ALA C C 66 180.376 180.376 179.677 0.699 26021 2987 1 5 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.751 0.813 26021 2988 1 5 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.840 -0.186 26021 2989 1 5 . 1 1 66 66 ALA H H 66 8.305 8.305 7.642 0.663 26021 2990 1 5 . 1 1 67 67 ASP N N 67 119.175 119.175 117.774 1.401 26021 2991 1 5 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.399 0.051 26021 2992 1 5 . 1 1 67 67 ASP C C 67 178.757 178.757 177.942 0.815 26021 2993 1 5 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.660 0.832 26021 2994 1 5 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.881 -0.727 26021 2995 1 5 . 1 1 67 67 ASP H H 67 7.945 7.945 7.913 0.032 26021 2996 1 5 . 1 1 68 68 GLU N N 68 122.322 122.322 119.864 2.458 26021 2997 1 5 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.341 -0.326 26021 2998 1 5 . 1 1 68 68 GLU C C 68 180.055 180.055 179.199 0.856 26021 2999 1 5 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.008 1.102 26021 3000 1 5 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.900 -0.253 26021 3001 1 5 . 1 1 68 68 GLU H H 68 8.168 8.168 7.958 0.210 26021 3002 1 5 . 1 1 69 69 VAL N N 69 122.135 122.135 118.917 3.218 26021 3003 1 5 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.708 -0.456 26021 3004 1 5 . 1 1 69 69 VAL C C 69 177.736 177.736 177.883 -0.147 26021 3005 1 5 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.500 1.039 26021 3006 1 5 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.251 -0.009 26021 3007 1 5 . 1 1 69 69 VAL H H 69 8.424 8.424 7.494 0.930 26021 3008 1 5 . 1 1 70 70 ARG N N 70 121.373 121.373 119.243 2.130 26021 3009 1 5 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.031 -0.339 26021 3010 1 5 . 1 1 70 70 ARG C C 70 179.117 179.117 178.985 0.132 26021 3011 1 5 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.309 0.856 26021 3012 1 5 . 1 1 70 70 ARG CB C 70 29.654 29.654 30.054 -0.400 26021 3013 1 5 . 1 1 70 70 ARG H H 70 7.916 7.916 7.623 0.293 26021 3014 1 5 . 1 1 71 71 GLU N N 71 119.075 119.075 121.145 -2.070 26021 3015 1 5 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.013 0.050 26021 3016 1 5 . 1 1 71 71 GLU C C 71 179.119 179.119 178.904 0.215 26021 3017 1 5 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.024 0.663 26021 3018 1 5 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.901 0.369 26021 3019 1 5 . 1 1 71 71 GLU H H 71 8.031 8.031 8.274 -0.243 26021 3020 1 5 . 1 1 72 72 LEU N N 72 120.503 120.503 121.457 -0.954 26021 3021 1 5 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.106 -0.049 26021 3022 1 5 . 1 1 72 72 LEU C C 72 178.734 178.734 178.905 -0.171 26021 3023 1 5 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.217 0.205 26021 3024 1 5 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.742 -0.334 26021 3025 1 5 . 1 1 72 72 LEU H H 72 8.175 8.175 7.633 0.542 26021 3026 1 5 . 1 1 73 73 SER N N 73 115.243 115.243 115.461 -0.218 26021 3027 1 5 . 1 1 73 73 SER HA H 73 3.824 3.824 4.058 -0.234 26021 3028 1 5 . 1 1 73 73 SER C C 73 175.697 175.697 176.341 -0.644 26021 3029 1 5 . 1 1 73 73 SER CA C 73 62.384 62.384 61.792 0.591 26021 3030 1 5 . 1 1 73 73 SER CB C 73 62.093 62.093 63.049 -0.956 26021 3031 1 5 . 1 1 73 73 SER H H 73 8.411 8.411 8.184 0.227 26021 3032 1 5 . 1 1 74 74 TYR N N 74 121.342 121.342 121.298 0.044 26021 3033 1 5 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.500 -0.009 26021 3034 1 5 . 1 1 74 74 TYR C C 74 178.747 178.747 177.614 1.133 26021 3035 1 5 . 1 1 74 74 TYR CA C 74 60.435 60.435 61.157 -0.722 26021 3036 1 5 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.363 -0.856 26021 3037 1 5 . 1 1 74 74 TYR H H 74 7.314 7.314 7.849 -0.535 26021 3038 1 5 . 1 1 75 75 VAL N N 75 120.779 120.779 118.284 2.495 26021 3039 1 5 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.583 0.278 26021 3040 1 5 . 1 1 75 75 VAL C C 75 179.788 179.788 178.009 1.779 26021 3041 1 5 . 1 1 75 75 VAL CA C 75 66.048 66.048 66.552 -0.505 26021 3042 1 5 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.892 -0.178 26021 3043 1 5 . 1 1 75 75 VAL H H 75 7.740 7.740 7.847 -0.107 26021 3044 1 5 . 1 1 76 76 ILE N N 76 120.598 120.598 120.504 0.094 26021 3045 1 5 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.577 0.123 26021 3046 1 5 . 1 1 76 76 ILE C C 76 177.066 177.066 178.152 -1.086 26021 3047 1 5 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.954 0.965 26021 3048 1 5 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.227 0.158 26021 3049 1 5 . 1 1 76 76 ILE H H 76 8.584 8.584 7.416 1.168 26021 3050 1 5 . 1 1 77 77 GLU N N 77 120.468 120.468 119.719 0.749 26021 3051 1 5 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.790 -0.141 26021 3052 1 5 . 1 1 77 77 GLU C C 77 177.502 177.502 178.035 -0.533 26021 3053 1 5 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.579 1.283 26021 3054 1 5 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.714 0.638 26021 3055 1 5 . 1 1 77 77 GLU H H 77 8.445 8.445 7.703 0.742 26021 3056 1 5 . 1 1 78 78 ASP N N 78 117.382 117.382 119.555 -2.173 26021 3057 1 5 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.319 0.072 26021 3058 1 5 . 1 1 78 78 ASP C C 78 177.382 177.382 177.835 -0.453 26021 3059 1 5 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.938 0.557 26021 3060 1 5 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.933 1.002 26021 3061 1 5 . 1 1 78 78 ASP H H 78 7.885 7.885 7.821 0.064 26021 3062 1 5 . 1 1 79 79 ALA N N 79 120.171 120.171 121.484 -1.313 26021 3063 1 5 . 1 1 79 79 ALA HA H 79 4.050 4.050 3.972 0.078 26021 3064 1 5 . 1 1 79 79 ALA C C 79 181.193 181.193 179.012 2.181 26021 3065 1 5 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.036 0.019 26021 3066 1 5 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.533 -0.113 26021 3067 1 5 . 1 1 79 79 ALA H H 79 7.754 7.754 8.012 -0.258 26021 3068 1 5 . 1 1 80 80 VAL N N 80 119.541 119.541 112.709 6.832 26021 3069 1 5 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.920 -0.243 26021 3070 1 5 . 1 1 80 80 VAL C C 80 177.096 177.096 177.559 -0.463 26021 3071 1 5 . 1 1 80 80 VAL CA C 80 67.084 67.084 63.703 3.381 26021 3072 1 5 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.649 -0.206 26021 3073 1 5 . 1 1 80 80 VAL H H 80 8.635 8.635 7.442 1.193 26021 3074 1 5 . 1 1 81 81 ASP N N 81 121.140 121.140 122.081 -0.941 26021 3075 1 5 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.327 0.142 26021 3076 1 5 . 1 1 81 81 ASP C C 81 179.569 179.569 178.025 1.544 26021 3077 1 5 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.585 0.344 26021 3078 1 5 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.684 -0.749 26021 3079 1 5 . 1 1 81 81 ASP H H 81 8.575 8.575 8.149 0.426 26021 3080 1 5 . 1 1 82 82 LYS N N 82 118.159 118.159 117.837 0.322 26021 3081 1 5 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.027 -0.006 26021 3082 1 5 . 1 1 82 82 LYS C C 82 178.890 178.890 178.687 0.203 26021 3083 1 5 . 1 1 82 82 LYS CA C 82 59.067 59.067 57.968 1.099 26021 3084 1 5 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.677 0.910 26021 3085 1 5 . 1 1 82 82 LYS H H 82 8.079 8.079 7.623 0.456 26021 3086 1 5 . 1 1 83 83 PHE N N 83 120.900 120.900 119.596 1.304 26021 3087 1 5 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.278 -0.002 26021 3088 1 5 . 1 1 83 83 PHE C C 83 177.269 177.269 176.722 0.547 26021 3089 1 5 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.981 -0.038 26021 3090 1 5 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.532 0.215 26021 3091 1 5 . 1 1 83 83 PHE H H 83 8.015 8.015 7.982 0.033 26021 3092 1 5 . 1 1 84 84 LEU N N 84 118.209 118.209 118.758 -0.549 26021 3093 1 5 . 1 1 84 84 LEU HA H 84 3.942 3.942 3.887 0.055 26021 3094 1 5 . 1 1 84 84 LEU C C 84 178.774 178.774 178.120 0.654 26021 3095 1 5 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.088 0.082 26021 3096 1 5 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.404 0.790 26021 3097 1 5 . 1 1 84 84 LEU H H 84 8.338 8.338 7.824 0.514 26021 3098 1 5 . 1 1 85 85 VAL N N 85 116.078 116.078 118.716 -2.638 26021 3099 1 5 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.738 0.253 26021 3100 1 5 . 1 1 85 85 VAL C C 85 177.252 177.252 177.723 -0.471 26021 3101 1 5 . 1 1 85 85 VAL CA C 85 64.180 64.180 66.547 -2.367 26021 3102 1 5 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.213 0.677 26021 3103 1 5 . 1 1 85 85 VAL H H 85 7.447 7.447 7.703 -0.256 26021 3104 1 5 . 1 1 86 86 ARG N N 86 120.842 120.842 118.670 2.172 26021 3105 1 5 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.021 0.206 26021 3106 1 5 . 1 1 86 86 ARG C C 86 177.520 177.520 179.087 -1.567 26021 3107 1 5 . 1 1 86 86 ARG CA C 86 57.059 57.059 59.043 -1.984 26021 3108 1 5 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.896 0.367 26021 3109 1 5 . 1 1 86 86 ARG H H 86 7.598 7.598 7.314 0.284 26021 3110 1 5 . 1 1 87 87 VAL N N 87 119.293 119.293 116.948 2.345 26021 3111 1 5 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.701 0.124 26021 3112 1 5 . 1 1 87 87 VAL C C 87 176.121 176.121 177.648 -1.527 26021 3113 1 5 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.279 -1.841 26021 3114 1 5 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.491 0.281 26021 3115 1 5 . 1 1 87 87 VAL H H 87 7.994 7.994 7.589 0.405 26021 3116 1 5 . 1 1 88 88 HIS N N 88 120.016 120.016 117.216 2.800 26021 3117 1 5 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.371 0.266 26021 3118 1 5 . 1 1 88 88 HIS C C 88 175.639 175.639 176.177 -0.538 26021 3119 1 5 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.403 -0.052 26021 3120 1 5 . 1 1 88 88 HIS CB C 88 29.681 29.681 29.747 -0.066 26021 3121 1 5 . 1 1 88 88 HIS H H 88 7.969 7.969 8.226 -0.257 26021 3122 1 5 . 1 1 89 89 GLY N N 89 109.587 109.587 108.102 1.485 26021 3123 1 5 . 1 1 89 89 GLY C C 89 173.730 173.730 174.459 -0.729 26021 3124 1 5 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.639 -0.470 26021 3125 1 5 . 1 1 89 89 GLY H H 89 8.083 8.083 7.973 0.110 26021 3126 1 5 . 1 1 90 90 VAL N N 90 118.224 118.224 116.860 1.364 26021 3127 1 5 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.518 -0.380 26021 3128 1 5 . 1 1 90 90 VAL C C 90 176.018 176.018 175.333 0.685 26021 3129 1 5 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.702 1.724 26021 3130 1 5 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.971 -0.355 26021 3131 1 5 . 1 1 90 90 VAL H H 90 7.944 7.944 7.217 0.727 26021 3132 1 5 . 1 1 91 91 GLU N N 91 124.313 124.313 125.791 -1.478 26021 3133 1 5 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.278 0.328 26021 3134 1 5 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.923 -0.747 26021 3135 1 5 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.451 1.310 26021 3136 1 5 . 1 1 91 91 GLU H H 91 8.423 8.423 8.583 -0.160 26021 3137 1 5 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.364 -0.027 26021 3138 1 5 . 1 1 92 92 PRO C C 92 176.504 176.504 175.687 0.817 26021 3139 1 5 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.086 0.286 26021 3140 1 5 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.253 -0.086 26021 3141 1 5 . 1 1 93 93 ASP N N 93 120.275 120.275 118.683 1.592 26021 3142 1 5 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.707 -0.135 26021 3143 1 5 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.646 0.324 26021 3144 1 5 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.258 -1.742 26021 3145 1 5 . 1 1 93 93 ASP H H 93 8.286 8.286 8.158 0.128 26021 3146 1 5 . 1 1 94 94 ASP N N 94 121.181 121.181 122.532 -1.351 26021 3147 1 5 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.642 -0.077 26021 3148 1 5 . 1 1 94 94 ASP C C 94 176.474 176.474 176.598 -0.124 26021 3149 1 5 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.276 -0.903 26021 3150 1 5 . 1 1 94 94 ASP CB C 94 41.225 41.225 42.030 -0.805 26021 3151 1 5 . 1 1 94 94 ASP H H 94 8.259 8.259 8.620 -0.361 26021 3152 1 5 . 1 1 95 95 ASN N N 95 118.728 118.728 118.708 0.020 26021 3153 1 5 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.584 0.110 26021 3154 1 5 . 1 1 95 95 ASN C C 95 176.272 176.272 177.085 -0.813 26021 3155 1 5 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.256 -1.270 26021 3156 1 5 . 1 1 95 95 ASN CB C 95 38.729 38.729 39.470 -0.741 26021 3157 1 5 . 1 1 95 95 ASN H H 95 8.474 8.474 8.335 0.139 26021 3158 1 5 . 1 1 96 96 THR N N 96 113.868 113.868 114.033 -0.165 26021 3159 1 5 . 1 1 96 96 THR HA H 96 4.220 4.220 4.052 0.168 26021 3160 1 5 . 1 1 96 96 THR C C 96 175.107 175.107 176.134 -1.027 26021 3161 1 5 . 1 1 96 96 THR CA C 96 63.200 63.200 65.698 -2.498 26021 3162 1 5 . 1 1 96 96 THR CB C 96 69.475 69.475 68.683 0.792 26021 3163 1 5 . 1 1 96 96 THR H H 96 8.263 8.263 8.520 -0.257 26021 3164 1 5 . 1 1 97 97 ASN N N 97 119.954 119.954 119.283 0.671 26021 3165 1 5 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.574 0.042 26021 3166 1 5 . 1 1 97 97 ASN C C 97 176.275 176.275 176.797 -0.522 26021 3167 1 5 . 1 1 97 97 ASN CA C 97 53.956 53.956 53.985 -0.029 26021 3168 1 5 . 1 1 97 97 ASN CB C 97 38.692 38.692 37.902 0.790 26021 3169 1 5 . 1 1 97 97 ASN H H 97 8.431 8.431 8.235 0.196 26021 3170 1 5 . 1 1 98 98 GLY N N 98 108.847 108.847 107.830 1.017 26021 3171 1 5 . 1 1 98 98 GLY C C 98 175.533 175.533 175.515 0.018 26021 3172 1 5 . 1 1 98 98 GLY CA C 98 46.011 46.011 45.679 0.332 26021 3173 1 5 . 1 1 98 98 GLY H H 98 8.338 8.338 7.593 0.745 26021 3174 1 5 . 1 1 99 99 PHE N N 99 118.492 118.492 121.629 -3.137 26021 3175 1 5 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.076 0.172 26021 3176 1 5 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.536 1.423 26021 3177 1 5 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.112 -0.953 26021 3178 1 5 . 1 1 99 99 PHE H H 99 8.370 8.370 9.097 -0.727 26021 3179 1 5 . 1 1 100 100 LYS N N 100 120.987 120.987 119.147 1.840 26021 3180 1 5 . 1 1 100 100 LYS H H 100 8.256 8.256 8.471 -0.215 26021 3181 1 5 . 1 1 101 101 GLY N N 101 108.186 108.186 106.508 1.678 26021 3182 1 5 . 1 1 101 101 GLY C C 101 177.075 177.075 176.006 1.069 26021 3183 1 5 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.446 0.456 26021 3184 1 5 . 1 1 101 101 GLY H H 101 8.300 8.300 7.871 0.429 26021 3185 1 5 . 1 1 102 102 LEU N N 102 121.439 121.439 121.208 0.231 26021 3186 1 5 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.217 -0.120 26021 3187 1 5 . 1 1 102 102 LEU C C 102 179.836 179.836 178.391 1.445 26021 3188 1 5 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.352 0.006 26021 3189 1 5 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.821 -0.051 26021 3190 1 5 . 1 1 102 102 LEU H H 102 7.777 7.777 7.619 0.158 26021 3191 1 5 . 1 1 103 103 MET N N 103 122.290 122.290 118.717 3.573 26021 3192 1 5 . 1 1 103 103 MET HA H 103 4.220 4.220 4.000 0.220 26021 3193 1 5 . 1 1 103 103 MET C C 103 177.739 177.739 177.699 0.040 26021 3194 1 5 . 1 1 103 103 MET CA C 103 58.739 58.739 58.133 0.606 26021 3195 1 5 . 1 1 103 103 MET CB C 103 31.895 31.895 31.767 0.128 26021 3196 1 5 . 1 1 103 103 MET H H 103 8.409 8.409 8.223 0.186 26021 3197 1 5 . 1 1 104 104 LYS N N 104 119.750 119.750 117.474 2.276 26021 3198 1 5 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.123 -0.056 26021 3199 1 5 . 1 1 104 104 LYS C C 104 179.301 179.301 179.207 0.094 26021 3200 1 5 . 1 1 104 104 LYS CA C 104 59.764 59.764 57.649 2.115 26021 3201 1 5 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.726 0.322 26021 3202 1 5 . 1 1 104 104 LYS H H 104 7.916 7.916 7.521 0.395 26021 3203 1 5 . 1 1 105 105 ARG N N 105 117.967 117.967 118.888 -0.921 26021 3204 1 5 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.000 0.026 26021 3205 1 5 . 1 1 105 105 ARG C C 105 178.777 178.777 178.541 0.236 26021 3206 1 5 . 1 1 105 105 ARG CA C 105 59.364 59.364 60.192 -0.828 26021 3207 1 5 . 1 1 105 105 ARG CB C 105 30.997 30.997 29.999 0.998 26021 3208 1 5 . 1 1 105 105 ARG H H 105 7.719 7.719 7.627 0.092 26021 3209 1 5 . 1 1 106 106 THR N N 106 117.211 117.211 111.668 5.543 26021 3210 1 5 . 1 1 106 106 THR HA H 106 4.301 4.301 4.160 0.141 26021 3211 1 5 . 1 1 106 106 THR C C 106 176.254 176.254 176.305 -0.051 26021 3212 1 5 . 1 1 106 106 THR CA C 106 67.860 67.860 66.547 1.313 26021 3213 1 5 . 1 1 106 106 THR CB C 106 67.860 67.860 68.444 -0.584 26021 3214 1 5 . 1 1 106 106 THR H H 106 8.152 8.152 7.582 0.570 26021 3215 1 5 . 1 1 107 107 THR N N 107 117.939 117.939 117.146 0.793 26021 3216 1 5 . 1 1 107 107 THR HA H 107 3.971 3.971 4.049 -0.078 26021 3217 1 5 . 1 1 107 107 THR C C 107 176.780 176.780 176.249 0.531 26021 3218 1 5 . 1 1 107 107 THR CA C 107 66.822 66.822 66.037 0.785 26021 3219 1 5 . 1 1 107 107 THR CB C 107 68.818 68.818 68.565 0.253 26021 3220 1 5 . 1 1 107 107 THR H H 107 8.651 8.651 7.750 0.901 26021 3221 1 5 . 1 1 108 108 LYS N N 108 120.867 120.867 121.418 -0.551 26021 3222 1 5 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.060 -0.038 26021 3223 1 5 . 1 1 108 108 LYS C C 108 179.045 179.045 179.163 -0.118 26021 3224 1 5 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.964 0.870 26021 3225 1 5 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.023 0.450 26021 3226 1 5 . 1 1 108 108 LYS H H 108 7.694 7.694 8.225 -0.531 26021 3227 1 5 . 1 1 109 109 LEU N N 109 119.472 119.472 118.932 0.540 26021 3228 1 5 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.247 0.074 26021 3229 1 5 . 1 1 109 109 LEU C C 109 179.974 179.974 178.879 1.095 26021 3230 1 5 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.508 0.085 26021 3231 1 5 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.272 -0.411 26021 3232 1 5 . 1 1 109 109 LEU H H 109 7.559 7.559 7.375 0.184 26021 3233 1 5 . 1 1 110 110 LEU N N 110 121.832 121.832 118.589 3.243 26021 3234 1 5 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.082 0.109 26021 3235 1 5 . 1 1 110 110 LEU C C 110 178.101 178.101 179.219 -1.118 26021 3236 1 5 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.752 0.140 26021 3237 1 5 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.171 0.713 26021 3238 1 5 . 1 1 110 110 LEU H H 110 8.567 8.567 7.695 0.872 26021 3239 1 5 . 1 1 111 111 LYS N N 111 117.972 117.972 118.258 -0.286 26021 3240 1 5 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.118 -0.139 26021 3241 1 5 . 1 1 111 111 LYS C C 111 177.677 177.677 178.591 -0.914 26021 3242 1 5 . 1 1 111 111 LYS CA C 111 58.785 58.785 57.797 0.988 26021 3243 1 5 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.138 0.071 26021 3244 1 5 . 1 1 111 111 LYS H H 111 7.965 7.965 8.237 -0.272 26021 3245 1 5 . 1 1 112 112 LYS N N 112 115.433 115.433 118.884 -3.451 26021 3246 1 5 . 1 1 112 112 LYS HA H 112 4.110 4.110 3.923 0.187 26021 3247 1 5 . 1 1 112 112 LYS C C 112 178.270 178.270 178.312 -0.042 26021 3248 1 5 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.831 0.120 26021 3249 1 5 . 1 1 112 112 LYS CB C 112 32.791 32.791 31.584 1.207 26021 3250 1 5 . 1 1 112 112 LYS H H 112 7.334 7.334 7.347 -0.013 26021 3251 1 5 . 1 1 113 113 VAL N N 113 114.861 114.861 117.345 -2.484 26021 3252 1 5 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.606 0.225 26021 3253 1 5 . 1 1 113 113 VAL C C 113 176.999 176.999 177.126 -0.127 26021 3254 1 5 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.333 -1.828 26021 3255 1 5 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.795 0.492 26021 3256 1 5 . 1 1 113 113 VAL H H 113 7.298 7.298 7.166 0.132 26021 3257 1 5 . 1 1 114 114 VAL N N 114 121.457 121.457 118.248 3.209 26021 3258 1 5 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.842 -0.120 26021 3259 1 5 . 1 1 114 114 VAL C C 114 177.737 177.737 177.082 0.655 26021 3260 1 5 . 1 1 114 114 VAL CA C 114 65.224 65.224 63.859 1.365 26021 3261 1 5 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.096 0.657 26021 3262 1 5 . 1 1 114 114 VAL H H 114 7.855 7.855 7.462 0.393 26021 3263 1 5 . 1 1 115 115 ASP N N 115 120.804 120.804 120.912 -0.108 26021 3264 1 5 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.455 -0.000 26021 3265 1 5 . 1 1 115 115 ASP C C 115 177.380 177.380 177.614 -0.234 26021 3266 1 5 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.741 -0.820 26021 3267 1 5 . 1 1 115 115 ASP CB C 115 40.372 40.372 41.079 -0.707 26021 3268 1 5 . 1 1 115 115 ASP H H 115 8.311 8.311 7.738 0.573 26021 3269 1 5 . 1 1 116 116 LYS N N 116 119.582 119.582 118.169 1.413 26021 3270 1 5 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.303 -0.208 26021 3271 1 5 . 1 1 116 116 LYS C C 116 177.077 177.077 178.751 -1.674 26021 3272 1 5 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.602 0.109 26021 3273 1 5 . 1 1 116 116 LYS CB C 116 33.488 33.488 32.857 0.631 26021 3274 1 5 . 1 1 116 116 LYS H H 116 7.639 7.639 7.678 -0.039 26021 3275 1 5 . 1 1 117 117 HIS N N 117 115.246 115.246 117.103 -1.857 26021 3276 1 5 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.384 0.241 26021 3277 1 5 . 1 1 117 117 HIS C C 117 175.497 175.497 176.607 -1.110 26021 3278 1 5 . 1 1 117 117 HIS CA C 117 56.175 56.175 57.980 -1.805 26021 3279 1 5 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.579 -0.104 26021 3280 1 5 . 1 1 117 117 HIS H H 117 8.108 8.108 7.981 0.127 26021 3281 1 5 . 1 1 118 118 GLY N N 118 109.944 109.944 107.630 2.314 26021 3282 1 5 . 1 1 118 118 GLY C C 118 174.093 174.093 174.866 -0.773 26021 3283 1 5 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.492 0.572 26021 3284 1 5 . 1 1 118 118 GLY H H 118 8.153 8.153 7.878 0.275 26021 3285 1 5 . 1 1 119 119 ILE N N 119 118.468 118.468 121.896 -3.428 26021 3286 1 5 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.876 0.246 26021 3287 1 5 . 1 1 119 119 ILE C C 119 174.777 174.777 175.651 -0.874 26021 3288 1 5 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.286 -0.185 26021 3289 1 5 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.022 2.609 26021 3290 1 5 . 1 1 119 119 ILE H H 119 7.828 7.828 7.528 0.300 26021 3291 1 6 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.657 0.092 26021 3292 1 6 . 1 1 4 4 ASN C C 4 175.260 175.260 176.219 -0.959 26021 3293 1 6 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.256 -0.425 26021 3294 1 6 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.824 -0.143 26021 3295 1 6 . 1 1 5 5 ALA N N 5 123.648 123.648 121.403 2.245 26021 3296 1 6 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.633 -0.343 26021 3297 1 6 . 1 1 5 5 ALA C C 5 178.256 178.256 178.910 -0.654 26021 3298 1 6 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.926 1.155 26021 3299 1 6 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.226 0.799 26021 3300 1 6 . 1 1 5 5 ALA H H 5 8.520 8.520 8.457 0.064 26021 3301 1 6 . 1 1 6 6 GLY N N 6 107.044 107.044 108.241 -1.197 26021 3302 1 6 . 1 1 6 6 GLY C C 6 174.961 174.961 175.619 -0.658 26021 3303 1 6 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.771 -0.941 26021 3304 1 6 . 1 1 6 6 GLY H H 6 8.350 8.350 8.334 0.016 26021 3305 1 6 . 1 1 7 7 ALA N N 7 123.366 123.366 122.473 0.893 26021 3306 1 6 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.091 0.125 26021 3307 1 6 . 1 1 7 7 ALA C C 7 179.006 179.006 178.490 0.516 26021 3308 1 6 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.236 -0.533 26021 3309 1 6 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.623 0.221 26021 3310 1 6 . 1 1 7 7 ALA H H 7 8.078 8.078 8.122 -0.044 26021 3311 1 6 . 1 1 8 8 ILE N N 8 117.376 117.376 118.473 -1.097 26021 3312 1 6 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.747 0.033 26021 3313 1 6 . 1 1 8 8 ILE C C 8 177.032 177.032 178.235 -1.203 26021 3314 1 6 . 1 1 8 8 ILE CA C 8 63.158 63.158 63.934 -0.776 26021 3315 1 6 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.113 -1.824 26021 3316 1 6 . 1 1 8 8 ILE H H 8 7.943 7.943 7.346 0.597 26021 3317 1 6 . 1 1 9 9 ALA N N 9 121.414 121.414 122.747 -1.333 26021 3318 1 6 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.012 -0.079 26021 3319 1 6 . 1 1 9 9 ALA C C 9 180.515 180.515 179.095 1.420 26021 3320 1 6 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.868 0.230 26021 3321 1 6 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.068 0.093 26021 3322 1 6 . 1 1 9 9 ALA H H 9 8.062 8.062 7.951 0.111 26021 3323 1 6 . 1 1 10 10 LYS N N 10 114.594 114.594 118.850 -4.256 26021 3324 1 6 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.124 0.040 26021 3325 1 6 . 1 1 10 10 LYS C C 10 178.099 178.099 178.073 0.026 26021 3326 1 6 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.352 -0.512 26021 3327 1 6 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.346 0.123 26021 3328 1 6 . 1 1 10 10 LYS H H 10 7.554 7.554 7.862 -0.308 26021 3329 1 6 . 1 1 11 11 LEU N N 11 119.662 119.662 118.410 1.252 26021 3330 1 6 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.190 -0.112 26021 3331 1 6 . 1 1 11 11 LEU C C 11 177.930 177.930 178.121 -0.191 26021 3332 1 6 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.069 0.487 26021 3333 1 6 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.787 1.301 26021 3334 1 6 . 1 1 11 11 LEU H H 11 7.814 7.814 7.374 0.440 26021 3335 1 6 . 1 1 12 12 ILE N N 12 117.945 117.945 120.596 -2.651 26021 3336 1 6 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.910 -0.218 26021 3337 1 6 . 1 1 12 12 ILE CA C 12 67.629 67.629 65.957 1.672 26021 3338 1 6 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.758 1.652 26021 3339 1 6 . 1 1 12 12 ILE H H 12 7.426 7.426 7.511 -0.085 26021 3340 1 6 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.306 0.097 26021 3341 1 6 . 1 1 13 13 PRO C C 13 179.030 179.030 178.716 0.314 26021 3342 1 6 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.057 0.187 26021 3343 1 6 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.051 -0.242 26021 3344 1 6 . 1 1 14 14 LYS N N 14 117.855 117.855 118.695 -0.840 26021 3345 1 6 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.104 0.041 26021 3346 1 6 . 1 1 14 14 LYS C C 14 178.565 178.565 178.911 -0.346 26021 3347 1 6 . 1 1 14 14 LYS CA C 14 59.433 59.433 58.955 0.478 26021 3348 1 6 . 1 1 14 14 LYS CB C 14 32.925 32.925 31.799 1.126 26021 3349 1 6 . 1 1 14 14 LYS H H 14 6.685 6.685 7.412 -0.727 26021 3350 1 6 . 1 1 15 15 LEU N N 15 118.008 118.008 116.801 1.207 26021 3351 1 6 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.403 -0.400 26021 3352 1 6 . 1 1 15 15 LEU C C 15 178.662 178.662 178.952 -0.290 26021 3353 1 6 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.726 0.986 26021 3354 1 6 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.166 -0.167 26021 3355 1 6 . 1 1 15 15 LEU H H 15 8.148 8.148 7.579 0.569 26021 3356 1 6 . 1 1 16 16 GLY N N 16 103.895 103.895 108.256 -4.361 26021 3357 1 6 . 1 1 16 16 GLY C C 16 176.838 176.838 175.418 1.420 26021 3358 1 6 . 1 1 16 16 GLY CA C 16 47.365 47.365 46.855 0.510 26021 3359 1 6 . 1 1 16 16 GLY H H 16 8.104 8.104 7.707 0.397 26021 3360 1 6 . 1 1 17 17 GLU N N 17 121.655 121.655 121.660 -0.005 26021 3361 1 6 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.068 0.065 26021 3362 1 6 . 1 1 17 17 GLU C C 17 179.007 179.007 178.283 0.724 26021 3363 1 6 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.303 -0.492 26021 3364 1 6 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.745 -0.612 26021 3365 1 6 . 1 1 17 17 GLU H H 17 7.817 7.817 7.680 0.137 26021 3366 1 6 . 1 1 18 18 LEU N N 18 117.834 117.834 116.527 1.307 26021 3367 1 6 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.513 -0.395 26021 3368 1 6 . 1 1 18 18 LEU C C 18 177.658 177.658 177.993 -0.335 26021 3369 1 6 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.641 1.388 26021 3370 1 6 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.739 -0.069 26021 3371 1 6 . 1 1 18 18 LEU H H 18 7.389 7.389 7.669 -0.280 26021 3372 1 6 . 1 1 19 19 LEU N N 19 113.694 113.694 118.285 -4.591 26021 3373 1 6 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.364 -0.202 26021 3374 1 6 . 1 1 19 19 LEU C C 19 178.123 178.123 178.516 -0.393 26021 3375 1 6 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.574 0.278 26021 3376 1 6 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.897 0.323 26021 3377 1 6 . 1 1 19 19 LEU H H 19 7.269 7.269 7.743 -0.474 26021 3378 1 6 . 1 1 20 20 VAL N N 20 112.778 112.778 113.157 -0.379 26021 3379 1 6 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.075 0.368 26021 3380 1 6 . 1 1 20 20 VAL C C 20 177.021 177.021 176.651 0.370 26021 3381 1 6 . 1 1 20 20 VAL CA C 20 61.855 61.855 64.062 -2.207 26021 3382 1 6 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.169 0.609 26021 3383 1 6 . 1 1 20 20 VAL H H 20 7.356 7.356 7.910 -0.554 26021 3384 1 6 . 1 1 21 21 GLY N N 21 108.962 108.962 108.866 0.096 26021 3385 1 6 . 1 1 21 21 GLY C C 21 173.813 173.813 173.353 0.460 26021 3386 1 6 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.472 0.574 26021 3387 1 6 . 1 1 21 21 GLY H H 21 7.925 7.925 8.195 -0.270 26021 3388 1 6 . 1 1 22 22 GLU N N 22 120.607 120.607 122.371 -1.764 26021 3389 1 6 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.275 0.003 26021 3390 1 6 . 1 1 22 22 GLU C C 22 175.869 175.869 174.588 1.281 26021 3391 1 6 . 1 1 22 22 GLU CA C 22 56.030 56.030 54.145 1.885 26021 3392 1 6 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.965 -0.284 26021 3393 1 6 . 1 1 22 22 GLU H H 22 8.300 8.300 7.676 0.624 26021 3394 1 6 . 1 1 23 23 TYR N N 23 120.738 120.738 120.384 0.354 26021 3395 1 6 . 1 1 23 23 TYR HA H 23 4.557 4.557 3.880 0.677 26021 3396 1 6 . 1 1 23 23 TYR C C 23 175.264 175.264 173.630 1.634 26021 3397 1 6 . 1 1 23 23 TYR CA C 23 57.561 57.561 56.628 0.933 26021 3398 1 6 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.521 -0.275 26021 3399 1 6 . 1 1 23 23 TYR H H 23 7.756 7.756 7.059 0.697 26021 3400 1 6 . 1 1 24 24 LYS N N 24 122.095 122.095 122.814 -0.719 26021 3401 1 6 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.591 -0.408 26021 3402 1 6 . 1 1 24 24 LYS C C 24 175.742 175.742 175.046 0.696 26021 3403 1 6 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.797 0.321 26021 3404 1 6 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.519 -0.800 26021 3405 1 6 . 1 1 24 24 LYS H H 24 8.692 8.692 8.619 0.073 26021 3406 1 6 . 1 1 25 25 LEU N N 25 121.123 121.123 116.402 4.721 26021 3407 1 6 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.653 -0.161 26021 3408 1 6 . 1 1 25 25 LEU C C 25 177.487 177.487 175.709 1.778 26021 3409 1 6 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.494 0.840 26021 3410 1 6 . 1 1 25 25 LEU CB C 25 43.758 43.758 43.247 0.511 26021 3411 1 6 . 1 1 25 25 LEU H H 25 8.088 8.088 7.449 0.639 26021 3412 1 6 . 1 1 26 26 HIS N N 26 122.993 122.993 118.783 4.210 26021 3413 1 6 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.537 -0.036 26021 3414 1 6 . 1 1 26 26 HIS C C 26 176.716 176.716 176.709 0.007 26021 3415 1 6 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.844 0.353 26021 3416 1 6 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.885 0.472 26021 3417 1 6 . 1 1 26 26 HIS H H 26 8.882 8.882 8.447 0.435 26021 3418 1 6 . 1 1 27 27 LYS N N 27 124.894 124.894 123.683 1.211 26021 3419 1 6 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.306 -0.358 26021 3420 1 6 . 1 1 27 27 LYS C C 27 178.873 178.873 177.926 0.947 26021 3421 1 6 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.149 1.862 26021 3422 1 6 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.356 0.086 26021 3423 1 6 . 1 1 27 27 LYS H H 27 8.699 8.699 8.675 0.024 26021 3424 1 6 . 1 1 28 28 GLY N N 28 111.258 111.258 105.352 5.906 26021 3425 1 6 . 1 1 28 28 GLY C C 28 176.131 176.131 174.960 1.171 26021 3426 1 6 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.054 0.436 26021 3427 1 6 . 1 1 28 28 GLY H H 28 9.814 9.814 8.370 1.444 26021 3428 1 6 . 1 1 29 29 VAL N N 29 122.719 122.719 121.577 1.142 26021 3429 1 6 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.738 0.154 26021 3430 1 6 . 1 1 29 29 VAL C C 29 177.628 177.628 177.852 -0.224 26021 3431 1 6 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.679 -0.159 26021 3432 1 6 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.826 -0.084 26021 3433 1 6 . 1 1 29 29 VAL H H 29 7.431 7.431 7.317 0.114 26021 3434 1 6 . 1 1 30 30 LYS N N 30 119.791 119.791 118.941 0.850 26021 3435 1 6 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.734 -0.099 26021 3436 1 6 . 1 1 30 30 LYS C C 30 177.666 177.666 178.094 -0.428 26021 3437 1 6 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.098 1.926 26021 3438 1 6 . 1 1 30 30 LYS CB C 30 32.405 32.405 30.797 1.608 26021 3439 1 6 . 1 1 30 30 LYS H H 30 8.255 8.255 7.524 0.731 26021 3440 1 6 . 1 1 31 31 LYS N N 31 117.918 117.918 118.251 -0.333 26021 3441 1 6 . 1 1 31 31 LYS HA H 31 4.116 4.116 3.951 0.165 26021 3442 1 6 . 1 1 31 31 LYS C C 31 177.784 177.784 178.172 -0.388 26021 3443 1 6 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.212 -0.509 26021 3444 1 6 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.936 -0.091 26021 3445 1 6 . 1 1 31 31 LYS H H 31 7.689 7.689 7.698 -0.009 26021 3446 1 6 . 1 1 32 32 ASN N N 32 116.347 116.347 116.402 -0.055 26021 3447 1 6 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.442 0.078 26021 3448 1 6 . 1 1 32 32 ASN C C 32 177.764 177.764 176.644 1.120 26021 3449 1 6 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.409 0.906 26021 3450 1 6 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.845 -0.213 26021 3451 1 6 . 1 1 32 32 ASN H H 32 7.556 7.556 7.849 -0.293 26021 3452 1 6 . 1 1 33 33 ILE N N 33 120.592 120.592 120.137 0.455 26021 3453 1 6 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.640 -0.358 26021 3454 1 6 . 1 1 33 33 ILE C C 33 177.074 177.074 177.680 -0.606 26021 3455 1 6 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.874 2.014 26021 3456 1 6 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.770 0.408 26021 3457 1 6 . 1 1 33 33 ILE H H 33 8.236 8.236 7.881 0.355 26021 3458 1 6 . 1 1 34 34 GLU N N 34 120.595 120.595 117.863 2.732 26021 3459 1 6 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.838 -0.050 26021 3460 1 6 . 1 1 34 34 GLU C C 34 179.739 179.739 178.018 1.721 26021 3461 1 6 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.487 0.752 26021 3462 1 6 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.753 1.092 26021 3463 1 6 . 1 1 34 34 GLU H H 34 8.551 8.551 7.905 0.646 26021 3464 1 6 . 1 1 35 35 ASP N N 35 120.600 120.600 120.904 -0.304 26021 3465 1 6 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.446 -0.034 26021 3466 1 6 . 1 1 35 35 ASP C C 35 178.681 178.681 178.409 0.272 26021 3467 1 6 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.774 0.688 26021 3468 1 6 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.849 -1.099 26021 3469 1 6 . 1 1 35 35 ASP H H 35 8.670 8.670 7.823 0.847 26021 3470 1 6 . 1 1 36 36 LEU N N 36 123.004 123.004 120.978 2.026 26021 3471 1 6 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.185 -0.090 26021 3472 1 6 . 1 1 36 36 LEU C C 36 178.035 178.035 179.136 -1.101 26021 3473 1 6 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.406 0.622 26021 3474 1 6 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.192 -0.316 26021 3475 1 6 . 1 1 36 36 LEU H H 36 8.166 8.166 7.646 0.520 26021 3476 1 6 . 1 1 37 37 LEU N N 37 120.178 120.178 119.688 0.490 26021 3477 1 6 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.065 -0.209 26021 3478 1 6 . 1 1 37 37 LEU C C 37 178.128 178.128 178.069 0.059 26021 3479 1 6 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.852 0.823 26021 3480 1 6 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.681 0.474 26021 3481 1 6 . 1 1 37 37 LEU H H 37 8.736 8.736 7.870 0.866 26021 3482 1 6 . 1 1 38 38 LYS N N 38 118.110 118.110 119.624 -1.514 26021 3483 1 6 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.866 0.067 26021 3484 1 6 . 1 1 38 38 LYS C C 38 179.533 179.533 178.949 0.584 26021 3485 1 6 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.973 0.300 26021 3486 1 6 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.237 0.040 26021 3487 1 6 . 1 1 38 38 LYS H H 38 7.770 7.770 7.994 -0.224 26021 3488 1 6 . 1 1 39 39 GLU N N 39 119.265 119.265 118.914 0.351 26021 3489 1 6 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.099 0.203 26021 3490 1 6 . 1 1 39 39 GLU C C 39 179.720 179.720 179.330 0.390 26021 3491 1 6 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.973 -0.215 26021 3492 1 6 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.672 -0.082 26021 3493 1 6 . 1 1 39 39 GLU H H 39 7.709 7.709 7.582 0.127 26021 3494 1 6 . 1 1 40 40 LEU N N 40 119.007 119.007 120.266 -1.259 26021 3495 1 6 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.001 0.049 26021 3496 1 6 . 1 1 40 40 LEU C C 40 179.690 179.690 178.749 0.941 26021 3497 1 6 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.659 -0.008 26021 3498 1 6 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.590 1.095 26021 3499 1 6 . 1 1 40 40 LEU H H 40 8.851 8.851 7.877 0.974 26021 3500 1 6 . 1 1 41 41 LYS N N 41 120.500 120.500 118.576 1.924 26021 3501 1 6 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.045 -0.093 26021 3502 1 6 . 1 1 41 41 LYS C C 41 180.223 180.223 179.007 1.216 26021 3503 1 6 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.538 1.353 26021 3504 1 6 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.122 -0.055 26021 3505 1 6 . 1 1 41 41 LYS H H 41 8.482 8.482 8.473 0.009 26021 3506 1 6 . 1 1 42 42 THR N N 42 119.555 119.555 112.736 6.819 26021 3507 1 6 . 1 1 42 42 THR HA H 42 4.000 4.000 4.161 -0.161 26021 3508 1 6 . 1 1 42 42 THR C C 42 176.633 176.633 176.773 -0.140 26021 3509 1 6 . 1 1 42 42 THR CA C 42 66.574 66.574 65.554 1.020 26021 3510 1 6 . 1 1 42 42 THR CB C 42 67.924 67.924 68.875 -0.951 26021 3511 1 6 . 1 1 42 42 THR H H 42 7.863 7.863 8.069 -0.206 26021 3512 1 6 . 1 1 43 43 MET N N 43 122.839 122.839 121.403 1.436 26021 3513 1 6 . 1 1 43 43 MET HA H 43 4.022 4.022 4.017 0.005 26021 3514 1 6 . 1 1 43 43 MET C C 43 177.290 177.290 178.090 -0.800 26021 3515 1 6 . 1 1 43 43 MET CA C 43 59.731 59.731 59.282 0.449 26021 3516 1 6 . 1 1 43 43 MET CB C 43 33.610 33.610 31.990 1.620 26021 3517 1 6 . 1 1 43 43 MET H H 43 8.714 8.714 7.737 0.977 26021 3518 1 6 . 1 1 44 44 ASN N N 44 118.049 118.049 117.729 0.320 26021 3519 1 6 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.289 0.085 26021 3520 1 6 . 1 1 44 44 ASN C C 44 176.297 176.297 177.350 -1.053 26021 3521 1 6 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.326 0.568 26021 3522 1 6 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.966 0.440 26021 3523 1 6 . 1 1 44 44 ASN H H 44 8.988 8.988 8.071 0.917 26021 3524 1 6 . 1 1 45 45 ALA N N 45 119.260 119.260 122.019 -2.759 26021 3525 1 6 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.059 0.007 26021 3526 1 6 . 1 1 45 45 ALA C C 45 180.476 180.476 179.257 1.219 26021 3527 1 6 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.572 0.696 26021 3528 1 6 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.219 -0.531 26021 3529 1 6 . 1 1 45 45 ALA H H 45 7.675 7.675 7.680 -0.005 26021 3530 1 6 . 1 1 46 46 ALA N N 46 121.126 121.126 121.918 -0.792 26021 3531 1 6 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.067 0.049 26021 3532 1 6 . 1 1 46 46 ALA C C 46 179.314 179.314 178.982 0.332 26021 3533 1 6 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.249 -0.263 26021 3534 1 6 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.519 -0.297 26021 3535 1 6 . 1 1 46 46 ALA H H 46 7.872 7.872 8.038 -0.166 26021 3536 1 6 . 1 1 47 47 LEU N N 47 119.328 119.328 116.527 2.801 26021 3537 1 6 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.082 0.109 26021 3538 1 6 . 1 1 47 47 LEU C C 47 180.403 180.403 178.330 2.073 26021 3539 1 6 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.774 0.272 26021 3540 1 6 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.453 0.497 26021 3541 1 6 . 1 1 47 47 LEU H H 47 8.529 8.529 7.629 0.900 26021 3542 1 6 . 1 1 48 48 ILE N N 48 121.653 121.653 118.385 3.268 26021 3543 1 6 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.802 -0.100 26021 3544 1 6 . 1 1 48 48 ILE C C 48 178.730 178.730 178.029 0.701 26021 3545 1 6 . 1 1 48 48 ILE CA C 48 64.910 64.910 63.101 1.809 26021 3546 1 6 . 1 1 48 48 ILE CB C 48 37.912 37.912 36.682 1.230 26021 3547 1 6 . 1 1 48 48 ILE H H 48 8.386 8.386 7.291 1.095 26021 3548 1 6 . 1 1 49 49 LYS N N 49 119.896 119.896 118.671 1.225 26021 3549 1 6 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.171 -0.128 26021 3550 1 6 . 1 1 49 49 LYS C C 49 179.999 179.999 179.653 0.346 26021 3551 1 6 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.105 -0.048 26021 3552 1 6 . 1 1 49 49 LYS CB C 49 31.961 31.961 33.027 -1.066 26021 3553 1 6 . 1 1 49 49 LYS H H 49 7.456 7.456 7.529 -0.073 26021 3554 1 6 . 1 1 50 50 ILE N N 50 119.964 119.964 116.209 3.755 26021 3555 1 6 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.151 -0.415 26021 3556 1 6 . 1 1 50 50 ILE C C 50 177.960 177.960 177.856 0.104 26021 3557 1 6 . 1 1 50 50 ILE CA C 50 64.349 64.349 64.103 0.246 26021 3558 1 6 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.664 0.468 26021 3559 1 6 . 1 1 50 50 ILE H H 50 8.154 8.154 8.784 -0.630 26021 3560 1 6 . 1 1 51 51 GLY N N 51 106.709 106.709 108.113 -1.404 26021 3561 1 6 . 1 1 51 51 GLY C C 51 174.461 174.461 175.275 -0.814 26021 3562 1 6 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.443 -0.534 26021 3563 1 6 . 1 1 51 51 GLY H H 51 7.932 7.932 7.899 0.033 26021 3564 1 6 . 1 1 52 52 GLU N N 52 118.736 118.736 119.433 -0.697 26021 3565 1 6 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.211 0.109 26021 3566 1 6 . 1 1 52 52 GLU C C 52 176.789 176.789 177.369 -0.580 26021 3567 1 6 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.391 -1.117 26021 3568 1 6 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.016 0.096 26021 3569 1 6 . 1 1 52 52 GLU H H 52 7.597 7.597 7.727 -0.130 26021 3570 1 6 . 1 1 53 53 VAL N N 53 122.982 122.982 117.974 5.008 26021 3571 1 6 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.217 0.044 26021 3572 1 6 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.892 1.492 26021 3573 1 6 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.856 1.966 26021 3574 1 6 . 1 1 53 53 VAL H H 53 7.511 7.511 7.594 -0.083 26021 3575 1 6 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.800 -0.155 26021 3576 1 6 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.562 0.016 26021 3577 1 6 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.009 0.526 26021 3578 1 6 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.387 -0.196 26021 3579 1 6 . 1 1 55 55 PRO C C 55 178.258 178.258 177.225 1.033 26021 3580 1 6 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.715 0.713 26021 3581 1 6 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.804 0.042 26021 3582 1 6 . 1 1 56 56 ASP N N 56 114.117 114.117 117.533 -3.416 26021 3583 1 6 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.518 -0.027 26021 3584 1 6 . 1 1 56 56 ASP C C 56 176.696 176.696 177.300 -0.604 26021 3585 1 6 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.638 -0.499 26021 3586 1 6 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.580 -0.854 26021 3587 1 6 . 1 1 56 56 ASP H H 56 8.489 8.489 8.259 0.230 26021 3588 1 6 . 1 1 57 57 GLN N N 57 117.641 117.641 116.608 1.033 26021 3589 1 6 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.220 0.154 26021 3590 1 6 . 1 1 57 57 GLN C C 57 175.765 175.765 176.189 -0.424 26021 3591 1 6 . 1 1 57 57 GLN CA C 57 55.290 55.290 56.153 -0.863 26021 3592 1 6 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.212 0.434 26021 3593 1 6 . 1 1 57 57 GLN H H 57 8.206 8.206 7.633 0.573 26021 3594 1 6 . 1 1 58 58 LEU N N 58 122.141 122.141 121.691 0.450 26021 3595 1 6 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.143 0.307 26021 3596 1 6 . 1 1 58 58 LEU C C 58 176.849 176.849 176.940 -0.091 26021 3597 1 6 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.862 -0.867 26021 3598 1 6 . 1 1 58 58 LEU CB C 58 43.231 43.231 40.590 2.641 26021 3599 1 6 . 1 1 58 58 LEU H H 58 7.152 7.152 7.394 -0.242 26021 3600 1 6 . 1 1 59 59 ASP N N 59 125.643 125.643 123.964 1.679 26021 3601 1 6 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.858 -0.139 26021 3602 1 6 . 1 1 59 59 ASP C C 59 177.249 177.249 176.940 0.309 26021 3603 1 6 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.270 0.133 26021 3604 1 6 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.289 -1.057 26021 3605 1 6 . 1 1 59 59 ASP H H 59 9.312 9.312 8.037 1.275 26021 3606 1 6 . 1 1 60 60 SER N N 60 116.550 116.550 114.167 2.383 26021 3607 1 6 . 1 1 60 60 SER HA H 60 4.124 4.124 4.241 -0.117 26021 3608 1 6 . 1 1 60 60 SER C C 60 176.840 176.840 176.150 0.690 26021 3609 1 6 . 1 1 60 60 SER CA C 60 61.722 61.722 60.441 1.281 26021 3610 1 6 . 1 1 60 60 SER CB C 60 62.815 62.815 63.471 -0.656 26021 3611 1 6 . 1 1 60 60 SER H H 60 8.647 8.647 8.431 0.216 26021 3612 1 6 . 1 1 61 61 GLN N N 61 121.394 121.394 119.650 1.744 26021 3613 1 6 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.219 -0.088 26021 3614 1 6 . 1 1 61 61 GLN C C 61 178.629 178.629 177.303 1.326 26021 3615 1 6 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.359 0.394 26021 3616 1 6 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.637 -0.384 26021 3617 1 6 . 1 1 61 61 GLN H H 61 8.453 8.453 8.121 0.332 26021 3618 1 6 . 1 1 62 62 ASP N N 62 122.187 122.187 119.804 2.383 26021 3619 1 6 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.451 0.168 26021 3620 1 6 . 1 1 62 62 ASP C C 62 178.318 178.318 178.241 0.077 26021 3621 1 6 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.469 -0.007 26021 3622 1 6 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.691 0.345 26021 3623 1 6 . 1 1 62 62 ASP H H 62 8.311 8.311 8.231 0.080 26021 3624 1 6 . 1 1 63 63 LYS N N 63 120.325 120.325 118.418 1.907 26021 3625 1 6 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.070 -0.061 26021 3626 1 6 . 1 1 63 63 LYS C C 63 178.765 178.765 179.056 -0.291 26021 3627 1 6 . 1 1 63 63 LYS CA C 63 59.753 59.753 59.136 0.617 26021 3628 1 6 . 1 1 63 63 LYS CB C 63 32.453 32.453 31.997 0.456 26021 3629 1 6 . 1 1 63 63 LYS H H 63 7.923 7.923 7.650 0.273 26021 3630 1 6 . 1 1 64 64 LEU N N 64 119.491 119.491 119.307 0.184 26021 3631 1 6 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.208 0.018 26021 3632 1 6 . 1 1 64 64 LEU C C 64 179.526 179.526 178.654 0.872 26021 3633 1 6 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.942 -0.144 26021 3634 1 6 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.763 0.012 26021 3635 1 6 . 1 1 64 64 LEU H H 64 7.820 7.820 7.580 0.240 26021 3636 1 6 . 1 1 65 65 TRP N N 65 120.674 120.674 121.960 -1.286 26021 3637 1 6 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.198 0.110 26021 3638 1 6 . 1 1 65 65 TRP C C 65 177.379 177.379 177.158 0.221 26021 3639 1 6 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.827 0.975 26021 3640 1 6 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.792 -0.381 26021 3641 1 6 . 1 1 65 65 TRP H H 65 8.196 8.196 7.932 0.264 26021 3642 1 6 . 1 1 66 66 ALA N N 66 120.606 120.606 119.720 0.886 26021 3643 1 6 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.620 0.089 26021 3644 1 6 . 1 1 66 66 ALA C C 66 180.376 180.376 179.033 1.343 26021 3645 1 6 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.655 0.909 26021 3646 1 6 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.926 -0.272 26021 3647 1 6 . 1 1 66 66 ALA H H 66 8.305 8.305 7.750 0.555 26021 3648 1 6 . 1 1 67 67 ASP N N 67 119.175 119.175 119.159 0.016 26021 3649 1 6 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.288 0.162 26021 3650 1 6 . 1 1 67 67 ASP C C 67 178.757 178.757 178.220 0.537 26021 3651 1 6 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.427 0.065 26021 3652 1 6 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.849 -0.695 26021 3653 1 6 . 1 1 67 67 ASP H H 67 7.945 7.945 7.664 0.281 26021 3654 1 6 . 1 1 68 68 GLU N N 68 122.322 122.322 118.913 3.409 26021 3655 1 6 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.261 -0.246 26021 3656 1 6 . 1 1 68 68 GLU C C 68 180.055 180.055 179.312 0.743 26021 3657 1 6 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.372 0.738 26021 3658 1 6 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.600 0.047 26021 3659 1 6 . 1 1 68 68 GLU H H 68 8.168 8.168 7.825 0.343 26021 3660 1 6 . 1 1 69 69 VAL N N 69 122.135 122.135 118.599 3.536 26021 3661 1 6 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.757 -0.505 26021 3662 1 6 . 1 1 69 69 VAL C C 69 177.736 177.736 178.387 -0.651 26021 3663 1 6 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.528 1.011 26021 3664 1 6 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.058 0.184 26021 3665 1 6 . 1 1 69 69 VAL H H 69 8.424 8.424 7.215 1.209 26021 3666 1 6 . 1 1 70 70 ARG N N 70 121.373 121.373 119.840 1.533 26021 3667 1 6 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.010 -0.318 26021 3668 1 6 . 1 1 70 70 ARG C C 70 179.117 179.117 178.876 0.241 26021 3669 1 6 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.969 1.196 26021 3670 1 6 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.905 -0.251 26021 3671 1 6 . 1 1 70 70 ARG H H 70 7.916 7.916 8.254 -0.338 26021 3672 1 6 . 1 1 71 71 GLU N N 71 119.075 119.075 120.395 -1.320 26021 3673 1 6 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.101 -0.038 26021 3674 1 6 . 1 1 71 71 GLU C C 71 179.119 179.119 179.268 -0.149 26021 3675 1 6 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.298 0.389 26021 3676 1 6 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.744 0.526 26021 3677 1 6 . 1 1 71 71 GLU H H 71 8.031 8.031 8.532 -0.501 26021 3678 1 6 . 1 1 72 72 LEU N N 72 120.503 120.503 120.725 -0.222 26021 3679 1 6 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.036 0.021 26021 3680 1 6 . 1 1 72 72 LEU C C 72 178.734 178.734 178.599 0.135 26021 3681 1 6 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.166 0.256 26021 3682 1 6 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.519 -0.111 26021 3683 1 6 . 1 1 72 72 LEU H H 72 8.175 8.175 7.641 0.534 26021 3684 1 6 . 1 1 73 73 SER N N 73 115.243 115.243 115.263 -0.020 26021 3685 1 6 . 1 1 73 73 SER HA H 73 3.824 3.824 4.019 -0.195 26021 3686 1 6 . 1 1 73 73 SER C C 73 175.697 175.697 176.758 -1.061 26021 3687 1 6 . 1 1 73 73 SER CA C 73 62.384 62.384 61.395 0.989 26021 3688 1 6 . 1 1 73 73 SER CB C 73 62.093 62.093 62.851 -0.758 26021 3689 1 6 . 1 1 73 73 SER H H 73 8.411 8.411 8.062 0.349 26021 3690 1 6 . 1 1 74 74 TYR N N 74 121.342 121.342 120.021 1.321 26021 3691 1 6 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.277 0.214 26021 3692 1 6 . 1 1 74 74 TYR C C 74 178.747 178.747 177.843 0.904 26021 3693 1 6 . 1 1 74 74 TYR CA C 74 60.435 60.435 61.221 -0.786 26021 3694 1 6 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.337 -0.830 26021 3695 1 6 . 1 1 74 74 TYR H H 74 7.314 7.314 7.817 -0.503 26021 3696 1 6 . 1 1 75 75 VAL N N 75 120.779 120.779 117.890 2.889 26021 3697 1 6 . 1 1 75 75 VAL HA H 75 3.861 3.861 4.013 -0.152 26021 3698 1 6 . 1 1 75 75 VAL C C 75 179.788 179.788 178.448 1.340 26021 3699 1 6 . 1 1 75 75 VAL CA C 75 66.048 66.048 64.738 1.310 26021 3700 1 6 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.606 0.108 26021 3701 1 6 . 1 1 75 75 VAL H H 75 7.740 7.740 7.867 -0.127 26021 3702 1 6 . 1 1 76 76 ILE N N 76 120.598 120.598 121.259 -0.661 26021 3703 1 6 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.655 0.045 26021 3704 1 6 . 1 1 76 76 ILE C C 76 177.066 177.066 178.229 -1.163 26021 3705 1 6 . 1 1 76 76 ILE CA C 76 65.919 65.919 65.430 0.489 26021 3706 1 6 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.320 0.065 26021 3707 1 6 . 1 1 76 76 ILE H H 76 8.584 8.584 7.742 0.842 26021 3708 1 6 . 1 1 77 77 GLU N N 77 120.468 120.468 119.759 0.709 26021 3709 1 6 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.978 -0.329 26021 3710 1 6 . 1 1 77 77 GLU C C 77 177.502 177.502 178.828 -1.326 26021 3711 1 6 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.799 1.063 26021 3712 1 6 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.783 0.569 26021 3713 1 6 . 1 1 77 77 GLU H H 77 8.445 8.445 7.918 0.527 26021 3714 1 6 . 1 1 78 78 ASP N N 78 117.382 117.382 119.421 -2.039 26021 3715 1 6 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.367 0.024 26021 3716 1 6 . 1 1 78 78 ASP C C 78 177.382 177.382 177.939 -0.557 26021 3717 1 6 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.844 0.651 26021 3718 1 6 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.189 1.746 26021 3719 1 6 . 1 1 78 78 ASP H H 78 7.885 7.885 7.917 -0.032 26021 3720 1 6 . 1 1 79 79 ALA N N 79 120.171 120.171 121.499 -1.328 26021 3721 1 6 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.129 -0.079 26021 3722 1 6 . 1 1 79 79 ALA C C 79 181.193 181.193 180.012 1.181 26021 3723 1 6 . 1 1 79 79 ALA CA C 79 55.055 55.055 54.997 0.058 26021 3724 1 6 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.457 -0.037 26021 3725 1 6 . 1 1 79 79 ALA H H 79 7.754 7.754 8.127 -0.373 26021 3726 1 6 . 1 1 80 80 VAL N N 80 119.541 119.541 113.493 6.048 26021 3727 1 6 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.856 -0.179 26021 3728 1 6 . 1 1 80 80 VAL C C 80 177.096 177.096 177.494 -0.398 26021 3729 1 6 . 1 1 80 80 VAL CA C 80 67.084 67.084 65.007 2.077 26021 3730 1 6 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.782 -0.339 26021 3731 1 6 . 1 1 80 80 VAL H H 80 8.635 8.635 7.411 1.224 26021 3732 1 6 . 1 1 81 81 ASP N N 81 121.140 121.140 120.834 0.306 26021 3733 1 6 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.293 0.176 26021 3734 1 6 . 1 1 81 81 ASP C C 81 179.569 179.569 178.222 1.347 26021 3735 1 6 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.219 0.709 26021 3736 1 6 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.586 -0.651 26021 3737 1 6 . 1 1 81 81 ASP H H 81 8.575 8.575 8.013 0.562 26021 3738 1 6 . 1 1 82 82 LYS N N 82 118.159 118.159 118.158 0.001 26021 3739 1 6 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.044 -0.023 26021 3740 1 6 . 1 1 82 82 LYS C C 82 178.890 178.890 179.181 -0.291 26021 3741 1 6 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.764 0.303 26021 3742 1 6 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.927 0.661 26021 3743 1 6 . 1 1 82 82 LYS H H 82 8.079 8.079 7.647 0.432 26021 3744 1 6 . 1 1 83 83 PHE N N 83 120.900 120.900 121.020 -0.120 26021 3745 1 6 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.394 -0.118 26021 3746 1 6 . 1 1 83 83 PHE C C 83 177.269 177.269 176.917 0.352 26021 3747 1 6 . 1 1 83 83 PHE CA C 83 60.943 60.943 59.370 1.573 26021 3748 1 6 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.194 0.553 26021 3749 1 6 . 1 1 83 83 PHE H H 83 8.015 8.015 7.799 0.216 26021 3750 1 6 . 1 1 84 84 LEU N N 84 118.209 118.209 118.433 -0.224 26021 3751 1 6 . 1 1 84 84 LEU HA H 84 3.942 3.942 3.681 0.261 26021 3752 1 6 . 1 1 84 84 LEU C C 84 178.774 178.774 177.737 1.037 26021 3753 1 6 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.187 0.983 26021 3754 1 6 . 1 1 84 84 LEU CB C 84 42.193 42.193 40.697 1.496 26021 3755 1 6 . 1 1 84 84 LEU H H 84 8.338 8.338 7.774 0.564 26021 3756 1 6 . 1 1 85 85 VAL N N 85 116.078 116.078 120.020 -3.942 26021 3757 1 6 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.569 0.422 26021 3758 1 6 . 1 1 85 85 VAL C C 85 177.252 177.252 176.913 0.339 26021 3759 1 6 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.516 -1.336 26021 3760 1 6 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.744 0.146 26021 3761 1 6 . 1 1 85 85 VAL H H 85 7.447 7.447 7.214 0.233 26021 3762 1 6 . 1 1 86 86 ARG N N 86 120.842 120.842 117.425 3.417 26021 3763 1 6 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.011 0.216 26021 3764 1 6 . 1 1 86 86 ARG C C 86 177.520 177.520 178.949 -1.429 26021 3765 1 6 . 1 1 86 86 ARG CA C 86 57.059 57.059 59.206 -2.147 26021 3766 1 6 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.269 -0.006 26021 3767 1 6 . 1 1 86 86 ARG H H 86 7.598 7.598 7.262 0.336 26021 3768 1 6 . 1 1 87 87 VAL N N 87 119.293 119.293 116.667 2.626 26021 3769 1 6 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.718 0.107 26021 3770 1 6 . 1 1 87 87 VAL C C 87 176.121 176.121 177.258 -1.137 26021 3771 1 6 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.503 -2.065 26021 3772 1 6 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.134 0.638 26021 3773 1 6 . 1 1 87 87 VAL H H 87 7.994 7.994 7.828 0.166 26021 3774 1 6 . 1 1 88 88 HIS N N 88 120.016 120.016 117.288 2.728 26021 3775 1 6 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.465 0.172 26021 3776 1 6 . 1 1 88 88 HIS C C 88 175.639 175.639 175.899 -0.260 26021 3777 1 6 . 1 1 88 88 HIS CA C 88 56.351 56.351 55.944 0.408 26021 3778 1 6 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.075 -0.393 26021 3779 1 6 . 1 1 88 88 HIS H H 88 7.969 7.969 8.248 -0.279 26021 3780 1 6 . 1 1 89 89 GLY N N 89 109.587 109.587 108.420 1.167 26021 3781 1 6 . 1 1 89 89 GLY C C 89 173.730 173.730 174.496 -0.766 26021 3782 1 6 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.673 -0.505 26021 3783 1 6 . 1 1 89 89 GLY H H 89 8.083 8.083 8.141 -0.058 26021 3784 1 6 . 1 1 90 90 VAL N N 90 118.224 118.224 117.357 0.867 26021 3785 1 6 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.452 -0.314 26021 3786 1 6 . 1 1 90 90 VAL C C 90 176.018 176.018 175.319 0.699 26021 3787 1 6 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.936 1.489 26021 3788 1 6 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.275 -0.659 26021 3789 1 6 . 1 1 90 90 VAL H H 90 7.944 7.944 7.345 0.599 26021 3790 1 6 . 1 1 91 91 GLU N N 91 124.313 124.313 124.712 -0.399 26021 3791 1 6 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.293 0.313 26021 3792 1 6 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.660 -0.484 26021 3793 1 6 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.691 1.069 26021 3794 1 6 . 1 1 91 91 GLU H H 91 8.423 8.423 8.482 -0.059 26021 3795 1 6 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.341 -0.004 26021 3796 1 6 . 1 1 92 92 PRO C C 92 176.504 176.504 175.652 0.852 26021 3797 1 6 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.348 0.024 26021 3798 1 6 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.138 0.029 26021 3799 1 6 . 1 1 93 93 ASP N N 93 120.275 120.275 122.310 -2.035 26021 3800 1 6 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.808 -0.236 26021 3801 1 6 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.541 0.430 26021 3802 1 6 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.715 -2.200 26021 3803 1 6 . 1 1 93 93 ASP H H 93 8.286 8.286 8.407 -0.121 26021 3804 1 6 . 1 1 94 94 ASP N N 94 121.181 121.181 123.810 -2.629 26021 3805 1 6 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.734 -0.169 26021 3806 1 6 . 1 1 94 94 ASP C C 94 176.474 176.474 177.531 -1.057 26021 3807 1 6 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.367 -0.994 26021 3808 1 6 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.834 -0.609 26021 3809 1 6 . 1 1 94 94 ASP H H 94 8.259 8.259 8.582 -0.323 26021 3810 1 6 . 1 1 95 95 ASN N N 95 118.728 118.728 119.508 -0.780 26021 3811 1 6 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.548 0.146 26021 3812 1 6 . 1 1 95 95 ASN C C 95 176.272 176.272 177.135 -0.863 26021 3813 1 6 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.775 -1.789 26021 3814 1 6 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.529 0.200 26021 3815 1 6 . 1 1 95 95 ASN H H 95 8.474 8.474 8.468 0.006 26021 3816 1 6 . 1 1 96 96 THR N N 96 113.868 113.868 115.092 -1.224 26021 3817 1 6 . 1 1 96 96 THR HA H 96 4.220 4.220 4.085 0.135 26021 3818 1 6 . 1 1 96 96 THR C C 96 175.107 175.107 175.909 -0.802 26021 3819 1 6 . 1 1 96 96 THR CA C 96 63.200 63.200 65.343 -2.143 26021 3820 1 6 . 1 1 96 96 THR CB C 96 69.475 69.475 68.668 0.807 26021 3821 1 6 . 1 1 96 96 THR H H 96 8.263 8.263 7.976 0.287 26021 3822 1 6 . 1 1 97 97 ASN N N 97 119.954 119.954 118.190 1.764 26021 3823 1 6 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.578 0.038 26021 3824 1 6 . 1 1 97 97 ASN C C 97 176.275 176.275 176.633 -0.358 26021 3825 1 6 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.387 -0.431 26021 3826 1 6 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.419 0.273 26021 3827 1 6 . 1 1 97 97 ASN H H 97 8.431 8.431 8.031 0.400 26021 3828 1 6 . 1 1 98 98 GLY N N 98 108.847 108.847 107.280 1.567 26021 3829 1 6 . 1 1 98 98 GLY C C 98 175.533 175.533 175.478 0.055 26021 3830 1 6 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.101 -0.090 26021 3831 1 6 . 1 1 98 98 GLY H H 98 8.338 8.338 7.753 0.585 26021 3832 1 6 . 1 1 99 99 PHE N N 99 118.492 118.492 119.238 -0.746 26021 3833 1 6 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.055 0.193 26021 3834 1 6 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.734 0.225 26021 3835 1 6 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.306 -1.147 26021 3836 1 6 . 1 1 99 99 PHE H H 99 8.370 8.370 8.642 -0.272 26021 3837 1 6 . 1 1 100 100 LYS N N 100 120.987 120.987 119.477 1.510 26021 3838 1 6 . 1 1 100 100 LYS H H 100 8.256 8.256 8.317 -0.061 26021 3839 1 6 . 1 1 101 101 GLY N N 101 108.186 108.186 106.092 2.094 26021 3840 1 6 . 1 1 101 101 GLY C C 101 177.075 177.075 175.656 1.419 26021 3841 1 6 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.239 0.663 26021 3842 1 6 . 1 1 101 101 GLY H H 101 8.300 8.300 7.757 0.543 26021 3843 1 6 . 1 1 102 102 LEU N N 102 121.439 121.439 123.441 -2.002 26021 3844 1 6 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.954 0.143 26021 3845 1 6 . 1 1 102 102 LEU C C 102 179.836 179.836 177.932 1.904 26021 3846 1 6 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.114 0.244 26021 3847 1 6 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.786 -0.016 26021 3848 1 6 . 1 1 102 102 LEU H H 102 7.777 7.777 7.409 0.368 26021 3849 1 6 . 1 1 103 103 MET N N 103 122.290 122.290 118.551 3.739 26021 3850 1 6 . 1 1 103 103 MET HA H 103 4.220 4.220 3.783 0.437 26021 3851 1 6 . 1 1 103 103 MET C C 103 177.739 177.739 177.698 0.041 26021 3852 1 6 . 1 1 103 103 MET CA C 103 58.739 58.739 58.607 0.132 26021 3853 1 6 . 1 1 103 103 MET CB C 103 31.895 31.895 32.035 -0.140 26021 3854 1 6 . 1 1 103 103 MET H H 103 8.409 8.409 8.183 0.226 26021 3855 1 6 . 1 1 104 104 LYS N N 104 119.750 119.750 117.734 2.016 26021 3856 1 6 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.017 0.050 26021 3857 1 6 . 1 1 104 104 LYS C C 104 179.301 179.301 179.265 0.036 26021 3858 1 6 . 1 1 104 104 LYS CA C 104 59.764 59.764 59.293 0.471 26021 3859 1 6 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.605 0.443 26021 3860 1 6 . 1 1 104 104 LYS H H 104 7.916 7.916 7.608 0.308 26021 3861 1 6 . 1 1 105 105 ARG N N 105 117.967 117.967 119.670 -1.703 26021 3862 1 6 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.041 -0.015 26021 3863 1 6 . 1 1 105 105 ARG C C 105 178.777 178.777 178.747 0.030 26021 3864 1 6 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.691 -0.327 26021 3865 1 6 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.317 0.680 26021 3866 1 6 . 1 1 105 105 ARG H H 105 7.719 7.719 7.652 0.067 26021 3867 1 6 . 1 1 106 106 THR N N 106 117.211 117.211 113.231 3.980 26021 3868 1 6 . 1 1 106 106 THR HA H 106 4.301 4.301 4.268 0.033 26021 3869 1 6 . 1 1 106 106 THR C C 106 176.254 176.254 176.305 -0.051 26021 3870 1 6 . 1 1 106 106 THR CA C 106 67.860 67.860 65.709 2.151 26021 3871 1 6 . 1 1 106 106 THR CB C 106 67.860 67.860 68.204 -0.344 26021 3872 1 6 . 1 1 106 106 THR H H 106 8.152 8.152 8.028 0.124 26021 3873 1 6 . 1 1 107 107 THR N N 107 117.939 117.939 117.692 0.247 26021 3874 1 6 . 1 1 107 107 THR HA H 107 3.971 3.971 3.955 0.016 26021 3875 1 6 . 1 1 107 107 THR C C 107 176.780 176.780 176.309 0.471 26021 3876 1 6 . 1 1 107 107 THR CA C 107 66.822 66.822 66.440 0.382 26021 3877 1 6 . 1 1 107 107 THR CB C 107 68.818 68.818 68.100 0.718 26021 3878 1 6 . 1 1 107 107 THR H H 107 8.651 8.651 8.066 0.585 26021 3879 1 6 . 1 1 108 108 LYS N N 108 120.867 120.867 120.443 0.424 26021 3880 1 6 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.136 -0.114 26021 3881 1 6 . 1 1 108 108 LYS C C 108 179.045 179.045 179.485 -0.440 26021 3882 1 6 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.735 1.099 26021 3883 1 6 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.120 0.353 26021 3884 1 6 . 1 1 108 108 LYS H H 108 7.694 7.694 7.717 -0.023 26021 3885 1 6 . 1 1 109 109 LEU N N 109 119.472 119.472 120.977 -1.505 26021 3886 1 6 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.165 0.156 26021 3887 1 6 . 1 1 109 109 LEU C C 109 179.974 179.974 179.163 0.811 26021 3888 1 6 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.463 0.130 26021 3889 1 6 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.140 -0.280 26021 3890 1 6 . 1 1 109 109 LEU H H 109 7.559 7.559 7.856 -0.297 26021 3891 1 6 . 1 1 110 110 LEU N N 110 121.832 121.832 118.976 2.856 26021 3892 1 6 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.085 0.106 26021 3893 1 6 . 1 1 110 110 LEU C C 110 178.101 178.101 178.362 -0.261 26021 3894 1 6 . 1 1 110 110 LEU CA C 110 57.892 57.892 58.060 -0.168 26021 3895 1 6 . 1 1 110 110 LEU CB C 110 41.884 41.884 40.976 0.908 26021 3896 1 6 . 1 1 110 110 LEU H H 110 8.567 8.567 7.989 0.578 26021 3897 1 6 . 1 1 111 111 LYS N N 111 117.972 117.972 117.417 0.555 26021 3898 1 6 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.039 -0.060 26021 3899 1 6 . 1 1 111 111 LYS C C 111 177.677 177.677 178.887 -1.210 26021 3900 1 6 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.571 0.214 26021 3901 1 6 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.849 0.360 26021 3902 1 6 . 1 1 111 111 LYS H H 111 7.965 7.965 7.582 0.383 26021 3903 1 6 . 1 1 112 112 LYS N N 112 115.433 115.433 118.737 -3.304 26021 3904 1 6 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.131 -0.021 26021 3905 1 6 . 1 1 112 112 LYS C C 112 178.270 178.270 177.558 0.712 26021 3906 1 6 . 1 1 112 112 LYS CA C 112 58.951 58.951 57.853 1.097 26021 3907 1 6 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.334 0.458 26021 3908 1 6 . 1 1 112 112 LYS H H 112 7.334 7.334 8.104 -0.770 26021 3909 1 6 . 1 1 113 113 VAL N N 113 114.861 114.861 117.655 -2.794 26021 3910 1 6 . 1 1 113 113 VAL HA H 113 3.831 3.831 4.005 -0.174 26021 3911 1 6 . 1 1 113 113 VAL C C 113 176.999 176.999 177.563 -0.564 26021 3912 1 6 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.262 -1.757 26021 3913 1 6 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.173 0.114 26021 3914 1 6 . 1 1 113 113 VAL H H 113 7.298 7.298 7.129 0.169 26021 3915 1 6 . 1 1 114 114 VAL N N 114 121.457 121.457 120.024 1.433 26021 3916 1 6 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.746 -0.024 26021 3917 1 6 . 1 1 114 114 VAL C C 114 177.737 177.737 177.271 0.466 26021 3918 1 6 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.428 -1.204 26021 3919 1 6 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.945 -0.192 26021 3920 1 6 . 1 1 114 114 VAL H H 114 7.855 7.855 8.545 -0.690 26021 3921 1 6 . 1 1 115 115 ASP N N 115 120.804 120.804 118.723 2.081 26021 3922 1 6 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.459 -0.004 26021 3923 1 6 . 1 1 115 115 ASP C C 115 177.380 177.380 176.903 0.477 26021 3924 1 6 . 1 1 115 115 ASP CA C 115 55.921 55.921 55.996 -0.075 26021 3925 1 6 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.742 -0.370 26021 3926 1 6 . 1 1 115 115 ASP H H 115 8.311 8.311 8.052 0.259 26021 3927 1 6 . 1 1 116 116 LYS N N 116 119.582 119.582 118.523 1.059 26021 3928 1 6 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.138 -0.043 26021 3929 1 6 . 1 1 116 116 LYS C C 116 177.077 177.077 177.864 -0.787 26021 3930 1 6 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.747 -0.036 26021 3931 1 6 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.133 0.355 26021 3932 1 6 . 1 1 116 116 LYS H H 116 7.639 7.639 7.892 -0.253 26021 3933 1 6 . 1 1 117 117 HIS N N 117 115.246 115.246 112.704 2.542 26021 3934 1 6 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.804 -0.179 26021 3935 1 6 . 1 1 117 117 HIS C C 117 175.497 175.497 175.955 -0.458 26021 3936 1 6 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.494 -0.319 26021 3937 1 6 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.433 -1.958 26021 3938 1 6 . 1 1 117 117 HIS H H 117 8.108 8.108 7.977 0.131 26021 3939 1 6 . 1 1 118 118 GLY N N 118 109.944 109.944 107.822 2.122 26021 3940 1 6 . 1 1 118 118 GLY C C 118 174.093 174.093 174.422 -0.329 26021 3941 1 6 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.967 1.097 26021 3942 1 6 . 1 1 118 118 GLY H H 118 8.153 8.153 7.686 0.467 26021 3943 1 6 . 1 1 119 119 ILE N N 119 118.468 118.468 122.941 -4.473 26021 3944 1 6 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.979 0.143 26021 3945 1 6 . 1 1 119 119 ILE C C 119 174.777 174.777 175.778 -1.001 26021 3946 1 6 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.482 -0.381 26021 3947 1 6 . 1 1 119 119 ILE CB C 119 38.631 38.631 37.462 1.169 26021 3948 1 6 . 1 1 119 119 ILE H H 119 7.828 7.828 8.057 -0.229 26021 3949 1 7 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.683 0.066 26021 3950 1 7 . 1 1 4 4 ASN C C 4 175.260 175.260 175.431 -0.171 26021 3951 1 7 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.032 -0.201 26021 3952 1 7 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.503 0.178 26021 3953 1 7 . 1 1 5 5 ALA N N 5 123.648 123.648 122.798 0.850 26021 3954 1 7 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.628 -0.338 26021 3955 1 7 . 1 1 5 5 ALA C C 5 178.256 178.256 178.676 -0.420 26021 3956 1 7 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.773 1.308 26021 3957 1 7 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.141 -0.116 26021 3958 1 7 . 1 1 5 5 ALA H H 5 8.520 8.520 8.143 0.377 26021 3959 1 7 . 1 1 6 6 GLY N N 6 107.044 107.044 108.089 -1.045 26021 3960 1 7 . 1 1 6 6 GLY C C 6 174.961 174.961 175.459 -0.498 26021 3961 1 7 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.964 -1.134 26021 3962 1 7 . 1 1 6 6 GLY H H 6 8.350 8.350 7.934 0.416 26021 3963 1 7 . 1 1 7 7 ALA N N 7 123.366 123.366 123.883 -0.517 26021 3964 1 7 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.076 0.140 26021 3965 1 7 . 1 1 7 7 ALA C C 7 179.006 179.006 179.202 -0.196 26021 3966 1 7 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.653 -0.950 26021 3967 1 7 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.428 0.416 26021 3968 1 7 . 1 1 7 7 ALA H H 7 8.078 8.078 8.085 -0.007 26021 3969 1 7 . 1 1 8 8 ILE N N 8 117.376 117.376 118.520 -1.144 26021 3970 1 7 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.715 0.065 26021 3971 1 7 . 1 1 8 8 ILE C C 8 177.032 177.032 178.356 -1.324 26021 3972 1 7 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.231 -1.073 26021 3973 1 7 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.985 -1.696 26021 3974 1 7 . 1 1 8 8 ILE H H 8 7.943 7.943 7.503 0.440 26021 3975 1 7 . 1 1 9 9 ALA N N 9 121.414 121.414 123.015 -1.601 26021 3976 1 7 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.014 -0.081 26021 3977 1 7 . 1 1 9 9 ALA C C 9 180.515 180.515 179.483 1.032 26021 3978 1 7 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.932 0.166 26021 3979 1 7 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.115 0.046 26021 3980 1 7 . 1 1 9 9 ALA H H 9 8.062 8.062 7.671 0.391 26021 3981 1 7 . 1 1 10 10 LYS N N 10 114.594 114.594 118.219 -3.625 26021 3982 1 7 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.126 0.038 26021 3983 1 7 . 1 1 10 10 LYS C C 10 178.099 178.099 178.233 -0.134 26021 3984 1 7 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.487 -0.647 26021 3985 1 7 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.329 0.140 26021 3986 1 7 . 1 1 10 10 LYS H H 10 7.554 7.554 7.967 -0.413 26021 3987 1 7 . 1 1 11 11 LEU N N 11 119.662 119.662 119.162 0.500 26021 3988 1 7 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.151 -0.073 26021 3989 1 7 . 1 1 11 11 LEU C C 11 177.930 177.930 178.283 -0.353 26021 3990 1 7 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.425 0.131 26021 3991 1 7 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.791 1.297 26021 3992 1 7 . 1 1 11 11 LEU H H 11 7.814 7.814 7.579 0.235 26021 3993 1 7 . 1 1 12 12 ILE N N 12 117.945 117.945 120.550 -2.605 26021 3994 1 7 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.921 -0.229 26021 3995 1 7 . 1 1 12 12 ILE CA C 12 67.629 67.629 65.989 1.640 26021 3996 1 7 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.763 1.647 26021 3997 1 7 . 1 1 12 12 ILE H H 12 7.426 7.426 7.409 0.017 26021 3998 1 7 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.322 0.081 26021 3999 1 7 . 1 1 13 13 PRO C C 13 179.030 179.030 178.806 0.224 26021 4000 1 7 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.176 0.068 26021 4001 1 7 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.009 -0.200 26021 4002 1 7 . 1 1 14 14 LYS N N 14 117.855 117.855 118.963 -1.108 26021 4003 1 7 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.074 0.071 26021 4004 1 7 . 1 1 14 14 LYS C C 14 178.565 178.565 178.874 -0.309 26021 4005 1 7 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.009 0.424 26021 4006 1 7 . 1 1 14 14 LYS CB C 14 32.925 32.925 31.861 1.064 26021 4007 1 7 . 1 1 14 14 LYS H H 14 6.685 6.685 7.457 -0.772 26021 4008 1 7 . 1 1 15 15 LEU N N 15 118.008 118.008 116.578 1.430 26021 4009 1 7 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.413 -0.410 26021 4010 1 7 . 1 1 15 15 LEU C C 15 178.662 178.662 179.289 -0.627 26021 4011 1 7 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.474 1.238 26021 4012 1 7 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.094 -0.095 26021 4013 1 7 . 1 1 15 15 LEU H H 15 8.148 8.148 7.521 0.627 26021 4014 1 7 . 1 1 16 16 GLY N N 16 103.895 103.895 108.916 -5.021 26021 4015 1 7 . 1 1 16 16 GLY C C 16 176.838 176.838 176.707 0.131 26021 4016 1 7 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.164 0.201 26021 4017 1 7 . 1 1 16 16 GLY H H 16 8.104 8.104 7.742 0.362 26021 4018 1 7 . 1 1 17 17 GLU N N 17 121.655 121.655 122.150 -0.495 26021 4019 1 7 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.221 -0.088 26021 4020 1 7 . 1 1 17 17 GLU C C 17 179.007 179.007 179.235 -0.228 26021 4021 1 7 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.874 -0.063 26021 4022 1 7 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.525 -0.392 26021 4023 1 7 . 1 1 17 17 GLU H H 17 7.817 7.817 7.906 -0.089 26021 4024 1 7 . 1 1 18 18 LEU N N 18 117.834 117.834 119.165 -1.331 26021 4025 1 7 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.529 -0.411 26021 4026 1 7 . 1 1 18 18 LEU C C 18 177.658 177.658 177.090 0.568 26021 4027 1 7 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.036 1.993 26021 4028 1 7 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.173 0.497 26021 4029 1 7 . 1 1 18 18 LEU H H 18 7.389 7.389 7.936 -0.547 26021 4030 1 7 . 1 1 19 19 LEU N N 19 113.694 113.694 117.865 -4.171 26021 4031 1 7 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.463 -0.301 26021 4032 1 7 . 1 1 19 19 LEU C C 19 178.123 178.123 178.054 0.069 26021 4033 1 7 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.406 0.446 26021 4034 1 7 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.053 0.167 26021 4035 1 7 . 1 1 19 19 LEU H H 19 7.269 7.269 7.877 -0.608 26021 4036 1 7 . 1 1 20 20 VAL N N 20 112.778 112.778 116.672 -3.894 26021 4037 1 7 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.118 0.325 26021 4038 1 7 . 1 1 20 20 VAL C C 20 177.021 177.021 176.556 0.465 26021 4039 1 7 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.133 -1.278 26021 4040 1 7 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.497 0.281 26021 4041 1 7 . 1 1 20 20 VAL H H 20 7.356 7.356 7.518 -0.162 26021 4042 1 7 . 1 1 21 21 GLY N N 21 108.962 108.962 109.952 -0.990 26021 4043 1 7 . 1 1 21 21 GLY C C 21 173.813 173.813 174.003 -0.190 26021 4044 1 7 . 1 1 21 21 GLY CA C 21 45.046 45.046 45.211 -0.165 26021 4045 1 7 . 1 1 21 21 GLY H H 21 7.925 7.925 8.598 -0.673 26021 4046 1 7 . 1 1 22 22 GLU N N 22 120.607 120.607 120.136 0.471 26021 4047 1 7 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.522 -0.244 26021 4048 1 7 . 1 1 22 22 GLU C C 22 175.869 175.869 175.024 0.845 26021 4049 1 7 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.320 0.710 26021 4050 1 7 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.992 -0.311 26021 4051 1 7 . 1 1 22 22 GLU H H 22 8.300 8.300 8.547 -0.247 26021 4052 1 7 . 1 1 23 23 TYR N N 23 120.738 120.738 121.159 -0.421 26021 4053 1 7 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.682 -0.125 26021 4054 1 7 . 1 1 23 23 TYR C C 23 175.264 175.264 175.288 -0.024 26021 4055 1 7 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.346 0.215 26021 4056 1 7 . 1 1 23 23 TYR CB C 23 39.246 39.246 40.505 -1.259 26021 4057 1 7 . 1 1 23 23 TYR H H 23 7.756 7.756 7.834 -0.078 26021 4058 1 7 . 1 1 24 24 LYS N N 24 122.095 122.095 123.463 -1.368 26021 4059 1 7 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.662 -0.479 26021 4060 1 7 . 1 1 24 24 LYS C C 24 175.742 175.742 174.583 1.159 26021 4061 1 7 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.325 -0.207 26021 4062 1 7 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.077 -0.358 26021 4063 1 7 . 1 1 24 24 LYS H H 24 8.692 8.692 8.674 0.018 26021 4064 1 7 . 1 1 25 25 LEU N N 25 121.123 121.123 119.070 2.053 26021 4065 1 7 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.411 0.081 26021 4066 1 7 . 1 1 25 25 LEU C C 25 177.487 177.487 176.363 1.124 26021 4067 1 7 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.615 0.719 26021 4068 1 7 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.294 -0.536 26021 4069 1 7 . 1 1 25 25 LEU H H 25 8.088 8.088 7.576 0.512 26021 4070 1 7 . 1 1 26 26 HIS N N 26 122.993 122.993 119.376 3.617 26021 4071 1 7 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.606 -0.105 26021 4072 1 7 . 1 1 26 26 HIS C C 26 176.716 176.716 176.326 0.390 26021 4073 1 7 . 1 1 26 26 HIS CA C 26 57.197 57.197 55.677 1.520 26021 4074 1 7 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.689 0.668 26021 4075 1 7 . 1 1 26 26 HIS H H 26 8.882 8.882 8.230 0.652 26021 4076 1 7 . 1 1 27 27 LYS N N 27 124.894 124.894 123.926 0.968 26021 4077 1 7 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.231 -0.283 26021 4078 1 7 . 1 1 27 27 LYS C C 27 178.873 178.873 178.521 0.352 26021 4079 1 7 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.281 1.730 26021 4080 1 7 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.391 0.051 26021 4081 1 7 . 1 1 27 27 LYS H H 27 8.699 8.699 8.686 0.013 26021 4082 1 7 . 1 1 28 28 GLY N N 28 111.258 111.258 107.468 3.790 26021 4083 1 7 . 1 1 28 28 GLY C C 28 176.131 176.131 176.035 0.096 26021 4084 1 7 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.931 -0.441 26021 4085 1 7 . 1 1 28 28 GLY H H 28 9.814 9.814 8.611 1.203 26021 4086 1 7 . 1 1 29 29 VAL N N 29 122.719 122.719 121.829 0.890 26021 4087 1 7 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.609 0.283 26021 4088 1 7 . 1 1 29 29 VAL C C 29 177.628 177.628 177.875 -0.247 26021 4089 1 7 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.189 0.330 26021 4090 1 7 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.003 0.739 26021 4091 1 7 . 1 1 29 29 VAL H H 29 7.431 7.431 7.464 -0.033 26021 4092 1 7 . 1 1 30 30 LYS N N 30 119.791 119.791 119.324 0.467 26021 4093 1 7 . 1 1 30 30 LYS HA H 30 3.635 3.635 4.054 -0.419 26021 4094 1 7 . 1 1 30 30 LYS C C 30 177.666 177.666 179.140 -1.474 26021 4095 1 7 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.031 1.993 26021 4096 1 7 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.603 0.802 26021 4097 1 7 . 1 1 30 30 LYS H H 30 8.255 8.255 8.089 0.166 26021 4098 1 7 . 1 1 31 31 LYS N N 31 117.918 117.918 118.584 -0.666 26021 4099 1 7 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.130 -0.014 26021 4100 1 7 . 1 1 31 31 LYS C C 31 177.784 177.784 179.077 -1.293 26021 4101 1 7 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.276 -0.573 26021 4102 1 7 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.101 -0.256 26021 4103 1 7 . 1 1 31 31 LYS H H 31 7.689 7.689 7.905 -0.216 26021 4104 1 7 . 1 1 32 32 ASN N N 32 116.347 116.347 116.401 -0.054 26021 4105 1 7 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.362 0.158 26021 4106 1 7 . 1 1 32 32 ASN C C 32 177.764 177.764 177.069 0.695 26021 4107 1 7 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.949 0.366 26021 4108 1 7 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.568 0.064 26021 4109 1 7 . 1 1 32 32 ASN H H 32 7.556 7.556 7.842 -0.286 26021 4110 1 7 . 1 1 33 33 ILE N N 33 120.592 120.592 119.863 0.729 26021 4111 1 7 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.799 -0.517 26021 4112 1 7 . 1 1 33 33 ILE C C 33 177.074 177.074 177.600 -0.526 26021 4113 1 7 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.240 2.648 26021 4114 1 7 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.101 0.077 26021 4115 1 7 . 1 1 33 33 ILE H H 33 8.236 8.236 7.404 0.832 26021 4116 1 7 . 1 1 34 34 GLU N N 34 120.595 120.595 119.899 0.696 26021 4117 1 7 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.877 -0.089 26021 4118 1 7 . 1 1 34 34 GLU C C 34 179.739 179.739 178.793 0.946 26021 4119 1 7 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.815 0.424 26021 4120 1 7 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.815 1.030 26021 4121 1 7 . 1 1 34 34 GLU H H 34 8.551 8.551 8.738 -0.187 26021 4122 1 7 . 1 1 35 35 ASP N N 35 120.600 120.600 120.079 0.521 26021 4123 1 7 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.491 -0.079 26021 4124 1 7 . 1 1 35 35 ASP C C 35 178.681 178.681 178.530 0.151 26021 4125 1 7 . 1 1 35 35 ASP CA C 35 57.462 57.462 57.059 0.403 26021 4126 1 7 . 1 1 35 35 ASP CB C 35 39.750 39.750 41.087 -1.337 26021 4127 1 7 . 1 1 35 35 ASP H H 35 8.670 8.670 7.772 0.898 26021 4128 1 7 . 1 1 36 36 LEU N N 36 123.004 123.004 120.177 2.827 26021 4129 1 7 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.201 -0.106 26021 4130 1 7 . 1 1 36 36 LEU C C 36 178.035 178.035 179.037 -1.002 26021 4131 1 7 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.347 0.680 26021 4132 1 7 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.352 -0.476 26021 4133 1 7 . 1 1 36 36 LEU H H 36 8.166 8.166 7.790 0.376 26021 4134 1 7 . 1 1 37 37 LEU N N 37 120.178 120.178 120.369 -0.191 26021 4135 1 7 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.101 -0.245 26021 4136 1 7 . 1 1 37 37 LEU C C 37 178.128 178.128 178.044 0.084 26021 4137 1 7 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.602 1.073 26021 4138 1 7 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.633 0.522 26021 4139 1 7 . 1 1 37 37 LEU H H 37 8.736 8.736 8.458 0.278 26021 4140 1 7 . 1 1 38 38 LYS N N 38 118.110 118.110 119.462 -1.352 26021 4141 1 7 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.896 0.037 26021 4142 1 7 . 1 1 38 38 LYS C C 38 179.533 179.533 178.812 0.721 26021 4143 1 7 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.076 0.197 26021 4144 1 7 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.246 0.031 26021 4145 1 7 . 1 1 38 38 LYS H H 38 7.770 7.770 8.181 -0.411 26021 4146 1 7 . 1 1 39 39 GLU N N 39 119.265 119.265 118.750 0.515 26021 4147 1 7 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.148 0.154 26021 4148 1 7 . 1 1 39 39 GLU C C 39 179.720 179.720 178.874 0.846 26021 4149 1 7 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.121 -0.363 26021 4150 1 7 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.656 -0.066 26021 4151 1 7 . 1 1 39 39 GLU H H 39 7.709 7.709 7.593 0.116 26021 4152 1 7 . 1 1 40 40 LEU N N 40 119.007 119.007 119.894 -0.887 26021 4153 1 7 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.239 -0.189 26021 4154 1 7 . 1 1 40 40 LEU C C 40 179.690 179.690 178.942 0.748 26021 4155 1 7 . 1 1 40 40 LEU CA C 40 57.651 57.651 56.845 0.806 26021 4156 1 7 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.884 0.801 26021 4157 1 7 . 1 1 40 40 LEU H H 40 8.851 8.851 7.743 1.108 26021 4158 1 7 . 1 1 41 41 LYS N N 41 120.500 120.500 119.822 0.678 26021 4159 1 7 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.027 -0.075 26021 4160 1 7 . 1 1 41 41 LYS C C 41 180.223 180.223 179.267 0.956 26021 4161 1 7 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.816 1.075 26021 4162 1 7 . 1 1 41 41 LYS CB C 41 32.067 32.067 31.950 0.117 26021 4163 1 7 . 1 1 41 41 LYS H H 41 8.482 8.482 8.268 0.214 26021 4164 1 7 . 1 1 42 42 THR N N 42 119.555 119.555 114.536 5.019 26021 4165 1 7 . 1 1 42 42 THR HA H 42 4.000 4.000 4.178 -0.178 26021 4166 1 7 . 1 1 42 42 THR C C 42 176.633 176.633 176.569 0.064 26021 4167 1 7 . 1 1 42 42 THR CA C 42 66.574 66.574 64.881 1.693 26021 4168 1 7 . 1 1 42 42 THR CB C 42 67.924 67.924 68.814 -0.890 26021 4169 1 7 . 1 1 42 42 THR H H 42 7.863 7.863 7.513 0.350 26021 4170 1 7 . 1 1 43 43 MET N N 43 122.839 122.839 120.829 2.010 26021 4171 1 7 . 1 1 43 43 MET HA H 43 4.022 4.022 3.989 0.033 26021 4172 1 7 . 1 1 43 43 MET C C 43 177.290 177.290 177.570 -0.280 26021 4173 1 7 . 1 1 43 43 MET CA C 43 59.731 59.731 60.420 -0.689 26021 4174 1 7 . 1 1 43 43 MET CB C 43 33.610 33.610 32.438 1.172 26021 4175 1 7 . 1 1 43 43 MET H H 43 8.714 8.714 7.804 0.910 26021 4176 1 7 . 1 1 44 44 ASN N N 44 118.049 118.049 117.262 0.787 26021 4177 1 7 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.342 0.032 26021 4178 1 7 . 1 1 44 44 ASN C C 44 176.297 176.297 177.203 -0.906 26021 4179 1 7 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.334 0.560 26021 4180 1 7 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.864 0.542 26021 4181 1 7 . 1 1 44 44 ASN H H 44 8.988 8.988 7.857 1.131 26021 4182 1 7 . 1 1 45 45 ALA N N 45 119.260 119.260 121.278 -2.018 26021 4183 1 7 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.209 -0.143 26021 4184 1 7 . 1 1 45 45 ALA C C 45 180.476 180.476 178.911 1.565 26021 4185 1 7 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.412 0.856 26021 4186 1 7 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.323 -0.635 26021 4187 1 7 . 1 1 45 45 ALA H H 45 7.675 7.675 7.508 0.167 26021 4188 1 7 . 1 1 46 46 ALA N N 46 121.126 121.126 123.256 -2.130 26021 4189 1 7 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.120 -0.004 26021 4190 1 7 . 1 1 46 46 ALA C C 46 179.314 179.314 179.162 0.152 26021 4191 1 7 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.303 -0.317 26021 4192 1 7 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.663 -0.441 26021 4193 1 7 . 1 1 46 46 ALA H H 46 7.872 7.872 7.487 0.385 26021 4194 1 7 . 1 1 47 47 LEU N N 47 119.328 119.328 116.278 3.050 26021 4195 1 7 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.005 0.186 26021 4196 1 7 . 1 1 47 47 LEU C C 47 180.403 180.403 178.543 1.860 26021 4197 1 7 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.015 0.031 26021 4198 1 7 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.383 0.567 26021 4199 1 7 . 1 1 47 47 LEU H H 47 8.529 8.529 7.597 0.932 26021 4200 1 7 . 1 1 48 48 ILE N N 48 121.653 121.653 118.747 2.906 26021 4201 1 7 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.674 0.028 26021 4202 1 7 . 1 1 48 48 ILE C C 48 178.730 178.730 178.254 0.476 26021 4203 1 7 . 1 1 48 48 ILE CA C 48 64.910 64.910 65.095 -0.185 26021 4204 1 7 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.620 0.292 26021 4205 1 7 . 1 1 48 48 ILE H H 48 8.386 8.386 7.064 1.322 26021 4206 1 7 . 1 1 49 49 LYS N N 49 119.896 119.896 120.034 -0.138 26021 4207 1 7 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.127 -0.084 26021 4208 1 7 . 1 1 49 49 LYS C C 49 179.999 179.999 179.124 0.875 26021 4209 1 7 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.373 -0.317 26021 4210 1 7 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.457 -0.496 26021 4211 1 7 . 1 1 49 49 LYS H H 49 7.456 7.456 7.673 -0.217 26021 4212 1 7 . 1 1 50 50 ILE N N 50 119.964 119.964 114.800 5.164 26021 4213 1 7 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.055 -0.319 26021 4214 1 7 . 1 1 50 50 ILE C C 50 177.960 177.960 177.178 0.782 26021 4215 1 7 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.982 0.367 26021 4216 1 7 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.837 0.295 26021 4217 1 7 . 1 1 50 50 ILE H H 50 8.154 8.154 8.436 -0.282 26021 4218 1 7 . 1 1 51 51 GLY N N 51 106.709 106.709 106.074 0.635 26021 4219 1 7 . 1 1 51 51 GLY C C 51 174.461 174.461 175.259 -0.798 26021 4220 1 7 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.508 0.401 26021 4221 1 7 . 1 1 51 51 GLY H H 51 7.932 7.932 7.618 0.314 26021 4222 1 7 . 1 1 52 52 GLU N N 52 118.736 118.736 118.735 0.001 26021 4223 1 7 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.368 -0.048 26021 4224 1 7 . 1 1 52 52 GLU C C 52 176.789 176.789 177.519 -0.730 26021 4225 1 7 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.030 -0.756 26021 4226 1 7 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.334 -0.222 26021 4227 1 7 . 1 1 52 52 GLU H H 52 7.597 7.597 7.714 -0.117 26021 4228 1 7 . 1 1 53 53 VAL N N 53 122.982 122.982 119.148 3.834 26021 4229 1 7 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.196 0.065 26021 4230 1 7 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.895 1.490 26021 4231 1 7 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.789 2.033 26021 4232 1 7 . 1 1 53 53 VAL H H 53 7.511 7.511 7.371 0.140 26021 4233 1 7 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.797 -0.152 26021 4234 1 7 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.563 0.015 26021 4235 1 7 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.033 0.502 26021 4236 1 7 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.325 -0.134 26021 4237 1 7 . 1 1 55 55 PRO C C 55 178.258 178.258 176.649 1.609 26021 4238 1 7 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.312 1.116 26021 4239 1 7 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.975 -0.129 26021 4240 1 7 . 1 1 56 56 ASP N N 56 114.117 114.117 116.516 -2.399 26021 4241 1 7 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.503 -0.012 26021 4242 1 7 . 1 1 56 56 ASP C C 56 176.696 176.696 177.387 -0.691 26021 4243 1 7 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.813 -0.675 26021 4244 1 7 . 1 1 56 56 ASP CB C 56 39.726 39.726 41.096 -1.370 26021 4245 1 7 . 1 1 56 56 ASP H H 56 8.489 8.489 8.394 0.095 26021 4246 1 7 . 1 1 57 57 GLN N N 57 117.641 117.641 117.135 0.506 26021 4247 1 7 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.342 0.032 26021 4248 1 7 . 1 1 57 57 GLN C C 57 175.765 175.765 176.899 -1.134 26021 4249 1 7 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.618 -0.328 26021 4250 1 7 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.711 -0.065 26021 4251 1 7 . 1 1 57 57 GLN H H 57 8.206 8.206 7.654 0.552 26021 4252 1 7 . 1 1 58 58 LEU N N 58 122.141 122.141 123.289 -1.148 26021 4253 1 7 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.136 0.314 26021 4254 1 7 . 1 1 58 58 LEU C C 58 176.849 176.849 176.365 0.484 26021 4255 1 7 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.535 -0.541 26021 4256 1 7 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.412 0.819 26021 4257 1 7 . 1 1 58 58 LEU H H 58 7.152 7.152 7.574 -0.422 26021 4258 1 7 . 1 1 59 59 ASP N N 59 125.643 125.643 122.013 3.630 26021 4259 1 7 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.931 -0.212 26021 4260 1 7 . 1 1 59 59 ASP C C 59 177.249 177.249 176.840 0.409 26021 4261 1 7 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.024 0.379 26021 4262 1 7 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.134 -0.902 26021 4263 1 7 . 1 1 59 59 ASP H H 59 9.312 9.312 8.213 1.099 26021 4264 1 7 . 1 1 60 60 SER N N 60 116.550 116.550 114.892 1.658 26021 4265 1 7 . 1 1 60 60 SER HA H 60 4.124 4.124 4.233 -0.109 26021 4266 1 7 . 1 1 60 60 SER C C 60 176.840 176.840 176.519 0.321 26021 4267 1 7 . 1 1 60 60 SER CA C 60 61.722 61.722 61.468 0.254 26021 4268 1 7 . 1 1 60 60 SER CB C 60 62.815 62.815 63.353 -0.538 26021 4269 1 7 . 1 1 60 60 SER H H 60 8.647 8.647 8.444 0.203 26021 4270 1 7 . 1 1 61 61 GLN N N 61 121.394 121.394 119.992 1.402 26021 4271 1 7 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.166 -0.035 26021 4272 1 7 . 1 1 61 61 GLN C C 61 178.629 178.629 177.677 0.952 26021 4273 1 7 . 1 1 61 61 GLN CA C 61 58.753 58.753 59.136 -0.383 26021 4274 1 7 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.101 0.152 26021 4275 1 7 . 1 1 61 61 GLN H H 61 8.453 8.453 8.685 -0.232 26021 4276 1 7 . 1 1 62 62 ASP N N 62 122.187 122.187 118.868 3.319 26021 4277 1 7 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.561 0.058 26021 4278 1 7 . 1 1 62 62 ASP C C 62 178.318 178.318 178.606 -0.288 26021 4279 1 7 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.736 -0.274 26021 4280 1 7 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.010 1.026 26021 4281 1 7 . 1 1 62 62 ASP H H 62 8.311 8.311 8.812 -0.501 26021 4282 1 7 . 1 1 63 63 LYS N N 63 120.325 120.325 119.152 1.173 26021 4283 1 7 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.109 -0.100 26021 4284 1 7 . 1 1 63 63 LYS C C 63 178.765 178.765 179.087 -0.322 26021 4285 1 7 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.776 0.977 26021 4286 1 7 . 1 1 63 63 LYS CB C 63 32.453 32.453 31.956 0.496 26021 4287 1 7 . 1 1 63 63 LYS H H 63 7.923 7.923 7.714 0.209 26021 4288 1 7 . 1 1 64 64 LEU N N 64 119.491 119.491 119.310 0.181 26021 4289 1 7 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.154 0.072 26021 4290 1 7 . 1 1 64 64 LEU C C 64 179.526 179.526 178.933 0.593 26021 4291 1 7 . 1 1 64 64 LEU CA C 64 57.798 57.798 58.052 -0.254 26021 4292 1 7 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.695 0.080 26021 4293 1 7 . 1 1 64 64 LEU H H 64 7.820 7.820 7.302 0.518 26021 4294 1 7 . 1 1 65 65 TRP N N 65 120.674 120.674 121.944 -1.270 26021 4295 1 7 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.476 -0.168 26021 4296 1 7 . 1 1 65 65 TRP C C 65 177.379 177.379 177.655 -0.276 26021 4297 1 7 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.154 1.648 26021 4298 1 7 . 1 1 65 65 TRP CB C 65 28.411 28.411 29.012 -0.601 26021 4299 1 7 . 1 1 65 65 TRP H H 65 8.196 8.196 8.262 -0.066 26021 4300 1 7 . 1 1 66 66 ALA N N 66 120.606 120.606 119.959 0.647 26021 4301 1 7 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.427 0.282 26021 4302 1 7 . 1 1 66 66 ALA C C 66 180.376 180.376 179.426 0.950 26021 4303 1 7 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.936 0.628 26021 4304 1 7 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.749 -0.095 26021 4305 1 7 . 1 1 66 66 ALA H H 66 8.305 8.305 8.183 0.122 26021 4306 1 7 . 1 1 67 67 ASP N N 67 119.175 119.175 118.347 0.828 26021 4307 1 7 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.369 0.081 26021 4308 1 7 . 1 1 67 67 ASP C C 67 178.757 178.757 178.109 0.648 26021 4309 1 7 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.211 0.281 26021 4310 1 7 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.961 -0.807 26021 4311 1 7 . 1 1 67 67 ASP H H 67 7.945 7.945 7.619 0.326 26021 4312 1 7 . 1 1 68 68 GLU N N 68 122.322 122.322 120.141 2.181 26021 4313 1 7 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.371 -0.356 26021 4314 1 7 . 1 1 68 68 GLU C C 68 180.055 180.055 179.184 0.871 26021 4315 1 7 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.042 1.068 26021 4316 1 7 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.757 -0.110 26021 4317 1 7 . 1 1 68 68 GLU H H 68 8.168 8.168 7.720 0.448 26021 4318 1 7 . 1 1 69 69 VAL N N 69 122.135 122.135 117.977 4.158 26021 4319 1 7 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.767 -0.515 26021 4320 1 7 . 1 1 69 69 VAL C C 69 177.736 177.736 177.418 0.318 26021 4321 1 7 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.336 1.203 26021 4322 1 7 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.040 0.202 26021 4323 1 7 . 1 1 69 69 VAL H H 69 8.424 8.424 7.501 0.923 26021 4324 1 7 . 1 1 70 70 ARG N N 70 121.373 121.373 119.289 2.084 26021 4325 1 7 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.093 -0.401 26021 4326 1 7 . 1 1 70 70 ARG C C 70 179.117 179.117 178.802 0.315 26021 4327 1 7 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.684 1.481 26021 4328 1 7 . 1 1 70 70 ARG CB C 70 29.654 29.654 30.063 -0.409 26021 4329 1 7 . 1 1 70 70 ARG H H 70 7.916 7.916 7.341 0.575 26021 4330 1 7 . 1 1 71 71 GLU N N 71 119.075 119.075 119.812 -0.737 26021 4331 1 7 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.025 0.038 26021 4332 1 7 . 1 1 71 71 GLU C C 71 179.119 179.119 179.012 0.107 26021 4333 1 7 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.058 0.629 26021 4334 1 7 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.633 0.637 26021 4335 1 7 . 1 1 71 71 GLU H H 71 8.031 8.031 8.336 -0.305 26021 4336 1 7 . 1 1 72 72 LEU N N 72 120.503 120.503 121.150 -0.647 26021 4337 1 7 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.088 -0.031 26021 4338 1 7 . 1 1 72 72 LEU C C 72 178.734 178.734 178.641 0.093 26021 4339 1 7 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.002 0.420 26021 4340 1 7 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.795 -0.387 26021 4341 1 7 . 1 1 72 72 LEU H H 72 8.175 8.175 7.672 0.503 26021 4342 1 7 . 1 1 73 73 SER N N 73 115.243 115.243 116.391 -1.148 26021 4343 1 7 . 1 1 73 73 SER HA H 73 3.824 3.824 4.049 -0.225 26021 4344 1 7 . 1 1 73 73 SER C C 73 175.697 175.697 176.659 -0.962 26021 4345 1 7 . 1 1 73 73 SER CA C 73 62.384 62.384 61.575 0.809 26021 4346 1 7 . 1 1 73 73 SER CB C 73 62.093 62.093 62.858 -0.764 26021 4347 1 7 . 1 1 73 73 SER H H 73 8.411 8.411 8.212 0.199 26021 4348 1 7 . 1 1 74 74 TYR N N 74 121.342 121.342 123.349 -2.007 26021 4349 1 7 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.214 0.277 26021 4350 1 7 . 1 1 74 74 TYR C C 74 178.747 178.747 177.713 1.034 26021 4351 1 7 . 1 1 74 74 TYR CA C 74 60.435 60.435 61.277 -0.842 26021 4352 1 7 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.465 -0.958 26021 4353 1 7 . 1 1 74 74 TYR H H 74 7.314 7.314 7.950 -0.636 26021 4354 1 7 . 1 1 75 75 VAL N N 75 120.779 120.779 117.960 2.819 26021 4355 1 7 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.845 0.016 26021 4356 1 7 . 1 1 75 75 VAL C C 75 179.788 179.788 178.509 1.279 26021 4357 1 7 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.699 0.349 26021 4358 1 7 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.587 0.127 26021 4359 1 7 . 1 1 75 75 VAL H H 75 7.740 7.740 7.743 -0.003 26021 4360 1 7 . 1 1 76 76 ILE N N 76 120.598 120.598 120.902 -0.304 26021 4361 1 7 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.603 0.097 26021 4362 1 7 . 1 1 76 76 ILE C C 76 177.066 177.066 178.249 -1.183 26021 4363 1 7 . 1 1 76 76 ILE CA C 76 65.919 65.919 65.285 0.634 26021 4364 1 7 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.355 0.030 26021 4365 1 7 . 1 1 76 76 ILE H H 76 8.584 8.584 7.365 1.219 26021 4366 1 7 . 1 1 77 77 GLU N N 77 120.468 120.468 119.484 0.984 26021 4367 1 7 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.910 -0.261 26021 4368 1 7 . 1 1 77 77 GLU C C 77 177.502 177.502 178.698 -1.196 26021 4369 1 7 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.790 1.072 26021 4370 1 7 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.703 0.649 26021 4371 1 7 . 1 1 77 77 GLU H H 77 8.445 8.445 7.809 0.636 26021 4372 1 7 . 1 1 78 78 ASP N N 78 117.382 117.382 119.628 -2.246 26021 4373 1 7 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.311 0.080 26021 4374 1 7 . 1 1 78 78 ASP C C 78 177.382 177.382 178.089 -0.707 26021 4375 1 7 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.772 0.723 26021 4376 1 7 . 1 1 78 78 ASP CB C 78 41.935 41.935 39.982 1.953 26021 4377 1 7 . 1 1 78 78 ASP H H 78 7.885 7.885 7.816 0.069 26021 4378 1 7 . 1 1 79 79 ALA N N 79 120.171 120.171 121.840 -1.669 26021 4379 1 7 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.008 0.043 26021 4380 1 7 . 1 1 79 79 ALA C C 79 181.193 181.193 178.906 2.287 26021 4381 1 7 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.019 0.036 26021 4382 1 7 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.669 -0.249 26021 4383 1 7 . 1 1 79 79 ALA H H 79 7.754 7.754 7.889 -0.135 26021 4384 1 7 . 1 1 80 80 VAL N N 80 119.541 119.541 112.550 6.991 26021 4385 1 7 . 1 1 80 80 VAL HA H 80 3.677 3.677 4.082 -0.405 26021 4386 1 7 . 1 1 80 80 VAL C C 80 177.096 177.096 177.848 -0.752 26021 4387 1 7 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.249 2.835 26021 4388 1 7 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.994 -0.551 26021 4389 1 7 . 1 1 80 80 VAL H H 80 8.635 8.635 7.426 1.209 26021 4390 1 7 . 1 1 81 81 ASP N N 81 121.140 121.140 122.085 -0.945 26021 4391 1 7 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.265 0.204 26021 4392 1 7 . 1 1 81 81 ASP C C 81 179.569 179.569 177.994 1.575 26021 4393 1 7 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.747 0.182 26021 4394 1 7 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.706 -0.771 26021 4395 1 7 . 1 1 81 81 ASP H H 81 8.575 8.575 8.473 0.102 26021 4396 1 7 . 1 1 82 82 LYS N N 82 118.159 118.159 118.163 -0.004 26021 4397 1 7 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.000 0.021 26021 4398 1 7 . 1 1 82 82 LYS C C 82 178.890 178.890 178.915 -0.025 26021 4399 1 7 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.385 0.682 26021 4400 1 7 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.861 0.726 26021 4401 1 7 . 1 1 82 82 LYS H H 82 8.079 8.079 7.618 0.461 26021 4402 1 7 . 1 1 83 83 PHE N N 83 120.900 120.900 120.051 0.849 26021 4403 1 7 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.169 0.107 26021 4404 1 7 . 1 1 83 83 PHE C C 83 177.269 177.269 176.881 0.388 26021 4405 1 7 . 1 1 83 83 PHE CA C 83 60.943 60.943 61.822 -0.879 26021 4406 1 7 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.171 0.576 26021 4407 1 7 . 1 1 83 83 PHE H H 83 8.015 8.015 8.188 -0.173 26021 4408 1 7 . 1 1 84 84 LEU N N 84 118.209 118.209 116.500 1.709 26021 4409 1 7 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.436 -0.494 26021 4410 1 7 . 1 1 84 84 LEU C C 84 178.774 178.774 178.537 0.237 26021 4411 1 7 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.475 -0.305 26021 4412 1 7 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.185 1.008 26021 4413 1 7 . 1 1 84 84 LEU H H 84 8.338 8.338 7.705 0.633 26021 4414 1 7 . 1 1 85 85 VAL N N 85 116.078 116.078 119.366 -3.288 26021 4415 1 7 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.852 0.139 26021 4416 1 7 . 1 1 85 85 VAL C C 85 177.252 177.252 177.061 0.191 26021 4417 1 7 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.603 -1.423 26021 4418 1 7 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.080 0.810 26021 4419 1 7 . 1 1 85 85 VAL H H 85 7.447 7.447 7.833 -0.386 26021 4420 1 7 . 1 1 86 86 ARG N N 86 120.842 120.842 117.303 3.539 26021 4421 1 7 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.153 0.074 26021 4422 1 7 . 1 1 86 86 ARG C C 86 177.520 177.520 179.330 -1.810 26021 4423 1 7 . 1 1 86 86 ARG CA C 86 57.059 57.059 57.851 -0.792 26021 4424 1 7 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.172 0.091 26021 4425 1 7 . 1 1 86 86 ARG H H 86 7.598 7.598 7.443 0.155 26021 4426 1 7 . 1 1 87 87 VAL N N 87 119.293 119.293 117.137 2.156 26021 4427 1 7 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.832 -0.007 26021 4428 1 7 . 1 1 87 87 VAL C C 87 176.121 176.121 176.933 -0.812 26021 4429 1 7 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.275 -1.837 26021 4430 1 7 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.699 1.073 26021 4431 1 7 . 1 1 87 87 VAL H H 87 7.994 7.994 7.651 0.343 26021 4432 1 7 . 1 1 88 88 HIS N N 88 120.016 120.016 118.453 1.563 26021 4433 1 7 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.375 0.262 26021 4434 1 7 . 1 1 88 88 HIS C C 88 175.639 175.639 176.029 -0.390 26021 4435 1 7 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.427 -0.076 26021 4436 1 7 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.774 -1.093 26021 4437 1 7 . 1 1 88 88 HIS H H 88 7.969 7.969 8.094 -0.125 26021 4438 1 7 . 1 1 89 89 GLY N N 89 109.587 109.587 106.519 3.068 26021 4439 1 7 . 1 1 89 89 GLY C C 89 173.730 173.730 174.138 -0.408 26021 4440 1 7 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.052 0.117 26021 4441 1 7 . 1 1 89 89 GLY H H 89 8.083 8.083 7.902 0.181 26021 4442 1 7 . 1 1 90 90 VAL N N 90 118.224 118.224 122.364 -4.140 26021 4443 1 7 . 1 1 90 90 VAL HA H 90 4.138 4.138 3.852 0.286 26021 4444 1 7 . 1 1 90 90 VAL C C 90 176.018 176.018 175.690 0.328 26021 4445 1 7 . 1 1 90 90 VAL CA C 90 62.425 62.425 62.898 -0.472 26021 4446 1 7 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.508 0.108 26021 4447 1 7 . 1 1 90 90 VAL H H 90 7.944 7.944 7.845 0.099 26021 4448 1 7 . 1 1 91 91 GLU N N 91 124.313 124.313 123.620 0.693 26021 4449 1 7 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.756 -0.150 26021 4450 1 7 . 1 1 91 91 GLU CA C 91 54.176 54.176 53.248 0.928 26021 4451 1 7 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.442 0.318 26021 4452 1 7 . 1 1 91 91 GLU H H 91 8.423 8.423 8.280 0.143 26021 4453 1 7 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.503 -0.166 26021 4454 1 7 . 1 1 92 92 PRO C C 92 176.504 176.504 175.862 0.642 26021 4455 1 7 . 1 1 92 92 PRO CA C 92 63.372 63.372 62.965 0.408 26021 4456 1 7 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.522 -0.355 26021 4457 1 7 . 1 1 93 93 ASP N N 93 120.275 120.275 118.686 1.589 26021 4458 1 7 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.768 -0.196 26021 4459 1 7 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.320 0.650 26021 4460 1 7 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.421 -1.906 26021 4461 1 7 . 1 1 93 93 ASP H H 93 8.286 8.286 8.249 0.037 26021 4462 1 7 . 1 1 94 94 ASP N N 94 121.181 121.181 118.676 2.505 26021 4463 1 7 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.530 0.035 26021 4464 1 7 . 1 1 94 94 ASP C C 94 176.474 176.474 176.939 -0.465 26021 4465 1 7 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.813 -1.440 26021 4466 1 7 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.123 0.102 26021 4467 1 7 . 1 1 94 94 ASP H H 94 8.259 8.259 8.713 -0.454 26021 4468 1 7 . 1 1 95 95 ASN N N 95 118.728 118.728 118.031 0.697 26021 4469 1 7 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.649 0.045 26021 4470 1 7 . 1 1 95 95 ASN C C 95 176.272 176.272 176.982 -0.710 26021 4471 1 7 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.359 -1.373 26021 4472 1 7 . 1 1 95 95 ASN CB C 95 38.729 38.729 39.076 -0.347 26021 4473 1 7 . 1 1 95 95 ASN H H 95 8.474 8.474 8.217 0.257 26021 4474 1 7 . 1 1 96 96 THR N N 96 113.868 113.868 114.976 -1.108 26021 4475 1 7 . 1 1 96 96 THR HA H 96 4.220 4.220 4.244 -0.024 26021 4476 1 7 . 1 1 96 96 THR C C 96 175.107 175.107 175.870 -0.763 26021 4477 1 7 . 1 1 96 96 THR CA C 96 63.200 63.200 64.663 -1.463 26021 4478 1 7 . 1 1 96 96 THR CB C 96 69.475 69.475 68.720 0.755 26021 4479 1 7 . 1 1 96 96 THR H H 96 8.263 8.263 7.762 0.501 26021 4480 1 7 . 1 1 97 97 ASN N N 97 119.954 119.954 118.256 1.698 26021 4481 1 7 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.585 0.031 26021 4482 1 7 . 1 1 97 97 ASN C C 97 176.275 176.275 176.411 -0.136 26021 4483 1 7 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.312 -0.356 26021 4484 1 7 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.348 0.344 26021 4485 1 7 . 1 1 97 97 ASN H H 97 8.431 8.431 7.897 0.534 26021 4486 1 7 . 1 1 98 98 GLY N N 98 108.847 108.847 106.893 1.954 26021 4487 1 7 . 1 1 98 98 GLY C C 98 175.533 175.533 175.137 0.396 26021 4488 1 7 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.137 -0.126 26021 4489 1 7 . 1 1 98 98 GLY H H 98 8.338 8.338 7.640 0.698 26021 4490 1 7 . 1 1 99 99 PHE N N 99 118.492 118.492 119.817 -1.325 26021 4491 1 7 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.202 0.046 26021 4492 1 7 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.825 1.135 26021 4493 1 7 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.329 -1.170 26021 4494 1 7 . 1 1 99 99 PHE H H 99 8.370 8.370 8.135 0.235 26021 4495 1 7 . 1 1 100 100 LYS N N 100 120.987 120.987 120.927 0.060 26021 4496 1 7 . 1 1 100 100 LYS H H 100 8.256 8.256 8.474 -0.218 26021 4497 1 7 . 1 1 101 101 GLY N N 101 108.186 108.186 106.542 1.644 26021 4498 1 7 . 1 1 101 101 GLY C C 101 177.075 177.075 176.007 1.068 26021 4499 1 7 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.639 0.263 26021 4500 1 7 . 1 1 101 101 GLY H H 101 8.300 8.300 8.136 0.164 26021 4501 1 7 . 1 1 102 102 LEU N N 102 121.439 121.439 123.305 -1.866 26021 4502 1 7 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.082 0.015 26021 4503 1 7 . 1 1 102 102 LEU C C 102 179.836 179.836 178.356 1.480 26021 4504 1 7 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.518 -0.160 26021 4505 1 7 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.990 -0.220 26021 4506 1 7 . 1 1 102 102 LEU H H 102 7.777 7.777 7.831 -0.054 26021 4507 1 7 . 1 1 103 103 MET N N 103 122.290 122.290 118.367 3.923 26021 4508 1 7 . 1 1 103 103 MET HA H 103 4.220 4.220 3.890 0.330 26021 4509 1 7 . 1 1 103 103 MET C C 103 177.739 177.739 178.132 -0.393 26021 4510 1 7 . 1 1 103 103 MET CA C 103 58.739 58.739 58.076 0.663 26021 4511 1 7 . 1 1 103 103 MET CB C 103 31.895 31.895 31.822 0.073 26021 4512 1 7 . 1 1 103 103 MET H H 103 8.409 8.409 8.152 0.257 26021 4513 1 7 . 1 1 104 104 LYS N N 104 119.750 119.750 118.692 1.058 26021 4514 1 7 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.015 0.052 26021 4515 1 7 . 1 1 104 104 LYS C C 104 179.301 179.301 179.238 0.063 26021 4516 1 7 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.916 0.848 26021 4517 1 7 . 1 1 104 104 LYS CB C 104 32.047 32.047 32.118 -0.071 26021 4518 1 7 . 1 1 104 104 LYS H H 104 7.916 7.916 7.456 0.460 26021 4519 1 7 . 1 1 105 105 ARG N N 105 117.967 117.967 118.830 -0.863 26021 4520 1 7 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.155 -0.129 26021 4521 1 7 . 1 1 105 105 ARG C C 105 178.777 178.777 178.465 0.312 26021 4522 1 7 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.330 0.034 26021 4523 1 7 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.427 0.570 26021 4524 1 7 . 1 1 105 105 ARG H H 105 7.719 7.719 8.060 -0.341 26021 4525 1 7 . 1 1 106 106 THR N N 106 117.211 117.211 112.673 4.538 26021 4526 1 7 . 1 1 106 106 THR HA H 106 4.301 4.301 4.250 0.051 26021 4527 1 7 . 1 1 106 106 THR C C 106 176.254 176.254 176.593 -0.339 26021 4528 1 7 . 1 1 106 106 THR CA C 106 67.860 67.860 66.000 1.860 26021 4529 1 7 . 1 1 106 106 THR CB C 106 67.860 67.860 68.608 -0.748 26021 4530 1 7 . 1 1 106 106 THR H H 106 8.152 8.152 7.973 0.179 26021 4531 1 7 . 1 1 107 107 THR N N 107 117.939 117.939 116.928 1.011 26021 4532 1 7 . 1 1 107 107 THR HA H 107 3.971 3.971 3.979 -0.008 26021 4533 1 7 . 1 1 107 107 THR C C 107 176.780 176.780 176.117 0.663 26021 4534 1 7 . 1 1 107 107 THR CA C 107 66.822 66.822 66.094 0.728 26021 4535 1 7 . 1 1 107 107 THR CB C 107 68.818 68.818 68.664 0.154 26021 4536 1 7 . 1 1 107 107 THR H H 107 8.651 8.651 8.020 0.631 26021 4537 1 7 . 1 1 108 108 LYS N N 108 120.867 120.867 120.882 -0.015 26021 4538 1 7 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.065 -0.043 26021 4539 1 7 . 1 1 108 108 LYS C C 108 179.045 179.045 178.747 0.298 26021 4540 1 7 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.892 0.942 26021 4541 1 7 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.109 0.363 26021 4542 1 7 . 1 1 108 108 LYS H H 108 7.694 7.694 7.586 0.108 26021 4543 1 7 . 1 1 109 109 LEU N N 109 119.472 119.472 117.902 1.570 26021 4544 1 7 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.323 -0.002 26021 4545 1 7 . 1 1 109 109 LEU C C 109 179.974 179.974 179.322 0.652 26021 4546 1 7 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.344 0.249 26021 4547 1 7 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.394 -0.534 26021 4548 1 7 . 1 1 109 109 LEU H H 109 7.559 7.559 7.783 -0.224 26021 4549 1 7 . 1 1 110 110 LEU N N 110 121.832 121.832 119.766 2.066 26021 4550 1 7 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.027 0.164 26021 4551 1 7 . 1 1 110 110 LEU C C 110 178.101 178.101 178.610 -0.509 26021 4552 1 7 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.676 0.216 26021 4553 1 7 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.054 0.830 26021 4554 1 7 . 1 1 110 110 LEU H H 110 8.567 8.567 7.768 0.799 26021 4555 1 7 . 1 1 111 111 LYS N N 111 117.972 117.972 118.525 -0.553 26021 4556 1 7 . 1 1 111 111 LYS HA H 111 3.979 3.979 3.920 0.059 26021 4557 1 7 . 1 1 111 111 LYS C C 111 177.677 177.677 178.819 -1.142 26021 4558 1 7 . 1 1 111 111 LYS CA C 111 58.785 58.785 59.761 -0.976 26021 4559 1 7 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.020 0.188 26021 4560 1 7 . 1 1 111 111 LYS H H 111 7.965 7.965 8.317 -0.352 26021 4561 1 7 . 1 1 112 112 LYS N N 112 115.433 115.433 118.558 -3.125 26021 4562 1 7 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.015 0.095 26021 4563 1 7 . 1 1 112 112 LYS C C 112 178.270 178.270 178.187 0.083 26021 4564 1 7 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.518 0.433 26021 4565 1 7 . 1 1 112 112 LYS CB C 112 32.791 32.791 31.979 0.812 26021 4566 1 7 . 1 1 112 112 LYS H H 112 7.334 7.334 7.442 -0.108 26021 4567 1 7 . 1 1 113 113 VAL N N 113 114.861 114.861 119.590 -4.729 26021 4568 1 7 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.806 0.025 26021 4569 1 7 . 1 1 113 113 VAL C C 113 176.999 176.999 177.419 -0.420 26021 4570 1 7 . 1 1 113 113 VAL CA C 113 63.505 63.505 66.342 -2.837 26021 4571 1 7 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.900 0.387 26021 4572 1 7 . 1 1 113 113 VAL H H 113 7.298 7.298 7.222 0.076 26021 4573 1 7 . 1 1 114 114 VAL N N 114 121.457 121.457 119.912 1.545 26021 4574 1 7 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.699 0.023 26021 4575 1 7 . 1 1 114 114 VAL C C 114 177.737 177.737 177.405 0.332 26021 4576 1 7 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.683 -1.459 26021 4577 1 7 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.935 -0.182 26021 4578 1 7 . 1 1 114 114 VAL H H 114 7.855 7.855 8.587 -0.732 26021 4579 1 7 . 1 1 115 115 ASP N N 115 120.804 120.804 118.610 2.194 26021 4580 1 7 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.443 0.012 26021 4581 1 7 . 1 1 115 115 ASP C C 115 177.380 177.380 177.051 0.329 26021 4582 1 7 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.080 -0.159 26021 4583 1 7 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.851 -0.479 26021 4584 1 7 . 1 1 115 115 ASP H H 115 8.311 8.311 7.932 0.379 26021 4585 1 7 . 1 1 116 116 LYS N N 116 119.582 119.582 117.913 1.669 26021 4586 1 7 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.089 0.006 26021 4587 1 7 . 1 1 116 116 LYS C C 116 177.077 177.077 177.806 -0.729 26021 4588 1 7 . 1 1 116 116 LYS CA C 116 57.711 57.711 58.264 -0.553 26021 4589 1 7 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.733 -0.245 26021 4590 1 7 . 1 1 116 116 LYS H H 116 7.639 7.639 7.659 -0.020 26021 4591 1 7 . 1 1 117 117 HIS N N 117 115.246 115.246 112.259 2.987 26021 4592 1 7 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.797 -0.172 26021 4593 1 7 . 1 1 117 117 HIS C C 117 175.497 175.497 175.861 -0.364 26021 4594 1 7 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.494 -0.319 26021 4595 1 7 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.301 -1.826 26021 4596 1 7 . 1 1 117 117 HIS H H 117 8.108 8.108 8.012 0.096 26021 4597 1 7 . 1 1 118 118 GLY N N 118 109.944 109.944 107.987 1.957 26021 4598 1 7 . 1 1 118 118 GLY C C 118 174.093 174.093 174.139 -0.046 26021 4599 1 7 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.884 1.180 26021 4600 1 7 . 1 1 118 118 GLY H H 118 8.153 8.153 7.686 0.467 26021 4601 1 7 . 1 1 119 119 ILE N N 119 118.468 118.468 122.783 -4.315 26021 4602 1 7 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.896 0.226 26021 4603 1 7 . 1 1 119 119 ILE C C 119 174.777 174.777 176.357 -1.580 26021 4604 1 7 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.078 0.024 26021 4605 1 7 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.700 1.931 26021 4606 1 7 . 1 1 119 119 ILE H H 119 7.828 7.828 7.876 -0.048 26021 4607 1 8 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.592 0.157 26021 4608 1 8 . 1 1 4 4 ASN C C 4 175.260 175.260 176.452 -1.192 26021 4609 1 8 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.449 -0.618 26021 4610 1 8 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.697 -0.015 26021 4611 1 8 . 1 1 5 5 ALA N N 5 123.648 123.648 122.013 1.635 26021 4612 1 8 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.605 -0.315 26021 4613 1 8 . 1 1 5 5 ALA C C 5 178.256 178.256 178.810 -0.554 26021 4614 1 8 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.981 1.100 26021 4615 1 8 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.436 0.589 26021 4616 1 8 . 1 1 5 5 ALA H H 5 8.520 8.520 8.404 0.116 26021 4617 1 8 . 1 1 6 6 GLY N N 6 107.044 107.044 108.044 -1.000 26021 4618 1 8 . 1 1 6 6 GLY C C 6 174.961 174.961 175.563 -0.602 26021 4619 1 8 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.649 -0.819 26021 4620 1 8 . 1 1 6 6 GLY H H 6 8.350 8.350 8.341 0.009 26021 4621 1 8 . 1 1 7 7 ALA N N 7 123.366 123.366 123.781 -0.415 26021 4622 1 8 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.172 0.044 26021 4623 1 8 . 1 1 7 7 ALA C C 7 179.006 179.006 178.701 0.305 26021 4624 1 8 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.490 -0.787 26021 4625 1 8 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.421 0.423 26021 4626 1 8 . 1 1 7 7 ALA H H 7 8.078 8.078 7.993 0.085 26021 4627 1 8 . 1 1 8 8 ILE N N 8 117.376 117.376 118.490 -1.114 26021 4628 1 8 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.764 0.016 26021 4629 1 8 . 1 1 8 8 ILE C C 8 177.032 177.032 178.106 -1.074 26021 4630 1 8 . 1 1 8 8 ILE CA C 8 63.158 63.158 63.919 -0.761 26021 4631 1 8 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.152 -1.863 26021 4632 1 8 . 1 1 8 8 ILE H H 8 7.943 7.943 7.374 0.569 26021 4633 1 8 . 1 1 9 9 ALA N N 9 121.414 121.414 123.105 -1.691 26021 4634 1 8 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.042 -0.109 26021 4635 1 8 . 1 1 9 9 ALA C C 9 180.515 180.515 179.203 1.312 26021 4636 1 8 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.736 0.362 26021 4637 1 8 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.147 0.014 26021 4638 1 8 . 1 1 9 9 ALA H H 9 8.062 8.062 7.846 0.216 26021 4639 1 8 . 1 1 10 10 LYS N N 10 114.594 114.594 118.959 -4.365 26021 4640 1 8 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.128 0.036 26021 4641 1 8 . 1 1 10 10 LYS C C 10 178.099 178.099 178.037 0.062 26021 4642 1 8 . 1 1 10 10 LYS CA C 10 57.840 57.840 57.823 0.017 26021 4643 1 8 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.156 0.314 26021 4644 1 8 . 1 1 10 10 LYS H H 10 7.554 7.554 7.745 -0.191 26021 4645 1 8 . 1 1 11 11 LEU N N 11 119.662 119.662 118.631 1.031 26021 4646 1 8 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.134 -0.056 26021 4647 1 8 . 1 1 11 11 LEU C C 11 177.930 177.930 177.945 -0.015 26021 4648 1 8 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.273 0.284 26021 4649 1 8 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.787 1.301 26021 4650 1 8 . 1 1 11 11 LEU H H 11 7.814 7.814 7.431 0.383 26021 4651 1 8 . 1 1 12 12 ILE N N 12 117.945 117.945 120.733 -2.788 26021 4652 1 8 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.922 -0.230 26021 4653 1 8 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.076 1.553 26021 4654 1 8 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.747 1.663 26021 4655 1 8 . 1 1 12 12 ILE H H 12 7.426 7.426 7.698 -0.272 26021 4656 1 8 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.297 0.106 26021 4657 1 8 . 1 1 13 13 PRO C C 13 179.030 179.030 178.845 0.185 26021 4658 1 8 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.250 -0.006 26021 4659 1 8 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.017 -0.208 26021 4660 1 8 . 1 1 14 14 LYS N N 14 117.855 117.855 119.194 -1.339 26021 4661 1 8 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.063 0.082 26021 4662 1 8 . 1 1 14 14 LYS C C 14 178.565 178.565 179.048 -0.483 26021 4663 1 8 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.642 -0.209 26021 4664 1 8 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.216 0.709 26021 4665 1 8 . 1 1 14 14 LYS H H 14 6.685 6.685 7.417 -0.732 26021 4666 1 8 . 1 1 15 15 LEU N N 15 118.008 118.008 116.859 1.149 26021 4667 1 8 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.358 -0.355 26021 4668 1 8 . 1 1 15 15 LEU C C 15 178.662 178.662 179.324 -0.662 26021 4669 1 8 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.615 1.097 26021 4670 1 8 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.080 -0.081 26021 4671 1 8 . 1 1 15 15 LEU H H 15 8.148 8.148 7.503 0.645 26021 4672 1 8 . 1 1 16 16 GLY N N 16 103.895 103.895 108.821 -4.926 26021 4673 1 8 . 1 1 16 16 GLY C C 16 176.838 176.838 176.673 0.165 26021 4674 1 8 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.170 0.195 26021 4675 1 8 . 1 1 16 16 GLY H H 16 8.104 8.104 7.848 0.256 26021 4676 1 8 . 1 1 17 17 GLU N N 17 121.655 121.655 122.185 -0.530 26021 4677 1 8 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.213 -0.080 26021 4678 1 8 . 1 1 17 17 GLU C C 17 179.007 179.007 179.225 -0.218 26021 4679 1 8 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.782 0.029 26021 4680 1 8 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.665 -0.532 26021 4681 1 8 . 1 1 17 17 GLU H H 17 7.817 7.817 7.996 -0.179 26021 4682 1 8 . 1 1 18 18 LEU N N 18 117.834 117.834 119.414 -1.580 26021 4683 1 8 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.339 -0.221 26021 4684 1 8 . 1 1 18 18 LEU C C 18 177.658 177.658 177.209 0.449 26021 4685 1 8 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.587 1.442 26021 4686 1 8 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.520 0.150 26021 4687 1 8 . 1 1 18 18 LEU H H 18 7.389 7.389 7.794 -0.405 26021 4688 1 8 . 1 1 19 19 LEU N N 19 113.694 113.694 117.054 -3.360 26021 4689 1 8 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.360 -0.198 26021 4690 1 8 . 1 1 19 19 LEU C C 19 178.123 178.123 177.744 0.379 26021 4691 1 8 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.323 0.529 26021 4692 1 8 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.558 -0.338 26021 4693 1 8 . 1 1 19 19 LEU H H 19 7.269 7.269 7.729 -0.460 26021 4694 1 8 . 1 1 20 20 VAL N N 20 112.778 112.778 114.858 -2.080 26021 4695 1 8 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.033 0.410 26021 4696 1 8 . 1 1 20 20 VAL C C 20 177.021 177.021 177.298 -0.277 26021 4697 1 8 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.752 -1.897 26021 4698 1 8 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.172 0.606 26021 4699 1 8 . 1 1 20 20 VAL H H 20 7.356 7.356 7.090 0.266 26021 4700 1 8 . 1 1 21 21 GLY N N 21 108.962 108.962 108.668 0.294 26021 4701 1 8 . 1 1 21 21 GLY C C 21 173.813 173.813 173.913 -0.100 26021 4702 1 8 . 1 1 21 21 GLY CA C 21 45.046 45.046 45.261 -0.215 26021 4703 1 8 . 1 1 21 21 GLY H H 21 7.925 7.925 8.431 -0.506 26021 4704 1 8 . 1 1 22 22 GLU N N 22 120.607 120.607 119.972 0.635 26021 4705 1 8 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.471 -0.193 26021 4706 1 8 . 1 1 22 22 GLU C C 22 175.869 175.869 174.951 0.918 26021 4707 1 8 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.264 0.766 26021 4708 1 8 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.231 -0.550 26021 4709 1 8 . 1 1 22 22 GLU H H 22 8.300 8.300 8.541 -0.241 26021 4710 1 8 . 1 1 23 23 TYR N N 23 120.738 120.738 121.021 -0.283 26021 4711 1 8 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.348 0.209 26021 4712 1 8 . 1 1 23 23 TYR C C 23 175.264 175.264 174.906 0.358 26021 4713 1 8 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.044 0.517 26021 4714 1 8 . 1 1 23 23 TYR CB C 23 39.246 39.246 40.179 -0.933 26021 4715 1 8 . 1 1 23 23 TYR H H 23 7.756 7.756 7.756 -0.000 26021 4716 1 8 . 1 1 24 24 LYS N N 24 122.095 122.095 123.127 -1.032 26021 4717 1 8 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.807 -0.624 26021 4718 1 8 . 1 1 24 24 LYS C C 24 175.742 175.742 174.649 1.093 26021 4719 1 8 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.148 -0.030 26021 4720 1 8 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.061 -0.342 26021 4721 1 8 . 1 1 24 24 LYS H H 24 8.692 8.692 8.895 -0.203 26021 4722 1 8 . 1 1 25 25 LEU N N 25 121.123 121.123 115.792 5.331 26021 4723 1 8 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.948 -0.456 26021 4724 1 8 . 1 1 25 25 LEU C C 25 177.487 177.487 175.977 1.510 26021 4725 1 8 . 1 1 25 25 LEU CA C 25 54.334 54.334 54.086 0.248 26021 4726 1 8 . 1 1 25 25 LEU CB C 25 43.758 43.758 43.787 -0.029 26021 4727 1 8 . 1 1 25 25 LEU H H 25 8.088 8.088 7.298 0.790 26021 4728 1 8 . 1 1 26 26 HIS N N 26 122.993 122.993 118.701 4.292 26021 4729 1 8 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.572 -0.071 26021 4730 1 8 . 1 1 26 26 HIS C C 26 176.716 176.716 176.497 0.219 26021 4731 1 8 . 1 1 26 26 HIS CA C 26 57.197 57.197 55.971 1.226 26021 4732 1 8 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.427 0.930 26021 4733 1 8 . 1 1 26 26 HIS H H 26 8.882 8.882 8.582 0.300 26021 4734 1 8 . 1 1 27 27 LYS N N 27 124.894 124.894 125.115 -0.221 26021 4735 1 8 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.223 -0.275 26021 4736 1 8 . 1 1 27 27 LYS C C 27 178.873 178.873 177.839 1.034 26021 4737 1 8 . 1 1 27 27 LYS CA C 27 60.011 60.011 57.892 2.119 26021 4738 1 8 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.398 0.044 26021 4739 1 8 . 1 1 27 27 LYS H H 27 8.699 8.699 8.494 0.205 26021 4740 1 8 . 1 1 28 28 GLY N N 28 111.258 111.258 105.503 5.755 26021 4741 1 8 . 1 1 28 28 GLY C C 28 176.131 176.131 175.584 0.547 26021 4742 1 8 . 1 1 28 28 GLY CA C 28 46.490 46.490 45.895 0.595 26021 4743 1 8 . 1 1 28 28 GLY H H 28 9.814 9.814 8.332 1.482 26021 4744 1 8 . 1 1 29 29 VAL N N 29 122.719 122.719 122.332 0.387 26021 4745 1 8 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.631 0.261 26021 4746 1 8 . 1 1 29 29 VAL C C 29 177.628 177.628 178.092 -0.464 26021 4747 1 8 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.670 -0.150 26021 4748 1 8 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.375 0.367 26021 4749 1 8 . 1 1 29 29 VAL H H 29 7.431 7.431 7.458 -0.027 26021 4750 1 8 . 1 1 30 30 LYS N N 30 119.791 119.791 118.764 1.027 26021 4751 1 8 . 1 1 30 30 LYS HA H 30 3.635 3.635 4.006 -0.371 26021 4752 1 8 . 1 1 30 30 LYS C C 30 177.666 177.666 178.159 -0.493 26021 4753 1 8 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.229 1.795 26021 4754 1 8 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.436 0.969 26021 4755 1 8 . 1 1 30 30 LYS H H 30 8.255 8.255 7.887 0.368 26021 4756 1 8 . 1 1 31 31 LYS N N 31 117.918 117.918 116.809 1.109 26021 4757 1 8 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.089 0.027 26021 4758 1 8 . 1 1 31 31 LYS C C 31 177.784 177.784 178.041 -0.257 26021 4759 1 8 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.062 -0.359 26021 4760 1 8 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.903 -0.058 26021 4761 1 8 . 1 1 31 31 LYS H H 31 7.689 7.689 7.731 -0.042 26021 4762 1 8 . 1 1 32 32 ASN N N 32 116.347 116.347 116.722 -0.375 26021 4763 1 8 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.642 -0.122 26021 4764 1 8 . 1 1 32 32 ASN C C 32 177.764 177.764 177.579 0.185 26021 4765 1 8 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.305 1.010 26021 4766 1 8 . 1 1 32 32 ASN CB C 32 38.632 38.632 39.170 -0.538 26021 4767 1 8 . 1 1 32 32 ASN H H 32 7.556 7.556 7.753 -0.197 26021 4768 1 8 . 1 1 33 33 ILE N N 33 120.592 120.592 120.634 -0.042 26021 4769 1 8 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.718 -0.436 26021 4770 1 8 . 1 1 33 33 ILE C C 33 177.074 177.074 177.405 -0.331 26021 4771 1 8 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.721 2.167 26021 4772 1 8 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.403 0.775 26021 4773 1 8 . 1 1 33 33 ILE H H 33 8.236 8.236 7.617 0.619 26021 4774 1 8 . 1 1 34 34 GLU N N 34 120.595 120.595 119.588 1.007 26021 4775 1 8 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.909 -0.121 26021 4776 1 8 . 1 1 34 34 GLU C C 34 179.739 179.739 178.651 1.088 26021 4777 1 8 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.737 0.502 26021 4778 1 8 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.869 0.976 26021 4779 1 8 . 1 1 34 34 GLU H H 34 8.551 8.551 7.900 0.651 26021 4780 1 8 . 1 1 35 35 ASP N N 35 120.600 120.600 121.145 -0.545 26021 4781 1 8 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.453 -0.041 26021 4782 1 8 . 1 1 35 35 ASP C C 35 178.681 178.681 178.680 0.001 26021 4783 1 8 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.877 0.585 26021 4784 1 8 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.112 -0.362 26021 4785 1 8 . 1 1 35 35 ASP H H 35 8.670 8.670 8.207 0.463 26021 4786 1 8 . 1 1 36 36 LEU N N 36 123.004 123.004 120.885 2.119 26021 4787 1 8 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.297 -0.202 26021 4788 1 8 . 1 1 36 36 LEU C C 36 178.035 178.035 179.485 -1.450 26021 4789 1 8 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.384 0.644 26021 4790 1 8 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.075 -0.199 26021 4791 1 8 . 1 1 36 36 LEU H H 36 8.166 8.166 7.599 0.567 26021 4792 1 8 . 1 1 37 37 LEU N N 37 120.178 120.178 119.513 0.665 26021 4793 1 8 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.088 -0.232 26021 4794 1 8 . 1 1 37 37 LEU C C 37 178.128 178.128 178.225 -0.097 26021 4795 1 8 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.634 1.041 26021 4796 1 8 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.650 0.505 26021 4797 1 8 . 1 1 37 37 LEU H H 37 8.736 8.736 7.826 0.910 26021 4798 1 8 . 1 1 38 38 LYS N N 38 118.110 118.110 119.925 -1.815 26021 4799 1 8 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.863 0.070 26021 4800 1 8 . 1 1 38 38 LYS C C 38 179.533 179.533 178.784 0.749 26021 4801 1 8 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.285 -0.012 26021 4802 1 8 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.278 -0.001 26021 4803 1 8 . 1 1 38 38 LYS H H 38 7.770 7.770 8.173 -0.403 26021 4804 1 8 . 1 1 39 39 GLU N N 39 119.265 119.265 119.443 -0.178 26021 4805 1 8 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.084 0.218 26021 4806 1 8 . 1 1 39 39 GLU C C 39 179.720 179.720 179.195 0.525 26021 4807 1 8 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.352 -0.595 26021 4808 1 8 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.622 -0.032 26021 4809 1 8 . 1 1 39 39 GLU H H 39 7.709 7.709 7.854 -0.145 26021 4810 1 8 . 1 1 40 40 LEU N N 40 119.007 119.007 119.035 -0.028 26021 4811 1 8 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.157 -0.107 26021 4812 1 8 . 1 1 40 40 LEU C C 40 179.690 179.690 179.082 0.608 26021 4813 1 8 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.335 0.316 26021 4814 1 8 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.787 0.898 26021 4815 1 8 . 1 1 40 40 LEU H H 40 8.851 8.851 7.889 0.962 26021 4816 1 8 . 1 1 41 41 LYS N N 41 120.500 120.500 120.167 0.333 26021 4817 1 8 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.094 -0.142 26021 4818 1 8 . 1 1 41 41 LYS C C 41 180.223 180.223 178.930 1.293 26021 4819 1 8 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.550 1.341 26021 4820 1 8 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.222 -0.155 26021 4821 1 8 . 1 1 41 41 LYS H H 41 8.482 8.482 8.254 0.228 26021 4822 1 8 . 1 1 42 42 THR N N 42 119.555 119.555 112.973 6.582 26021 4823 1 8 . 1 1 42 42 THR HA H 42 4.000 4.000 4.042 -0.042 26021 4824 1 8 . 1 1 42 42 THR C C 42 176.633 176.633 177.047 -0.414 26021 4825 1 8 . 1 1 42 42 THR CA C 42 66.574 66.574 65.944 0.630 26021 4826 1 8 . 1 1 42 42 THR CB C 42 67.924 67.924 68.619 -0.695 26021 4827 1 8 . 1 1 42 42 THR H H 42 7.863 7.863 7.794 0.069 26021 4828 1 8 . 1 1 43 43 MET N N 43 122.839 122.839 121.309 1.530 26021 4829 1 8 . 1 1 43 43 MET HA H 43 4.022 4.022 4.157 -0.135 26021 4830 1 8 . 1 1 43 43 MET C C 43 177.290 177.290 177.962 -0.672 26021 4831 1 8 . 1 1 43 43 MET CA C 43 59.731 59.731 59.479 0.252 26021 4832 1 8 . 1 1 43 43 MET CB C 43 33.610 33.610 32.441 1.169 26021 4833 1 8 . 1 1 43 43 MET H H 43 8.714 8.714 7.878 0.836 26021 4834 1 8 . 1 1 44 44 ASN N N 44 118.049 118.049 118.090 -0.041 26021 4835 1 8 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.273 0.101 26021 4836 1 8 . 1 1 44 44 ASN C C 44 176.297 176.297 177.513 -1.216 26021 4837 1 8 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.375 0.519 26021 4838 1 8 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.942 0.464 26021 4839 1 8 . 1 1 44 44 ASN H H 44 8.988 8.988 8.111 0.877 26021 4840 1 8 . 1 1 45 45 ALA N N 45 119.260 119.260 121.453 -2.193 26021 4841 1 8 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.164 -0.098 26021 4842 1 8 . 1 1 45 45 ALA C C 45 180.476 180.476 179.044 1.432 26021 4843 1 8 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.505 0.763 26021 4844 1 8 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.311 -0.622 26021 4845 1 8 . 1 1 45 45 ALA H H 45 7.675 7.675 8.317 -0.642 26021 4846 1 8 . 1 1 46 46 ALA N N 46 121.126 121.126 123.217 -2.091 26021 4847 1 8 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.020 0.096 26021 4848 1 8 . 1 1 46 46 ALA C C 46 179.314 179.314 179.183 0.131 26021 4849 1 8 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.317 -0.331 26021 4850 1 8 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.525 -0.303 26021 4851 1 8 . 1 1 46 46 ALA H H 46 7.872 7.872 7.553 0.319 26021 4852 1 8 . 1 1 47 47 LEU N N 47 119.328 119.328 115.099 4.229 26021 4853 1 8 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.986 0.205 26021 4854 1 8 . 1 1 47 47 LEU C C 47 180.403 180.403 177.954 2.449 26021 4855 1 8 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.913 0.133 26021 4856 1 8 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.560 0.390 26021 4857 1 8 . 1 1 47 47 LEU H H 47 8.529 8.529 7.706 0.823 26021 4858 1 8 . 1 1 48 48 ILE N N 48 121.653 121.653 118.665 2.988 26021 4859 1 8 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.793 -0.091 26021 4860 1 8 . 1 1 48 48 ILE C C 48 178.730 178.730 178.184 0.546 26021 4861 1 8 . 1 1 48 48 ILE CA C 48 64.910 64.910 62.997 1.913 26021 4862 1 8 . 1 1 48 48 ILE CB C 48 37.912 37.912 36.668 1.244 26021 4863 1 8 . 1 1 48 48 ILE H H 48 8.386 8.386 7.534 0.852 26021 4864 1 8 . 1 1 49 49 LYS N N 49 119.896 119.896 119.203 0.693 26021 4865 1 8 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.211 -0.168 26021 4866 1 8 . 1 1 49 49 LYS C C 49 179.999 179.999 179.655 0.344 26021 4867 1 8 . 1 1 49 49 LYS CA C 49 59.057 59.057 58.879 0.178 26021 4868 1 8 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.848 -0.887 26021 4869 1 8 . 1 1 49 49 LYS H H 49 7.456 7.456 7.566 -0.110 26021 4870 1 8 . 1 1 50 50 ILE N N 50 119.964 119.964 115.494 4.470 26021 4871 1 8 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.123 -0.387 26021 4872 1 8 . 1 1 50 50 ILE C C 50 177.960 177.960 177.582 0.378 26021 4873 1 8 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.751 0.598 26021 4874 1 8 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.647 0.485 26021 4875 1 8 . 1 1 50 50 ILE H H 50 8.154 8.154 8.718 -0.564 26021 4876 1 8 . 1 1 51 51 GLY N N 51 106.709 106.709 107.510 -0.801 26021 4877 1 8 . 1 1 51 51 GLY C C 51 174.461 174.461 174.866 -0.405 26021 4878 1 8 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.017 -0.108 26021 4879 1 8 . 1 1 51 51 GLY H H 51 7.932 7.932 7.797 0.135 26021 4880 1 8 . 1 1 52 52 GLU N N 52 118.736 118.736 119.660 -0.924 26021 4881 1 8 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.151 0.169 26021 4882 1 8 . 1 1 52 52 GLU C C 52 176.789 176.789 177.384 -0.595 26021 4883 1 8 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.396 -1.122 26021 4884 1 8 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.114 -0.002 26021 4885 1 8 . 1 1 52 52 GLU H H 52 7.597 7.597 7.630 -0.033 26021 4886 1 8 . 1 1 53 53 VAL N N 53 122.982 122.982 117.399 5.583 26021 4887 1 8 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.123 0.138 26021 4888 1 8 . 1 1 53 53 VAL CA C 53 60.385 60.385 60.419 -0.034 26021 4889 1 8 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.753 1.069 26021 4890 1 8 . 1 1 53 53 VAL H H 53 7.511 7.511 7.401 0.110 26021 4891 1 8 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.715 -0.070 26021 4892 1 8 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.515 0.063 26021 4893 1 8 . 1 1 54 54 PRO CB C 54 31.535 31.535 30.973 0.562 26021 4894 1 8 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.343 -0.152 26021 4895 1 8 . 1 1 55 55 PRO C C 55 178.258 178.258 178.068 0.190 26021 4896 1 8 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.907 0.521 26021 4897 1 8 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.754 0.092 26021 4898 1 8 . 1 1 56 56 ASP N N 56 114.117 114.117 118.865 -4.748 26021 4899 1 8 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.494 -0.003 26021 4900 1 8 . 1 1 56 56 ASP C C 56 176.696 176.696 176.859 -0.163 26021 4901 1 8 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.689 -0.551 26021 4902 1 8 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.738 -1.012 26021 4903 1 8 . 1 1 56 56 ASP H H 56 8.489 8.489 8.320 0.169 26021 4904 1 8 . 1 1 57 57 GLN N N 57 117.641 117.641 116.541 1.100 26021 4905 1 8 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.417 -0.043 26021 4906 1 8 . 1 1 57 57 GLN C C 57 175.765 175.765 175.650 0.115 26021 4907 1 8 . 1 1 57 57 GLN CA C 57 55.290 55.290 54.523 0.767 26021 4908 1 8 . 1 1 57 57 GLN CB C 57 29.646 29.646 28.713 0.933 26021 4909 1 8 . 1 1 57 57 GLN H H 57 8.206 8.206 7.752 0.454 26021 4910 1 8 . 1 1 58 58 LEU N N 58 122.141 122.141 120.935 1.206 26021 4911 1 8 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.365 0.085 26021 4912 1 8 . 1 1 58 58 LEU C C 58 176.849 176.849 176.119 0.730 26021 4913 1 8 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.513 0.482 26021 4914 1 8 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.928 0.303 26021 4915 1 8 . 1 1 58 58 LEU H H 58 7.152 7.152 7.193 -0.041 26021 4916 1 8 . 1 1 59 59 ASP N N 59 125.643 125.643 123.248 2.395 26021 4917 1 8 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.814 -0.095 26021 4918 1 8 . 1 1 59 59 ASP C C 59 177.249 177.249 177.069 0.180 26021 4919 1 8 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.018 0.385 26021 4920 1 8 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.640 -1.408 26021 4921 1 8 . 1 1 59 59 ASP H H 59 9.312 9.312 8.269 1.043 26021 4922 1 8 . 1 1 60 60 SER N N 60 116.550 116.550 115.313 1.237 26021 4923 1 8 . 1 1 60 60 SER HA H 60 4.124 4.124 4.250 -0.126 26021 4924 1 8 . 1 1 60 60 SER C C 60 176.840 176.840 176.373 0.467 26021 4925 1 8 . 1 1 60 60 SER CA C 60 61.722 61.722 61.087 0.635 26021 4926 1 8 . 1 1 60 60 SER CB C 60 62.815 62.815 63.587 -0.772 26021 4927 1 8 . 1 1 60 60 SER H H 60 8.647 8.647 8.432 0.215 26021 4928 1 8 . 1 1 61 61 GLN N N 61 121.394 121.394 119.763 1.631 26021 4929 1 8 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.319 -0.188 26021 4930 1 8 . 1 1 61 61 GLN C C 61 178.629 178.629 177.577 1.052 26021 4931 1 8 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.179 0.574 26021 4932 1 8 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.732 -0.479 26021 4933 1 8 . 1 1 61 61 GLN H H 61 8.453 8.453 8.440 0.013 26021 4934 1 8 . 1 1 62 62 ASP N N 62 122.187 122.187 119.690 2.497 26021 4935 1 8 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.480 0.139 26021 4936 1 8 . 1 1 62 62 ASP C C 62 178.318 178.318 178.515 -0.197 26021 4937 1 8 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.316 0.147 26021 4938 1 8 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.649 0.387 26021 4939 1 8 . 1 1 62 62 ASP H H 62 8.311 8.311 8.514 -0.203 26021 4940 1 8 . 1 1 63 63 LYS N N 63 120.325 120.325 118.264 2.061 26021 4941 1 8 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.150 -0.141 26021 4942 1 8 . 1 1 63 63 LYS C C 63 178.765 178.765 179.209 -0.444 26021 4943 1 8 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.943 0.810 26021 4944 1 8 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.468 -0.015 26021 4945 1 8 . 1 1 63 63 LYS H H 63 7.923 7.923 7.535 0.388 26021 4946 1 8 . 1 1 64 64 LEU N N 64 119.491 119.491 119.978 -0.487 26021 4947 1 8 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.180 0.046 26021 4948 1 8 . 1 1 64 64 LEU C C 64 179.526 179.526 178.255 1.271 26021 4949 1 8 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.551 0.247 26021 4950 1 8 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.834 -0.059 26021 4951 1 8 . 1 1 64 64 LEU H H 64 7.820 7.820 7.328 0.492 26021 4952 1 8 . 1 1 65 65 TRP N N 65 120.674 120.674 121.445 -0.771 26021 4953 1 8 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.171 0.137 26021 4954 1 8 . 1 1 65 65 TRP C C 65 177.379 177.379 177.103 0.276 26021 4955 1 8 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.644 1.158 26021 4956 1 8 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.659 -0.248 26021 4957 1 8 . 1 1 65 65 TRP H H 65 8.196 8.196 8.511 -0.315 26021 4958 1 8 . 1 1 66 66 ALA N N 66 120.606 120.606 120.161 0.445 26021 4959 1 8 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.574 0.135 26021 4960 1 8 . 1 1 66 66 ALA C C 66 180.376 180.376 179.183 1.193 26021 4961 1 8 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.806 0.758 26021 4962 1 8 . 1 1 66 66 ALA CB C 66 17.654 17.654 18.016 -0.362 26021 4963 1 8 . 1 1 66 66 ALA H H 66 8.305 8.305 7.436 0.869 26021 4964 1 8 . 1 1 67 67 ASP N N 67 119.175 119.175 118.301 0.874 26021 4965 1 8 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.349 0.101 26021 4966 1 8 . 1 1 67 67 ASP C C 67 178.757 178.757 178.282 0.475 26021 4967 1 8 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.529 0.963 26021 4968 1 8 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.832 -0.678 26021 4969 1 8 . 1 1 67 67 ASP H H 67 7.945 7.945 8.021 -0.076 26021 4970 1 8 . 1 1 68 68 GLU N N 68 122.322 122.322 118.863 3.459 26021 4971 1 8 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.041 -0.026 26021 4972 1 8 . 1 1 68 68 GLU C C 68 180.055 180.055 179.059 0.996 26021 4973 1 8 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.442 0.668 26021 4974 1 8 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.728 -0.081 26021 4975 1 8 . 1 1 68 68 GLU H H 68 8.168 8.168 8.466 -0.298 26021 4976 1 8 . 1 1 69 69 VAL N N 69 122.135 122.135 117.176 4.959 26021 4977 1 8 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.822 -0.570 26021 4978 1 8 . 1 1 69 69 VAL C C 69 177.736 177.736 178.030 -0.294 26021 4979 1 8 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.540 0.999 26021 4980 1 8 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.598 -0.356 26021 4981 1 8 . 1 1 69 69 VAL H H 69 8.424 8.424 7.353 1.071 26021 4982 1 8 . 1 1 70 70 ARG N N 70 121.373 121.373 121.263 0.110 26021 4983 1 8 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.829 -0.137 26021 4984 1 8 . 1 1 70 70 ARG C C 70 179.117 179.117 177.750 1.367 26021 4985 1 8 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.833 0.332 26021 4986 1 8 . 1 1 70 70 ARG CB C 70 29.654 29.654 30.105 -0.452 26021 4987 1 8 . 1 1 70 70 ARG H H 70 7.916 7.916 7.593 0.323 26021 4988 1 8 . 1 1 71 71 GLU N N 71 119.075 119.075 118.600 0.475 26021 4989 1 8 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.852 0.211 26021 4990 1 8 . 1 1 71 71 GLU C C 71 179.119 179.119 179.281 -0.162 26021 4991 1 8 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.923 0.764 26021 4992 1 8 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.531 0.739 26021 4993 1 8 . 1 1 71 71 GLU H H 71 8.031 8.031 7.815 0.216 26021 4994 1 8 . 1 1 72 72 LEU N N 72 120.503 120.503 120.096 0.407 26021 4995 1 8 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.129 -0.072 26021 4996 1 8 . 1 1 72 72 LEU C C 72 178.734 178.734 178.509 0.225 26021 4997 1 8 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.110 0.312 26021 4998 1 8 . 1 1 72 72 LEU CB C 72 41.408 41.408 42.064 -0.656 26021 4999 1 8 . 1 1 72 72 LEU H H 72 8.175 8.175 8.026 0.149 26021 5000 1 8 . 1 1 73 73 SER N N 73 115.243 115.243 116.824 -1.581 26021 5001 1 8 . 1 1 73 73 SER HA H 73 3.824 3.824 4.186 -0.362 26021 5002 1 8 . 1 1 73 73 SER C C 73 175.697 175.697 176.759 -1.062 26021 5003 1 8 . 1 1 73 73 SER CA C 73 62.384 62.384 61.515 0.869 26021 5004 1 8 . 1 1 73 73 SER CB C 73 62.093 62.093 62.200 -0.107 26021 5005 1 8 . 1 1 73 73 SER H H 73 8.411 8.411 8.281 0.130 26021 5006 1 8 . 1 1 74 74 TYR N N 74 121.342 121.342 123.170 -1.828 26021 5007 1 8 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.293 0.198 26021 5008 1 8 . 1 1 74 74 TYR C C 74 178.747 178.747 178.568 0.179 26021 5009 1 8 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.280 0.155 26021 5010 1 8 . 1 1 74 74 TYR CB C 74 37.507 37.507 37.580 -0.073 26021 5011 1 8 . 1 1 74 74 TYR H H 74 7.314 7.314 7.826 -0.512 26021 5012 1 8 . 1 1 75 75 VAL N N 75 120.779 120.779 119.681 1.098 26021 5013 1 8 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.745 0.116 26021 5014 1 8 . 1 1 75 75 VAL C C 75 179.788 179.788 177.262 2.526 26021 5015 1 8 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.410 0.638 26021 5016 1 8 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.905 -0.191 26021 5017 1 8 . 1 1 75 75 VAL H H 75 7.740 7.740 8.309 -0.569 26021 5018 1 8 . 1 1 76 76 ILE N N 76 120.598 120.598 119.512 1.086 26021 5019 1 8 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.699 0.001 26021 5020 1 8 . 1 1 76 76 ILE C C 76 177.066 177.066 177.831 -0.765 26021 5021 1 8 . 1 1 76 76 ILE CA C 76 65.919 65.919 63.752 2.167 26021 5022 1 8 . 1 1 76 76 ILE CB C 76 37.385 37.385 36.382 1.003 26021 5023 1 8 . 1 1 76 76 ILE H H 76 8.584 8.584 8.123 0.461 26021 5024 1 8 . 1 1 77 77 GLU N N 77 120.468 120.468 120.150 0.318 26021 5025 1 8 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.870 -0.221 26021 5026 1 8 . 1 1 77 77 GLU C C 77 177.502 177.502 178.319 -0.817 26021 5027 1 8 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.523 1.339 26021 5028 1 8 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.668 0.684 26021 5029 1 8 . 1 1 77 77 GLU H H 77 8.445 8.445 7.859 0.586 26021 5030 1 8 . 1 1 78 78 ASP N N 78 117.382 117.382 120.695 -3.313 26021 5031 1 8 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.349 0.042 26021 5032 1 8 . 1 1 78 78 ASP C C 78 177.382 177.382 178.018 -0.636 26021 5033 1 8 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.599 0.896 26021 5034 1 8 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.520 1.415 26021 5035 1 8 . 1 1 78 78 ASP H H 78 7.885 7.885 7.963 -0.078 26021 5036 1 8 . 1 1 79 79 ALA N N 79 120.171 120.171 121.510 -1.339 26021 5037 1 8 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.084 -0.034 26021 5038 1 8 . 1 1 79 79 ALA C C 79 181.193 181.193 179.723 1.470 26021 5039 1 8 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.261 -0.206 26021 5040 1 8 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.260 0.160 26021 5041 1 8 . 1 1 79 79 ALA H H 79 7.754 7.754 8.106 -0.352 26021 5042 1 8 . 1 1 80 80 VAL N N 80 119.541 119.541 114.162 5.379 26021 5043 1 8 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.986 -0.309 26021 5044 1 8 . 1 1 80 80 VAL C C 80 177.096 177.096 177.350 -0.254 26021 5045 1 8 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.627 2.457 26021 5046 1 8 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.232 0.211 26021 5047 1 8 . 1 1 80 80 VAL H H 80 8.635 8.635 7.343 1.292 26021 5048 1 8 . 1 1 81 81 ASP N N 81 121.140 121.140 121.229 -0.089 26021 5049 1 8 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.208 0.261 26021 5050 1 8 . 1 1 81 81 ASP C C 81 179.569 179.569 177.756 1.813 26021 5051 1 8 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.788 0.141 26021 5052 1 8 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.791 -0.856 26021 5053 1 8 . 1 1 81 81 ASP H H 81 8.575 8.575 8.556 0.019 26021 5054 1 8 . 1 1 82 82 LYS N N 82 118.159 118.159 117.219 0.940 26021 5055 1 8 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.047 -0.026 26021 5056 1 8 . 1 1 82 82 LYS C C 82 178.890 178.890 178.992 -0.102 26021 5057 1 8 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.807 0.260 26021 5058 1 8 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.459 0.128 26021 5059 1 8 . 1 1 82 82 LYS H H 82 8.079 8.079 7.692 0.387 26021 5060 1 8 . 1 1 83 83 PHE N N 83 120.900 120.900 121.636 -0.736 26021 5061 1 8 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.312 -0.036 26021 5062 1 8 . 1 1 83 83 PHE C C 83 177.269 177.269 176.476 0.793 26021 5063 1 8 . 1 1 83 83 PHE CA C 83 60.943 60.943 59.394 1.549 26021 5064 1 8 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.178 0.569 26021 5065 1 8 . 1 1 83 83 PHE H H 83 8.015 8.015 7.810 0.205 26021 5066 1 8 . 1 1 84 84 LEU N N 84 118.209 118.209 118.720 -0.511 26021 5067 1 8 . 1 1 84 84 LEU HA H 84 3.942 3.942 3.895 0.047 26021 5068 1 8 . 1 1 84 84 LEU C C 84 178.774 178.774 177.993 0.781 26021 5069 1 8 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.541 0.629 26021 5070 1 8 . 1 1 84 84 LEU CB C 84 42.193 42.193 40.918 1.275 26021 5071 1 8 . 1 1 84 84 LEU H H 84 8.338 8.338 8.189 0.149 26021 5072 1 8 . 1 1 85 85 VAL N N 85 116.078 116.078 120.152 -4.074 26021 5073 1 8 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.536 0.455 26021 5074 1 8 . 1 1 85 85 VAL C C 85 177.252 177.252 176.760 0.492 26021 5075 1 8 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.714 -1.534 26021 5076 1 8 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.735 0.155 26021 5077 1 8 . 1 1 85 85 VAL H H 85 7.447 7.447 7.256 0.191 26021 5078 1 8 . 1 1 86 86 ARG N N 86 120.842 120.842 117.951 2.891 26021 5079 1 8 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.052 0.175 26021 5080 1 8 . 1 1 86 86 ARG C C 86 177.520 177.520 179.124 -1.604 26021 5081 1 8 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.864 -1.804 26021 5082 1 8 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.847 0.416 26021 5083 1 8 . 1 1 86 86 ARG H H 86 7.598 7.598 7.402 0.196 26021 5084 1 8 . 1 1 87 87 VAL N N 87 119.293 119.293 116.454 2.839 26021 5085 1 8 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.798 0.027 26021 5086 1 8 . 1 1 87 87 VAL C C 87 176.121 176.121 177.642 -1.521 26021 5087 1 8 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.147 -1.709 26021 5088 1 8 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.466 0.306 26021 5089 1 8 . 1 1 87 87 VAL H H 87 7.994 7.994 7.991 0.003 26021 5090 1 8 . 1 1 88 88 HIS N N 88 120.016 120.016 117.294 2.722 26021 5091 1 8 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.437 0.200 26021 5092 1 8 . 1 1 88 88 HIS C C 88 175.639 175.639 176.205 -0.566 26021 5093 1 8 . 1 1 88 88 HIS CA C 88 56.351 56.351 57.478 -1.127 26021 5094 1 8 . 1 1 88 88 HIS CB C 88 29.681 29.681 29.576 0.105 26021 5095 1 8 . 1 1 88 88 HIS H H 88 7.969 7.969 8.363 -0.394 26021 5096 1 8 . 1 1 89 89 GLY N N 89 109.587 109.587 108.674 0.913 26021 5097 1 8 . 1 1 89 89 GLY C C 89 173.730 173.730 174.662 -0.932 26021 5098 1 8 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.816 -0.647 26021 5099 1 8 . 1 1 89 89 GLY H H 89 8.083 8.083 7.831 0.252 26021 5100 1 8 . 1 1 90 90 VAL N N 90 118.224 118.224 120.041 -1.817 26021 5101 1 8 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.187 -0.049 26021 5102 1 8 . 1 1 90 90 VAL C C 90 176.018 176.018 176.088 -0.070 26021 5103 1 8 . 1 1 90 90 VAL CA C 90 62.425 62.425 61.065 1.360 26021 5104 1 8 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.121 -0.505 26021 5105 1 8 . 1 1 90 90 VAL H H 90 7.944 7.944 7.475 0.469 26021 5106 1 8 . 1 1 91 91 GLU N N 91 124.313 124.313 125.233 -0.920 26021 5107 1 8 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.446 0.160 26021 5108 1 8 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.580 -0.404 26021 5109 1 8 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.719 0.041 26021 5110 1 8 . 1 1 91 91 GLU H H 91 8.423 8.423 8.345 0.078 26021 5111 1 8 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.391 -0.054 26021 5112 1 8 . 1 1 92 92 PRO C C 92 176.504 176.504 175.816 0.688 26021 5113 1 8 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.469 -0.097 26021 5114 1 8 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.022 0.145 26021 5115 1 8 . 1 1 93 93 ASP N N 93 120.275 120.275 121.691 -1.416 26021 5116 1 8 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.756 -0.184 26021 5117 1 8 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.302 0.668 26021 5118 1 8 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.134 -2.619 26021 5119 1 8 . 1 1 93 93 ASP H H 93 8.286 8.286 8.130 0.156 26021 5120 1 8 . 1 1 94 94 ASP N N 94 121.181 121.181 120.621 0.560 26021 5121 1 8 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.672 -0.107 26021 5122 1 8 . 1 1 94 94 ASP C C 94 176.474 176.474 177.379 -0.905 26021 5123 1 8 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.343 -0.970 26021 5124 1 8 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.899 -0.674 26021 5125 1 8 . 1 1 94 94 ASP H H 94 8.259 8.259 8.615 -0.356 26021 5126 1 8 . 1 1 95 95 ASN N N 95 118.728 118.728 119.539 -0.811 26021 5127 1 8 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.545 0.149 26021 5128 1 8 . 1 1 95 95 ASN C C 95 176.272 176.272 177.048 -0.776 26021 5129 1 8 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.934 -1.948 26021 5130 1 8 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.064 0.665 26021 5131 1 8 . 1 1 95 95 ASN H H 95 8.474 8.474 8.713 -0.239 26021 5132 1 8 . 1 1 96 96 THR N N 96 113.868 113.868 114.129 -0.261 26021 5133 1 8 . 1 1 96 96 THR HA H 96 4.220 4.220 4.148 0.072 26021 5134 1 8 . 1 1 96 96 THR C C 96 175.107 175.107 175.787 -0.680 26021 5135 1 8 . 1 1 96 96 THR CA C 96 63.200 63.200 64.416 -1.216 26021 5136 1 8 . 1 1 96 96 THR CB C 96 69.475 69.475 68.214 1.261 26021 5137 1 8 . 1 1 96 96 THR H H 96 8.263 8.263 8.225 0.038 26021 5138 1 8 . 1 1 97 97 ASN N N 97 119.954 119.954 119.222 0.732 26021 5139 1 8 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.617 -0.001 26021 5140 1 8 . 1 1 97 97 ASN C C 97 176.275 176.275 176.401 -0.126 26021 5141 1 8 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.777 -0.821 26021 5142 1 8 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.706 -0.014 26021 5143 1 8 . 1 1 97 97 ASN H H 97 8.431 8.431 7.933 0.498 26021 5144 1 8 . 1 1 98 98 GLY N N 98 108.847 108.847 106.327 2.520 26021 5145 1 8 . 1 1 98 98 GLY C C 98 175.533 175.533 175.130 0.403 26021 5146 1 8 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.253 -0.242 26021 5147 1 8 . 1 1 98 98 GLY H H 98 8.338 8.338 7.660 0.678 26021 5148 1 8 . 1 1 99 99 PHE N N 99 118.492 118.492 118.927 -0.435 26021 5149 1 8 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.174 0.074 26021 5150 1 8 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.180 0.779 26021 5151 1 8 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.357 -1.198 26021 5152 1 8 . 1 1 99 99 PHE H H 99 8.370 8.370 8.676 -0.306 26021 5153 1 8 . 1 1 100 100 LYS N N 100 120.987 120.987 119.946 1.041 26021 5154 1 8 . 1 1 100 100 LYS H H 100 8.256 8.256 8.475 -0.219 26021 5155 1 8 . 1 1 101 101 GLY N N 101 108.186 108.186 106.272 1.914 26021 5156 1 8 . 1 1 101 101 GLY C C 101 177.075 177.075 175.763 1.312 26021 5157 1 8 . 1 1 101 101 GLY CA C 101 46.902 46.902 45.969 0.933 26021 5158 1 8 . 1 1 101 101 GLY H H 101 8.300 8.300 7.742 0.558 26021 5159 1 8 . 1 1 102 102 LEU N N 102 121.439 121.439 123.243 -1.804 26021 5160 1 8 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.963 0.134 26021 5161 1 8 . 1 1 102 102 LEU C C 102 179.836 179.836 177.945 1.891 26021 5162 1 8 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.235 0.123 26021 5163 1 8 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.731 0.039 26021 5164 1 8 . 1 1 102 102 LEU H H 102 7.777 7.777 7.544 0.233 26021 5165 1 8 . 1 1 103 103 MET N N 103 122.290 122.290 119.451 2.839 26021 5166 1 8 . 1 1 103 103 MET HA H 103 4.220 4.220 4.022 0.198 26021 5167 1 8 . 1 1 103 103 MET C C 103 177.739 177.739 177.850 -0.111 26021 5168 1 8 . 1 1 103 103 MET CA C 103 58.739 58.739 57.996 0.743 26021 5169 1 8 . 1 1 103 103 MET CB C 103 31.895 31.895 32.090 -0.195 26021 5170 1 8 . 1 1 103 103 MET H H 103 8.409 8.409 8.086 0.323 26021 5171 1 8 . 1 1 104 104 LYS N N 104 119.750 119.750 118.831 0.919 26021 5172 1 8 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.221 -0.154 26021 5173 1 8 . 1 1 104 104 LYS C C 104 179.301 179.301 179.399 -0.098 26021 5174 1 8 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.237 1.527 26021 5175 1 8 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.870 0.177 26021 5176 1 8 . 1 1 104 104 LYS H H 104 7.916 7.916 7.740 0.176 26021 5177 1 8 . 1 1 105 105 ARG N N 105 117.967 117.967 119.216 -1.249 26021 5178 1 8 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.064 -0.038 26021 5179 1 8 . 1 1 105 105 ARG C C 105 178.777 178.777 178.372 0.405 26021 5180 1 8 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.586 -0.222 26021 5181 1 8 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.280 0.716 26021 5182 1 8 . 1 1 105 105 ARG H H 105 7.719 7.719 8.380 -0.661 26021 5183 1 8 . 1 1 106 106 THR N N 106 117.211 117.211 111.654 5.557 26021 5184 1 8 . 1 1 106 106 THR HA H 106 4.301 4.301 4.299 0.002 26021 5185 1 8 . 1 1 106 106 THR C C 106 176.254 176.254 176.292 -0.038 26021 5186 1 8 . 1 1 106 106 THR CA C 106 67.860 67.860 66.050 1.810 26021 5187 1 8 . 1 1 106 106 THR CB C 106 67.860 67.860 68.783 -0.923 26021 5188 1 8 . 1 1 106 106 THR H H 106 8.152 8.152 7.590 0.562 26021 5189 1 8 . 1 1 107 107 THR N N 107 117.939 117.939 115.601 2.338 26021 5190 1 8 . 1 1 107 107 THR HA H 107 3.971 3.971 3.967 0.004 26021 5191 1 8 . 1 1 107 107 THR C C 107 176.780 176.780 176.624 0.156 26021 5192 1 8 . 1 1 107 107 THR CA C 107 66.822 66.822 66.008 0.814 26021 5193 1 8 . 1 1 107 107 THR CB C 107 68.818 68.818 67.670 1.148 26021 5194 1 8 . 1 1 107 107 THR H H 107 8.651 8.651 7.773 0.878 26021 5195 1 8 . 1 1 108 108 LYS N N 108 120.867 120.867 121.033 -0.166 26021 5196 1 8 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.017 0.005 26021 5197 1 8 . 1 1 108 108 LYS C C 108 179.045 179.045 178.871 0.174 26021 5198 1 8 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.615 0.219 26021 5199 1 8 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.213 0.260 26021 5200 1 8 . 1 1 108 108 LYS H H 108 7.694 7.694 7.835 -0.141 26021 5201 1 8 . 1 1 109 109 LEU N N 109 119.472 119.472 119.304 0.168 26021 5202 1 8 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.215 0.106 26021 5203 1 8 . 1 1 109 109 LEU C C 109 179.974 179.974 179.584 0.390 26021 5204 1 8 . 1 1 109 109 LEU CA C 109 57.593 57.593 56.775 0.818 26021 5205 1 8 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.277 -0.417 26021 5206 1 8 . 1 1 109 109 LEU H H 109 7.559 7.559 7.603 -0.044 26021 5207 1 8 . 1 1 110 110 LEU N N 110 121.832 121.832 120.745 1.087 26021 5208 1 8 . 1 1 110 110 LEU HA H 110 4.191 4.191 3.960 0.231 26021 5209 1 8 . 1 1 110 110 LEU C C 110 178.101 178.101 178.490 -0.389 26021 5210 1 8 . 1 1 110 110 LEU CA C 110 57.892 57.892 58.097 -0.205 26021 5211 1 8 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.324 0.560 26021 5212 1 8 . 1 1 110 110 LEU H H 110 8.567 8.567 8.430 0.137 26021 5213 1 8 . 1 1 111 111 LYS N N 111 117.972 117.972 118.026 -0.054 26021 5214 1 8 . 1 1 111 111 LYS HA H 111 3.979 3.979 3.972 0.007 26021 5215 1 8 . 1 1 111 111 LYS C C 111 177.677 177.677 178.477 -0.800 26021 5216 1 8 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.985 -0.200 26021 5217 1 8 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.214 0.995 26021 5218 1 8 . 1 1 111 111 LYS H H 111 7.965 7.965 7.873 0.092 26021 5219 1 8 . 1 1 112 112 LYS N N 112 115.433 115.433 118.743 -3.310 26021 5220 1 8 . 1 1 112 112 LYS HA H 112 4.110 4.110 3.912 0.198 26021 5221 1 8 . 1 1 112 112 LYS C C 112 178.270 178.270 178.742 -0.472 26021 5222 1 8 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.817 0.134 26021 5223 1 8 . 1 1 112 112 LYS CB C 112 32.791 32.791 31.975 0.816 26021 5224 1 8 . 1 1 112 112 LYS H H 112 7.334 7.334 8.319 -0.985 26021 5225 1 8 . 1 1 113 113 VAL N N 113 114.861 114.861 115.554 -0.693 26021 5226 1 8 . 1 1 113 113 VAL HA H 113 3.831 3.831 4.054 -0.223 26021 5227 1 8 . 1 1 113 113 VAL C C 113 176.999 176.999 177.435 -0.436 26021 5228 1 8 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.396 -1.891 26021 5229 1 8 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.415 0.872 26021 5230 1 8 . 1 1 113 113 VAL H H 113 7.298 7.298 7.615 -0.317 26021 5231 1 8 . 1 1 114 114 VAL N N 114 121.457 121.457 122.790 -1.333 26021 5232 1 8 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.655 0.067 26021 5233 1 8 . 1 1 114 114 VAL C C 114 177.737 177.737 178.267 -0.530 26021 5234 1 8 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.724 -1.500 26021 5235 1 8 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.416 0.338 26021 5236 1 8 . 1 1 114 114 VAL H H 114 7.855 7.855 7.995 -0.140 26021 5237 1 8 . 1 1 115 115 ASP N N 115 120.804 120.804 118.775 2.029 26021 5238 1 8 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.464 -0.009 26021 5239 1 8 . 1 1 115 115 ASP C C 115 177.380 177.380 176.974 0.406 26021 5240 1 8 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.185 -0.264 26021 5241 1 8 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.642 -0.270 26021 5242 1 8 . 1 1 115 115 ASP H H 115 8.311 8.311 7.854 0.457 26021 5243 1 8 . 1 1 116 116 LYS N N 116 119.582 119.582 118.439 1.143 26021 5244 1 8 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.119 -0.024 26021 5245 1 8 . 1 1 116 116 LYS C C 116 177.077 177.077 177.767 -0.690 26021 5246 1 8 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.747 -0.036 26021 5247 1 8 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.448 0.040 26021 5248 1 8 . 1 1 116 116 LYS H H 116 7.639 7.639 7.465 0.174 26021 5249 1 8 . 1 1 117 117 HIS N N 117 115.246 115.246 112.297 2.949 26021 5250 1 8 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.818 -0.193 26021 5251 1 8 . 1 1 117 117 HIS C C 117 175.497 175.497 175.863 -0.366 26021 5252 1 8 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.508 -0.333 26021 5253 1 8 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.373 -1.898 26021 5254 1 8 . 1 1 117 117 HIS H H 117 8.108 8.108 8.373 -0.265 26021 5255 1 8 . 1 1 118 118 GLY N N 118 109.944 109.944 109.045 0.899 26021 5256 1 8 . 1 1 118 118 GLY C C 118 174.093 174.093 174.177 -0.084 26021 5257 1 8 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.037 1.027 26021 5258 1 8 . 1 1 118 118 GLY H H 118 8.153 8.153 7.751 0.402 26021 5259 1 8 . 1 1 119 119 ILE N N 119 118.468 118.468 121.858 -3.390 26021 5260 1 8 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.879 0.243 26021 5261 1 8 . 1 1 119 119 ILE C C 119 174.777 174.777 176.369 -1.592 26021 5262 1 8 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.478 -0.377 26021 5263 1 8 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.527 2.104 26021 5264 1 8 . 1 1 119 119 ILE H H 119 7.828 7.828 7.682 0.146 26021 5265 1 9 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.512 0.237 26021 5266 1 9 . 1 1 4 4 ASN C C 4 175.260 175.260 175.454 -0.194 26021 5267 1 9 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.992 -1.161 26021 5268 1 9 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.457 0.224 26021 5269 1 9 . 1 1 5 5 ALA N N 5 123.648 123.648 118.615 5.033 26021 5270 1 9 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.615 -0.325 26021 5271 1 9 . 1 1 5 5 ALA C C 5 178.256 178.256 179.082 -0.826 26021 5272 1 9 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.467 1.614 26021 5273 1 9 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.369 0.656 26021 5274 1 9 . 1 1 5 5 ALA H H 5 8.520 8.520 8.127 0.394 26021 5275 1 9 . 1 1 6 6 GLY N N 6 107.044 107.044 108.510 -1.466 26021 5276 1 9 . 1 1 6 6 GLY C C 6 174.961 174.961 175.142 -0.181 26021 5277 1 9 . 1 1 6 6 GLY CA C 6 45.830 45.830 47.187 -1.357 26021 5278 1 9 . 1 1 6 6 GLY H H 6 8.350 8.350 8.182 0.168 26021 5279 1 9 . 1 1 7 7 ALA N N 7 123.366 123.366 123.374 -0.008 26021 5280 1 9 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.173 0.043 26021 5281 1 9 . 1 1 7 7 ALA C C 7 179.006 179.006 178.806 0.200 26021 5282 1 9 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.376 -0.673 26021 5283 1 9 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.431 0.413 26021 5284 1 9 . 1 1 7 7 ALA H H 7 8.078 8.078 8.113 -0.035 26021 5285 1 9 . 1 1 8 8 ILE N N 8 117.376 117.376 118.182 -0.806 26021 5286 1 9 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.822 -0.042 26021 5287 1 9 . 1 1 8 8 ILE C C 8 177.032 177.032 178.353 -1.321 26021 5288 1 9 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.134 -0.976 26021 5289 1 9 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.183 -1.894 26021 5290 1 9 . 1 1 8 8 ILE H H 8 7.943 7.943 7.542 0.401 26021 5291 1 9 . 1 1 9 9 ALA N N 9 121.414 121.414 122.978 -1.564 26021 5292 1 9 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.043 -0.110 26021 5293 1 9 . 1 1 9 9 ALA C C 9 180.515 180.515 179.430 1.085 26021 5294 1 9 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.978 0.120 26021 5295 1 9 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.130 0.031 26021 5296 1 9 . 1 1 9 9 ALA H H 9 8.062 8.062 7.653 0.409 26021 5297 1 9 . 1 1 10 10 LYS N N 10 114.594 114.594 118.353 -3.759 26021 5298 1 9 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.124 0.040 26021 5299 1 9 . 1 1 10 10 LYS C C 10 178.099 178.099 178.256 -0.157 26021 5300 1 9 . 1 1 10 10 LYS CA C 10 57.840 57.840 57.904 -0.064 26021 5301 1 9 . 1 1 10 10 LYS CB C 10 32.469 32.469 31.954 0.515 26021 5302 1 9 . 1 1 10 10 LYS H H 10 7.554 7.554 7.694 -0.140 26021 5303 1 9 . 1 1 11 11 LEU N N 11 119.662 119.662 119.176 0.486 26021 5304 1 9 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.142 -0.064 26021 5305 1 9 . 1 1 11 11 LEU C C 11 177.930 177.930 178.169 -0.239 26021 5306 1 9 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.272 0.284 26021 5307 1 9 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.643 1.445 26021 5308 1 9 . 1 1 11 11 LEU H H 11 7.814 7.814 7.394 0.420 26021 5309 1 9 . 1 1 12 12 ILE N N 12 117.945 117.945 120.673 -2.728 26021 5310 1 9 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.897 -0.205 26021 5311 1 9 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.312 1.317 26021 5312 1 9 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.682 1.728 26021 5313 1 9 . 1 1 12 12 ILE H H 12 7.426 7.426 7.751 -0.325 26021 5314 1 9 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.276 0.127 26021 5315 1 9 . 1 1 13 13 PRO C C 13 179.030 179.030 178.912 0.118 26021 5316 1 9 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.408 -0.164 26021 5317 1 9 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.024 -0.215 26021 5318 1 9 . 1 1 14 14 LYS N N 14 117.855 117.855 118.883 -1.028 26021 5319 1 9 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.013 0.132 26021 5320 1 9 . 1 1 14 14 LYS C C 14 178.565 178.565 178.810 -0.245 26021 5321 1 9 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.466 -0.033 26021 5322 1 9 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.115 0.810 26021 5323 1 9 . 1 1 14 14 LYS H H 14 6.685 6.685 7.392 -0.707 26021 5324 1 9 . 1 1 15 15 LEU N N 15 118.008 118.008 117.958 0.050 26021 5325 1 9 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.294 -0.291 26021 5326 1 9 . 1 1 15 15 LEU C C 15 178.662 178.662 179.010 -0.348 26021 5327 1 9 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.961 0.751 26021 5328 1 9 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.351 -0.352 26021 5329 1 9 . 1 1 15 15 LEU H H 15 8.148 8.148 7.553 0.595 26021 5330 1 9 . 1 1 16 16 GLY N N 16 103.895 103.895 107.518 -3.623 26021 5331 1 9 . 1 1 16 16 GLY C C 16 176.838 176.838 176.738 0.100 26021 5332 1 9 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.193 0.172 26021 5333 1 9 . 1 1 16 16 GLY H H 16 8.104 8.104 8.028 0.076 26021 5334 1 9 . 1 1 17 17 GLU N N 17 121.655 121.655 122.389 -0.734 26021 5335 1 9 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.228 -0.095 26021 5336 1 9 . 1 1 17 17 GLU C C 17 179.007 179.007 179.020 -0.013 26021 5337 1 9 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.466 0.345 26021 5338 1 9 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.477 -0.344 26021 5339 1 9 . 1 1 17 17 GLU H H 17 7.817 7.817 7.991 -0.174 26021 5340 1 9 . 1 1 18 18 LEU N N 18 117.834 117.834 119.690 -1.856 26021 5341 1 9 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.306 -0.188 26021 5342 1 9 . 1 1 18 18 LEU C C 18 177.658 177.658 177.166 0.492 26021 5343 1 9 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.355 1.674 26021 5344 1 9 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.171 0.499 26021 5345 1 9 . 1 1 18 18 LEU H H 18 7.389 7.389 8.074 -0.685 26021 5346 1 9 . 1 1 19 19 LEU N N 19 113.694 113.694 116.891 -3.197 26021 5347 1 9 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.400 -0.238 26021 5348 1 9 . 1 1 19 19 LEU C C 19 178.123 178.123 177.861 0.262 26021 5349 1 9 . 1 1 19 19 LEU CA C 19 55.852 55.852 54.999 0.853 26021 5350 1 9 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.873 0.347 26021 5351 1 9 . 1 1 19 19 LEU H H 19 7.269 7.269 7.476 -0.207 26021 5352 1 9 . 1 1 20 20 VAL N N 20 112.778 112.778 113.439 -0.661 26021 5353 1 9 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.097 0.346 26021 5354 1 9 . 1 1 20 20 VAL C C 20 177.021 177.021 177.051 -0.030 26021 5355 1 9 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.823 -1.968 26021 5356 1 9 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.468 0.311 26021 5357 1 9 . 1 1 20 20 VAL H H 20 7.356 7.356 7.387 -0.031 26021 5358 1 9 . 1 1 21 21 GLY N N 21 108.962 108.962 107.999 0.963 26021 5359 1 9 . 1 1 21 21 GLY C C 21 173.813 173.813 174.059 -0.246 26021 5360 1 9 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.714 0.332 26021 5361 1 9 . 1 1 21 21 GLY H H 21 7.925 7.925 8.352 -0.427 26021 5362 1 9 . 1 1 22 22 GLU N N 22 120.607 120.607 122.910 -2.303 26021 5363 1 9 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.604 -0.326 26021 5364 1 9 . 1 1 22 22 GLU C C 22 175.869 175.869 175.484 0.385 26021 5365 1 9 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.416 0.613 26021 5366 1 9 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.015 -0.334 26021 5367 1 9 . 1 1 22 22 GLU H H 22 8.300 8.300 8.774 -0.474 26021 5368 1 9 . 1 1 23 23 TYR N N 23 120.738 120.738 119.347 1.391 26021 5369 1 9 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.003 -0.446 26021 5370 1 9 . 1 1 23 23 TYR C C 23 175.264 175.264 174.167 1.097 26021 5371 1 9 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.013 0.548 26021 5372 1 9 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.242 0.004 26021 5373 1 9 . 1 1 23 23 TYR H H 23 7.756 7.756 7.442 0.314 26021 5374 1 9 . 1 1 24 24 LYS N N 24 122.095 122.095 121.893 0.202 26021 5375 1 9 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.414 -0.231 26021 5376 1 9 . 1 1 24 24 LYS C C 24 175.742 175.742 174.913 0.829 26021 5377 1 9 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.940 0.178 26021 5378 1 9 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.154 -0.435 26021 5379 1 9 . 1 1 24 24 LYS H H 24 8.692 8.692 8.462 0.230 26021 5380 1 9 . 1 1 25 25 LEU N N 25 121.123 121.123 119.399 1.724 26021 5381 1 9 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.556 -0.064 26021 5382 1 9 . 1 1 25 25 LEU C C 25 177.487 177.487 176.227 1.260 26021 5383 1 9 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.346 0.988 26021 5384 1 9 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.904 -1.146 26021 5385 1 9 . 1 1 25 25 LEU H H 25 8.088 8.088 7.777 0.311 26021 5386 1 9 . 1 1 26 26 HIS N N 26 122.993 122.993 119.521 3.472 26021 5387 1 9 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.685 -0.184 26021 5388 1 9 . 1 1 26 26 HIS C C 26 176.716 176.716 176.913 -0.197 26021 5389 1 9 . 1 1 26 26 HIS CA C 26 57.197 57.197 55.472 1.725 26021 5390 1 9 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.676 0.681 26021 5391 1 9 . 1 1 26 26 HIS H H 26 8.882 8.882 8.368 0.514 26021 5392 1 9 . 1 1 27 27 LYS N N 27 124.894 124.894 121.107 3.787 26021 5393 1 9 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.385 -0.437 26021 5394 1 9 . 1 1 27 27 LYS C C 27 178.873 178.873 178.974 -0.101 26021 5395 1 9 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.738 1.273 26021 5396 1 9 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.536 -0.094 26021 5397 1 9 . 1 1 27 27 LYS H H 27 8.699 8.699 8.584 0.115 26021 5398 1 9 . 1 1 28 28 GLY N N 28 111.258 111.258 107.091 4.167 26021 5399 1 9 . 1 1 28 28 GLY C C 28 176.131 176.131 176.312 -0.181 26021 5400 1 9 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.810 -0.320 26021 5401 1 9 . 1 1 28 28 GLY H H 28 9.814 9.814 8.783 1.031 26021 5402 1 9 . 1 1 29 29 VAL N N 29 122.719 122.719 121.678 1.041 26021 5403 1 9 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.677 0.215 26021 5404 1 9 . 1 1 29 29 VAL C C 29 177.628 177.628 177.782 -0.154 26021 5405 1 9 . 1 1 29 29 VAL CA C 29 65.520 65.520 64.368 1.152 26021 5406 1 9 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.206 0.536 26021 5407 1 9 . 1 1 29 29 VAL H H 29 7.431 7.431 7.476 -0.045 26021 5408 1 9 . 1 1 30 30 LYS N N 30 119.791 119.791 120.074 -0.283 26021 5409 1 9 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.850 -0.215 26021 5410 1 9 . 1 1 30 30 LYS C C 30 177.666 177.666 178.270 -0.604 26021 5411 1 9 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.938 1.086 26021 5412 1 9 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.890 0.515 26021 5413 1 9 . 1 1 30 30 LYS H H 30 8.255 8.255 8.123 0.132 26021 5414 1 9 . 1 1 31 31 LYS N N 31 117.918 117.918 117.956 -0.038 26021 5415 1 9 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.251 -0.135 26021 5416 1 9 . 1 1 31 31 LYS C C 31 177.784 177.784 178.815 -1.031 26021 5417 1 9 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.432 -0.729 26021 5418 1 9 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.265 -0.420 26021 5419 1 9 . 1 1 31 31 LYS H H 31 7.689 7.689 7.501 0.188 26021 5420 1 9 . 1 1 32 32 ASN N N 32 116.347 116.347 118.102 -1.755 26021 5421 1 9 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.347 0.173 26021 5422 1 9 . 1 1 32 32 ASN C C 32 177.764 177.764 177.312 0.452 26021 5423 1 9 . 1 1 32 32 ASN CA C 32 56.315 56.315 56.205 0.111 26021 5424 1 9 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.583 0.049 26021 5425 1 9 . 1 1 32 32 ASN H H 32 7.556 7.556 7.944 -0.388 26021 5426 1 9 . 1 1 33 33 ILE N N 33 120.592 120.592 120.882 -0.290 26021 5427 1 9 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.729 -0.447 26021 5428 1 9 . 1 1 33 33 ILE C C 33 177.074 177.074 177.395 -0.321 26021 5429 1 9 . 1 1 33 33 ILE CA C 33 65.888 65.888 65.049 0.839 26021 5430 1 9 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.884 -0.706 26021 5431 1 9 . 1 1 33 33 ILE H H 33 8.236 8.236 7.682 0.554 26021 5432 1 9 . 1 1 34 34 GLU N N 34 120.595 120.595 119.597 0.998 26021 5433 1 9 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.891 -0.103 26021 5434 1 9 . 1 1 34 34 GLU C C 34 179.739 179.739 179.060 0.679 26021 5435 1 9 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.795 0.444 26021 5436 1 9 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.939 0.906 26021 5437 1 9 . 1 1 34 34 GLU H H 34 8.551 8.551 8.645 -0.094 26021 5438 1 9 . 1 1 35 35 ASP N N 35 120.600 120.600 121.062 -0.462 26021 5439 1 9 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.559 -0.147 26021 5440 1 9 . 1 1 35 35 ASP C C 35 178.681 178.681 178.489 0.192 26021 5441 1 9 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.596 0.866 26021 5442 1 9 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.708 -0.958 26021 5443 1 9 . 1 1 35 35 ASP H H 35 8.670 8.670 7.633 1.037 26021 5444 1 9 . 1 1 36 36 LEU N N 36 123.004 123.004 120.686 2.318 26021 5445 1 9 . 1 1 36 36 LEU HA H 36 4.095 4.095 3.999 0.096 26021 5446 1 9 . 1 1 36 36 LEU C C 36 178.035 178.035 178.827 -0.792 26021 5447 1 9 . 1 1 36 36 LEU CA C 36 58.028 58.028 58.074 -0.046 26021 5448 1 9 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.054 -0.178 26021 5449 1 9 . 1 1 36 36 LEU H H 36 8.166 8.166 7.935 0.231 26021 5450 1 9 . 1 1 37 37 LEU N N 37 120.178 120.178 119.186 0.992 26021 5451 1 9 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.081 -0.225 26021 5452 1 9 . 1 1 37 37 LEU C C 37 178.128 178.128 178.112 0.016 26021 5453 1 9 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.933 0.742 26021 5454 1 9 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.565 0.590 26021 5455 1 9 . 1 1 37 37 LEU H H 37 8.736 8.736 8.429 0.307 26021 5456 1 9 . 1 1 38 38 LYS N N 38 118.110 118.110 119.350 -1.240 26021 5457 1 9 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.957 -0.024 26021 5458 1 9 . 1 1 38 38 LYS C C 38 179.533 179.533 178.560 0.973 26021 5459 1 9 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.923 0.350 26021 5460 1 9 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.227 0.050 26021 5461 1 9 . 1 1 38 38 LYS H H 38 7.770 7.770 7.417 0.353 26021 5462 1 9 . 1 1 39 39 GLU N N 39 119.265 119.265 118.785 0.480 26021 5463 1 9 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.121 0.181 26021 5464 1 9 . 1 1 39 39 GLU C C 39 179.720 179.720 179.252 0.468 26021 5465 1 9 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.866 -0.108 26021 5466 1 9 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.271 0.319 26021 5467 1 9 . 1 1 39 39 GLU H H 39 7.709 7.709 8.049 -0.340 26021 5468 1 9 . 1 1 40 40 LEU N N 40 119.007 119.007 121.658 -2.651 26021 5469 1 9 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.193 -0.143 26021 5470 1 9 . 1 1 40 40 LEU C C 40 179.690 179.690 178.774 0.916 26021 5471 1 9 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.649 0.002 26021 5472 1 9 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.887 -0.202 26021 5473 1 9 . 1 1 40 40 LEU H H 40 8.851 8.851 7.824 1.027 26021 5474 1 9 . 1 1 41 41 LYS N N 41 120.500 120.500 119.173 1.327 26021 5475 1 9 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.027 -0.075 26021 5476 1 9 . 1 1 41 41 LYS C C 41 180.223 180.223 178.906 1.317 26021 5477 1 9 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.772 1.119 26021 5478 1 9 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.138 -0.071 26021 5479 1 9 . 1 1 41 41 LYS H H 41 8.482 8.482 8.223 0.259 26021 5480 1 9 . 1 1 42 42 THR N N 42 119.555 119.555 112.085 7.470 26021 5481 1 9 . 1 1 42 42 THR HA H 42 4.000 4.000 4.268 -0.268 26021 5482 1 9 . 1 1 42 42 THR C C 42 176.633 176.633 176.531 0.102 26021 5483 1 9 . 1 1 42 42 THR CA C 42 66.574 66.574 64.624 1.950 26021 5484 1 9 . 1 1 42 42 THR CB C 42 67.924 67.924 68.453 -0.528 26021 5485 1 9 . 1 1 42 42 THR H H 42 7.863 7.863 7.641 0.222 26021 5486 1 9 . 1 1 43 43 MET N N 43 122.839 122.839 121.981 0.858 26021 5487 1 9 . 1 1 43 43 MET HA H 43 4.022 4.022 4.107 -0.085 26021 5488 1 9 . 1 1 43 43 MET C C 43 177.290 177.290 178.012 -0.722 26021 5489 1 9 . 1 1 43 43 MET CA C 43 59.731 59.731 60.067 -0.336 26021 5490 1 9 . 1 1 43 43 MET CB C 43 33.610 33.610 32.414 1.196 26021 5491 1 9 . 1 1 43 43 MET H H 43 8.714 8.714 7.727 0.987 26021 5492 1 9 . 1 1 44 44 ASN N N 44 118.049 118.049 117.655 0.394 26021 5493 1 9 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.299 0.075 26021 5494 1 9 . 1 1 44 44 ASN C C 44 176.297 176.297 177.386 -1.089 26021 5495 1 9 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.542 0.352 26021 5496 1 9 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.908 0.498 26021 5497 1 9 . 1 1 44 44 ASN H H 44 8.988 8.988 8.451 0.537 26021 5498 1 9 . 1 1 45 45 ALA N N 45 119.260 119.260 121.342 -2.082 26021 5499 1 9 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.199 -0.133 26021 5500 1 9 . 1 1 45 45 ALA C C 45 180.476 180.476 179.168 1.308 26021 5501 1 9 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.403 0.865 26021 5502 1 9 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.345 -0.657 26021 5503 1 9 . 1 1 45 45 ALA H H 45 7.675 7.675 7.495 0.180 26021 5504 1 9 . 1 1 46 46 ALA N N 46 121.126 121.126 122.602 -1.476 26021 5505 1 9 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.077 0.039 26021 5506 1 9 . 1 1 46 46 ALA C C 46 179.314 179.314 179.335 -0.021 26021 5507 1 9 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.063 -0.077 26021 5508 1 9 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.466 -0.244 26021 5509 1 9 . 1 1 46 46 ALA H H 46 7.872 7.872 7.809 0.063 26021 5510 1 9 . 1 1 47 47 LEU N N 47 119.328 119.328 115.598 3.730 26021 5511 1 9 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.165 0.026 26021 5512 1 9 . 1 1 47 47 LEU C C 47 180.403 180.403 177.983 2.420 26021 5513 1 9 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.125 -0.079 26021 5514 1 9 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.706 0.244 26021 5515 1 9 . 1 1 47 47 LEU H H 47 8.529 8.529 8.165 0.364 26021 5516 1 9 . 1 1 48 48 ILE N N 48 121.653 121.653 118.430 3.223 26021 5517 1 9 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.797 -0.095 26021 5518 1 9 . 1 1 48 48 ILE C C 48 178.730 178.730 178.523 0.207 26021 5519 1 9 . 1 1 48 48 ILE CA C 48 64.910 64.910 62.933 1.977 26021 5520 1 9 . 1 1 48 48 ILE CB C 48 37.912 37.912 36.677 1.235 26021 5521 1 9 . 1 1 48 48 ILE H H 48 8.386 8.386 7.165 1.221 26021 5522 1 9 . 1 1 49 49 LYS N N 49 119.896 119.896 120.430 -0.534 26021 5523 1 9 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.099 -0.056 26021 5524 1 9 . 1 1 49 49 LYS C C 49 179.999 179.999 179.081 0.918 26021 5525 1 9 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.033 0.024 26021 5526 1 9 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.390 -0.429 26021 5527 1 9 . 1 1 49 49 LYS H H 49 7.456 7.456 7.449 0.007 26021 5528 1 9 . 1 1 50 50 ILE N N 50 119.964 119.964 114.083 5.881 26021 5529 1 9 . 1 1 50 50 ILE HA H 50 3.736 3.736 3.817 -0.081 26021 5530 1 9 . 1 1 50 50 ILE C C 50 177.960 177.960 176.850 1.110 26021 5531 1 9 . 1 1 50 50 ILE CA C 50 64.349 64.349 62.920 1.429 26021 5532 1 9 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.792 0.340 26021 5533 1 9 . 1 1 50 50 ILE H H 50 8.154 8.154 8.198 -0.044 26021 5534 1 9 . 1 1 51 51 GLY N N 51 106.709 106.709 106.039 0.670 26021 5535 1 9 . 1 1 51 51 GLY C C 51 174.461 174.461 174.905 -0.444 26021 5536 1 9 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.313 0.596 26021 5537 1 9 . 1 1 51 51 GLY H H 51 7.932 7.932 7.644 0.288 26021 5538 1 9 . 1 1 52 52 GLU N N 52 118.736 118.736 119.841 -1.105 26021 5539 1 9 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.221 0.099 26021 5540 1 9 . 1 1 52 52 GLU C C 52 176.789 176.789 177.338 -0.549 26021 5541 1 9 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.218 -0.944 26021 5542 1 9 . 1 1 52 52 GLU CB C 52 30.112 30.112 29.942 0.170 26021 5543 1 9 . 1 1 52 52 GLU H H 52 7.597 7.597 7.720 -0.123 26021 5544 1 9 . 1 1 53 53 VAL N N 53 122.982 122.982 118.234 4.748 26021 5545 1 9 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.238 0.023 26021 5546 1 9 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.040 1.345 26021 5547 1 9 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.758 2.064 26021 5548 1 9 . 1 1 53 53 VAL H H 53 7.511 7.511 7.379 0.132 26021 5549 1 9 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.792 -0.147 26021 5550 1 9 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.532 0.046 26021 5551 1 9 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.003 0.532 26021 5552 1 9 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.328 -0.137 26021 5553 1 9 . 1 1 55 55 PRO C C 55 178.258 178.258 177.871 0.387 26021 5554 1 9 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.880 0.548 26021 5555 1 9 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.686 0.161 26021 5556 1 9 . 1 1 56 56 ASP N N 56 114.117 114.117 119.311 -5.194 26021 5557 1 9 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.515 -0.024 26021 5558 1 9 . 1 1 56 56 ASP C C 56 176.696 176.696 176.977 -0.281 26021 5559 1 9 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.937 -0.798 26021 5560 1 9 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.797 -1.071 26021 5561 1 9 . 1 1 56 56 ASP H H 56 8.489 8.489 8.766 -0.277 26021 5562 1 9 . 1 1 57 57 GLN N N 57 117.641 117.641 117.092 0.549 26021 5563 1 9 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.445 -0.071 26021 5564 1 9 . 1 1 57 57 GLN C C 57 175.765 175.765 175.258 0.507 26021 5565 1 9 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.077 0.213 26021 5566 1 9 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.555 0.091 26021 5567 1 9 . 1 1 57 57 GLN H H 57 8.206 8.206 7.680 0.526 26021 5568 1 9 . 1 1 58 58 LEU N N 58 122.141 122.141 120.446 1.695 26021 5569 1 9 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.448 0.002 26021 5570 1 9 . 1 1 58 58 LEU C C 58 176.849 176.849 175.940 0.909 26021 5571 1 9 . 1 1 58 58 LEU CA C 58 54.995 54.995 53.922 1.073 26021 5572 1 9 . 1 1 58 58 LEU CB C 58 43.231 43.231 43.753 -0.522 26021 5573 1 9 . 1 1 58 58 LEU H H 58 7.152 7.152 7.178 -0.026 26021 5574 1 9 . 1 1 59 59 ASP N N 59 125.643 125.643 119.774 5.869 26021 5575 1 9 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.810 -0.091 26021 5576 1 9 . 1 1 59 59 ASP C C 59 177.249 177.249 177.103 0.146 26021 5577 1 9 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.141 0.262 26021 5578 1 9 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.698 -1.466 26021 5579 1 9 . 1 1 59 59 ASP H H 59 9.312 9.312 8.222 1.090 26021 5580 1 9 . 1 1 60 60 SER N N 60 116.550 116.550 115.983 0.567 26021 5581 1 9 . 1 1 60 60 SER HA H 60 4.124 4.124 4.206 -0.082 26021 5582 1 9 . 1 1 60 60 SER C C 60 176.840 176.840 176.005 0.835 26021 5583 1 9 . 1 1 60 60 SER CA C 60 61.722 61.722 60.991 0.731 26021 5584 1 9 . 1 1 60 60 SER CB C 60 62.815 62.815 63.462 -0.647 26021 5585 1 9 . 1 1 60 60 SER H H 60 8.647 8.647 8.592 0.055 26021 5586 1 9 . 1 1 61 61 GLN N N 61 121.394 121.394 119.330 2.064 26021 5587 1 9 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.207 -0.076 26021 5588 1 9 . 1 1 61 61 GLN C C 61 178.629 178.629 177.615 1.014 26021 5589 1 9 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.902 -0.149 26021 5590 1 9 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.648 -0.395 26021 5591 1 9 . 1 1 61 61 GLN H H 61 8.453 8.453 7.868 0.585 26021 5592 1 9 . 1 1 62 62 ASP N N 62 122.187 122.187 118.595 3.592 26021 5593 1 9 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.404 0.215 26021 5594 1 9 . 1 1 62 62 ASP C C 62 178.318 178.318 178.542 -0.224 26021 5595 1 9 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.389 0.073 26021 5596 1 9 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.470 0.566 26021 5597 1 9 . 1 1 62 62 ASP H H 62 8.311 8.311 8.666 -0.355 26021 5598 1 9 . 1 1 63 63 LYS N N 63 120.325 120.325 119.141 1.184 26021 5599 1 9 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.205 -0.196 26021 5600 1 9 . 1 1 63 63 LYS C C 63 178.765 178.765 179.517 -0.752 26021 5601 1 9 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.788 0.965 26021 5602 1 9 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.181 0.272 26021 5603 1 9 . 1 1 63 63 LYS H H 63 7.923 7.923 7.557 0.366 26021 5604 1 9 . 1 1 64 64 LEU N N 64 119.491 119.491 120.711 -1.220 26021 5605 1 9 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.114 0.112 26021 5606 1 9 . 1 1 64 64 LEU C C 64 179.526 179.526 178.609 0.917 26021 5607 1 9 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.373 0.425 26021 5608 1 9 . 1 1 64 64 LEU CB C 64 41.775 41.775 40.847 0.928 26021 5609 1 9 . 1 1 64 64 LEU H H 64 7.820 7.820 7.402 0.418 26021 5610 1 9 . 1 1 65 65 TRP N N 65 120.674 120.674 120.853 -0.179 26021 5611 1 9 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.445 -0.137 26021 5612 1 9 . 1 1 65 65 TRP C C 65 177.379 177.379 177.546 -0.167 26021 5613 1 9 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.718 1.084 26021 5614 1 9 . 1 1 65 65 TRP CB C 65 28.411 28.411 29.050 -0.639 26021 5615 1 9 . 1 1 65 65 TRP H H 65 8.196 8.196 8.345 -0.149 26021 5616 1 9 . 1 1 66 66 ALA N N 66 120.606 120.606 119.606 1.000 26021 5617 1 9 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.692 0.017 26021 5618 1 9 . 1 1 66 66 ALA C C 66 180.376 180.376 179.036 1.340 26021 5619 1 9 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.699 0.865 26021 5620 1 9 . 1 1 66 66 ALA CB C 66 17.654 17.654 18.117 -0.463 26021 5621 1 9 . 1 1 66 66 ALA H H 66 8.305 8.305 7.637 0.668 26021 5622 1 9 . 1 1 67 67 ASP N N 67 119.175 119.175 118.834 0.341 26021 5623 1 9 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.374 0.076 26021 5624 1 9 . 1 1 67 67 ASP C C 67 178.757 178.757 178.110 0.647 26021 5625 1 9 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.559 0.933 26021 5626 1 9 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.808 -0.654 26021 5627 1 9 . 1 1 67 67 ASP H H 67 7.945 7.945 7.849 0.096 26021 5628 1 9 . 1 1 68 68 GLU N N 68 122.322 122.322 118.752 3.570 26021 5629 1 9 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.257 -0.242 26021 5630 1 9 . 1 1 68 68 GLU C C 68 180.055 180.055 178.906 1.149 26021 5631 1 9 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.388 0.722 26021 5632 1 9 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.225 0.422 26021 5633 1 9 . 1 1 68 68 GLU H H 68 8.168 8.168 7.633 0.535 26021 5634 1 9 . 1 1 69 69 VAL N N 69 122.135 122.135 117.974 4.161 26021 5635 1 9 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.587 -0.335 26021 5636 1 9 . 1 1 69 69 VAL C C 69 177.736 177.736 177.795 -0.059 26021 5637 1 9 . 1 1 69 69 VAL CA C 69 66.539 66.539 66.440 0.099 26021 5638 1 9 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.557 -0.315 26021 5639 1 9 . 1 1 69 69 VAL H H 69 8.424 8.424 7.039 1.385 26021 5640 1 9 . 1 1 70 70 ARG N N 70 121.373 121.373 120.266 1.107 26021 5641 1 9 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.975 -0.283 26021 5642 1 9 . 1 1 70 70 ARG C C 70 179.117 179.117 178.494 0.623 26021 5643 1 9 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.583 0.583 26021 5644 1 9 . 1 1 70 70 ARG CB C 70 29.654 29.654 30.253 -0.599 26021 5645 1 9 . 1 1 70 70 ARG H H 70 7.916 7.916 7.365 0.551 26021 5646 1 9 . 1 1 71 71 GLU N N 71 119.075 119.075 118.712 0.363 26021 5647 1 9 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.861 0.202 26021 5648 1 9 . 1 1 71 71 GLU C C 71 179.119 179.119 179.218 -0.099 26021 5649 1 9 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.770 0.917 26021 5650 1 9 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.884 0.386 26021 5651 1 9 . 1 1 71 71 GLU H H 71 8.031 8.031 8.147 -0.116 26021 5652 1 9 . 1 1 72 72 LEU N N 72 120.503 120.503 119.800 0.703 26021 5653 1 9 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.183 -0.126 26021 5654 1 9 . 1 1 72 72 LEU C C 72 178.734 178.734 178.783 -0.049 26021 5655 1 9 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.642 0.781 26021 5656 1 9 . 1 1 72 72 LEU CB C 72 41.408 41.408 42.114 -0.706 26021 5657 1 9 . 1 1 72 72 LEU H H 72 8.175 8.175 7.488 0.687 26021 5658 1 9 . 1 1 73 73 SER N N 73 115.243 115.243 115.078 0.165 26021 5659 1 9 . 1 1 73 73 SER HA H 73 3.824 3.824 4.163 -0.339 26021 5660 1 9 . 1 1 73 73 SER C C 73 175.697 175.697 176.643 -0.946 26021 5661 1 9 . 1 1 73 73 SER CA C 73 62.384 62.384 61.419 0.965 26021 5662 1 9 . 1 1 73 73 SER CB C 73 62.093 62.093 62.530 -0.437 26021 5663 1 9 . 1 1 73 73 SER H H 73 8.411 8.411 8.033 0.378 26021 5664 1 9 . 1 1 74 74 TYR N N 74 121.342 121.342 121.446 -0.104 26021 5665 1 9 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.238 0.253 26021 5666 1 9 . 1 1 74 74 TYR C C 74 178.747 178.747 177.818 0.929 26021 5667 1 9 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.882 -0.447 26021 5668 1 9 . 1 1 74 74 TYR CB C 74 37.507 37.507 37.935 -0.428 26021 5669 1 9 . 1 1 74 74 TYR H H 74 7.314 7.314 7.651 -0.337 26021 5670 1 9 . 1 1 75 75 VAL N N 75 120.779 120.779 118.859 1.920 26021 5671 1 9 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.781 0.080 26021 5672 1 9 . 1 1 75 75 VAL C C 75 179.788 179.788 178.217 1.571 26021 5673 1 9 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.007 1.041 26021 5674 1 9 . 1 1 75 75 VAL CB C 75 31.714 31.714 30.487 1.227 26021 5675 1 9 . 1 1 75 75 VAL H H 75 7.740 7.740 7.902 -0.162 26021 5676 1 9 . 1 1 76 76 ILE N N 76 120.598 120.598 119.588 1.010 26021 5677 1 9 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.686 0.014 26021 5678 1 9 . 1 1 76 76 ILE C C 76 177.066 177.066 177.834 -0.768 26021 5679 1 9 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.439 1.480 26021 5680 1 9 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.436 -0.051 26021 5681 1 9 . 1 1 76 76 ILE H H 76 8.584 8.584 7.529 1.055 26021 5682 1 9 . 1 1 77 77 GLU N N 77 120.468 120.468 120.859 -0.391 26021 5683 1 9 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.854 -0.205 26021 5684 1 9 . 1 1 77 77 GLU C C 77 177.502 177.502 178.433 -0.931 26021 5685 1 9 . 1 1 77 77 GLU CA C 77 60.862 60.862 60.031 0.831 26021 5686 1 9 . 1 1 77 77 GLU CB C 77 29.352 29.352 29.162 0.190 26021 5687 1 9 . 1 1 77 77 GLU H H 77 8.445 8.445 8.293 0.152 26021 5688 1 9 . 1 1 78 78 ASP N N 78 117.382 117.382 119.896 -2.514 26021 5689 1 9 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.382 0.009 26021 5690 1 9 . 1 1 78 78 ASP C C 78 177.382 177.382 178.129 -0.747 26021 5691 1 9 . 1 1 78 78 ASP CA C 78 57.495 57.495 57.271 0.224 26021 5692 1 9 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.187 1.748 26021 5693 1 9 . 1 1 78 78 ASP H H 78 7.885 7.885 7.698 0.187 26021 5694 1 9 . 1 1 79 79 ALA N N 79 120.171 120.171 121.316 -1.145 26021 5695 1 9 . 1 1 79 79 ALA HA H 79 4.050 4.050 3.994 0.056 26021 5696 1 9 . 1 1 79 79 ALA C C 79 181.193 181.193 178.880 2.313 26021 5697 1 9 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.202 -0.147 26021 5698 1 9 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.680 -0.260 26021 5699 1 9 . 1 1 79 79 ALA H H 79 7.754 7.754 7.995 -0.241 26021 5700 1 9 . 1 1 80 80 VAL N N 80 119.541 119.541 112.309 7.232 26021 5701 1 9 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.952 -0.275 26021 5702 1 9 . 1 1 80 80 VAL C C 80 177.096 177.096 177.745 -0.649 26021 5703 1 9 . 1 1 80 80 VAL CA C 80 67.084 67.084 63.166 3.918 26021 5704 1 9 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.848 -0.405 26021 5705 1 9 . 1 1 80 80 VAL H H 80 8.635 8.635 7.386 1.249 26021 5706 1 9 . 1 1 81 81 ASP N N 81 121.140 121.140 121.817 -0.677 26021 5707 1 9 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.354 0.115 26021 5708 1 9 . 1 1 81 81 ASP C C 81 179.569 179.569 178.399 1.170 26021 5709 1 9 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.341 0.588 26021 5710 1 9 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.602 -0.667 26021 5711 1 9 . 1 1 81 81 ASP H H 81 8.575 8.575 8.326 0.249 26021 5712 1 9 . 1 1 82 82 LYS N N 82 118.159 118.159 118.521 -0.362 26021 5713 1 9 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.060 -0.039 26021 5714 1 9 . 1 1 82 82 LYS C C 82 178.890 178.890 178.903 -0.013 26021 5715 1 9 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.554 0.513 26021 5716 1 9 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.879 0.708 26021 5717 1 9 . 1 1 82 82 LYS H H 82 8.079 8.079 7.967 0.112 26021 5718 1 9 . 1 1 83 83 PHE N N 83 120.900 120.900 120.441 0.459 26021 5719 1 9 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.392 -0.116 26021 5720 1 9 . 1 1 83 83 PHE C C 83 177.269 177.269 176.514 0.755 26021 5721 1 9 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.534 0.409 26021 5722 1 9 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.583 0.164 26021 5723 1 9 . 1 1 83 83 PHE H H 83 8.015 8.015 7.805 0.210 26021 5724 1 9 . 1 1 84 84 LEU N N 84 118.209 118.209 118.768 -0.559 26021 5725 1 9 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.235 -0.293 26021 5726 1 9 . 1 1 84 84 LEU C C 84 178.774 178.774 178.064 0.710 26021 5727 1 9 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.294 0.876 26021 5728 1 9 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.223 0.970 26021 5729 1 9 . 1 1 84 84 LEU H H 84 8.338 8.338 8.023 0.315 26021 5730 1 9 . 1 1 85 85 VAL N N 85 116.078 116.078 120.205 -4.127 26021 5731 1 9 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.640 0.351 26021 5732 1 9 . 1 1 85 85 VAL C C 85 177.252 177.252 177.055 0.197 26021 5733 1 9 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.690 -1.510 26021 5734 1 9 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.812 0.078 26021 5735 1 9 . 1 1 85 85 VAL H H 85 7.447 7.447 7.282 0.165 26021 5736 1 9 . 1 1 86 86 ARG N N 86 120.842 120.842 117.473 3.369 26021 5737 1 9 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.077 0.150 26021 5738 1 9 . 1 1 86 86 ARG C C 86 177.520 177.520 179.044 -1.524 26021 5739 1 9 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.184 -1.125 26021 5740 1 9 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.853 0.410 26021 5741 1 9 . 1 1 86 86 ARG H H 86 7.598 7.598 7.390 0.208 26021 5742 1 9 . 1 1 87 87 VAL N N 87 119.293 119.293 117.779 1.514 26021 5743 1 9 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.837 -0.012 26021 5744 1 9 . 1 1 87 87 VAL C C 87 176.121 176.121 177.098 -0.977 26021 5745 1 9 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.389 -1.951 26021 5746 1 9 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.672 1.100 26021 5747 1 9 . 1 1 87 87 VAL H H 87 7.994 7.994 7.934 0.060 26021 5748 1 9 . 1 1 88 88 HIS N N 88 120.016 120.016 118.121 1.895 26021 5749 1 9 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.514 0.123 26021 5750 1 9 . 1 1 88 88 HIS C C 88 175.639 175.639 176.100 -0.461 26021 5751 1 9 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.084 0.267 26021 5752 1 9 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.471 -0.790 26021 5753 1 9 . 1 1 88 88 HIS H H 88 7.969 7.969 8.328 -0.359 26021 5754 1 9 . 1 1 89 89 GLY N N 89 109.587 109.587 108.844 0.743 26021 5755 1 9 . 1 1 89 89 GLY C C 89 173.730 173.730 174.011 -0.281 26021 5756 1 9 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.700 -0.531 26021 5757 1 9 . 1 1 89 89 GLY H H 89 8.083 8.083 8.058 0.025 26021 5758 1 9 . 1 1 90 90 VAL N N 90 118.224 118.224 120.022 -1.798 26021 5759 1 9 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.254 -0.116 26021 5760 1 9 . 1 1 90 90 VAL C C 90 176.018 176.018 174.994 1.024 26021 5761 1 9 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.762 1.663 26021 5762 1 9 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.255 -0.638 26021 5763 1 9 . 1 1 90 90 VAL H H 90 7.944 7.944 7.349 0.595 26021 5764 1 9 . 1 1 91 91 GLU N N 91 124.313 124.313 126.298 -1.985 26021 5765 1 9 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.385 0.221 26021 5766 1 9 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.221 -0.045 26021 5767 1 9 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.595 1.165 26021 5768 1 9 . 1 1 91 91 GLU H H 91 8.423 8.423 8.343 0.080 26021 5769 1 9 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.436 -0.099 26021 5770 1 9 . 1 1 92 92 PRO C C 92 176.504 176.504 175.710 0.794 26021 5771 1 9 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.013 0.360 26021 5772 1 9 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.178 -0.011 26021 5773 1 9 . 1 1 93 93 ASP N N 93 120.275 120.275 120.716 -0.441 26021 5774 1 9 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.715 -0.143 26021 5775 1 9 . 1 1 93 93 ASP CA C 93 53.970 53.970 54.006 -0.036 26021 5776 1 9 . 1 1 93 93 ASP CB C 93 41.515 41.515 42.849 -1.334 26021 5777 1 9 . 1 1 93 93 ASP H H 93 8.286 8.286 8.182 0.104 26021 5778 1 9 . 1 1 94 94 ASP N N 94 121.181 121.181 123.785 -2.604 26021 5779 1 9 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.669 -0.104 26021 5780 1 9 . 1 1 94 94 ASP C C 94 176.474 176.474 177.618 -1.144 26021 5781 1 9 . 1 1 94 94 ASP CA C 94 54.373 54.373 54.743 -0.370 26021 5782 1 9 . 1 1 94 94 ASP CB C 94 41.225 41.225 42.355 -1.129 26021 5783 1 9 . 1 1 94 94 ASP H H 94 8.259 8.259 8.563 -0.304 26021 5784 1 9 . 1 1 95 95 ASN N N 95 118.728 118.728 119.509 -0.781 26021 5785 1 9 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.531 0.163 26021 5786 1 9 . 1 1 95 95 ASN C C 95 176.272 176.272 177.564 -1.292 26021 5787 1 9 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.989 -2.003 26021 5788 1 9 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.343 0.386 26021 5789 1 9 . 1 1 95 95 ASN H H 95 8.474 8.474 8.412 0.062 26021 5790 1 9 . 1 1 96 96 THR N N 96 113.868 113.868 115.287 -1.419 26021 5791 1 9 . 1 1 96 96 THR HA H 96 4.220 4.220 4.095 0.125 26021 5792 1 9 . 1 1 96 96 THR C C 96 175.107 175.107 175.671 -0.564 26021 5793 1 9 . 1 1 96 96 THR CA C 96 63.200 63.200 65.229 -2.029 26021 5794 1 9 . 1 1 96 96 THR CB C 96 69.475 69.475 68.465 1.010 26021 5795 1 9 . 1 1 96 96 THR H H 96 8.263 8.263 8.063 0.200 26021 5796 1 9 . 1 1 97 97 ASN N N 97 119.954 119.954 119.466 0.488 26021 5797 1 9 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.637 -0.021 26021 5798 1 9 . 1 1 97 97 ASN C C 97 176.275 176.275 176.498 -0.223 26021 5799 1 9 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.975 -1.019 26021 5800 1 9 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.730 -0.038 26021 5801 1 9 . 1 1 97 97 ASN H H 97 8.431 8.431 8.023 0.408 26021 5802 1 9 . 1 1 98 98 GLY N N 98 108.847 108.847 107.322 1.525 26021 5803 1 9 . 1 1 98 98 GLY C C 98 175.533 175.533 175.265 0.268 26021 5804 1 9 . 1 1 98 98 GLY CA C 98 46.011 46.011 45.775 0.236 26021 5805 1 9 . 1 1 98 98 GLY H H 98 8.338 8.338 7.741 0.597 26021 5806 1 9 . 1 1 99 99 PHE N N 99 118.492 118.492 120.061 -1.569 26021 5807 1 9 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.126 0.122 26021 5808 1 9 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.391 1.568 26021 5809 1 9 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.150 -0.991 26021 5810 1 9 . 1 1 99 99 PHE H H 99 8.370 8.370 8.612 -0.242 26021 5811 1 9 . 1 1 100 100 LYS N N 100 120.987 120.987 120.393 0.594 26021 5812 1 9 . 1 1 100 100 LYS H H 100 8.256 8.256 8.398 -0.142 26021 5813 1 9 . 1 1 101 101 GLY N N 101 108.186 108.186 106.388 1.798 26021 5814 1 9 . 1 1 101 101 GLY C C 101 177.075 177.075 176.119 0.956 26021 5815 1 9 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.114 0.788 26021 5816 1 9 . 1 1 101 101 GLY H H 101 8.300 8.300 7.628 0.672 26021 5817 1 9 . 1 1 102 102 LEU N N 102 121.439 121.439 123.962 -2.523 26021 5818 1 9 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.992 0.105 26021 5819 1 9 . 1 1 102 102 LEU C C 102 179.836 179.836 178.082 1.754 26021 5820 1 9 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.660 -0.302 26021 5821 1 9 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.614 0.157 26021 5822 1 9 . 1 1 102 102 LEU H H 102 7.777 7.777 7.904 -0.128 26021 5823 1 9 . 1 1 103 103 MET N N 103 122.290 122.290 116.991 5.299 26021 5824 1 9 . 1 1 103 103 MET HA H 103 4.220 4.220 3.734 0.486 26021 5825 1 9 . 1 1 103 103 MET C C 103 177.739 177.739 177.783 -0.044 26021 5826 1 9 . 1 1 103 103 MET CA C 103 58.739 58.739 58.023 0.716 26021 5827 1 9 . 1 1 103 103 MET CB C 103 31.895 31.895 31.707 0.188 26021 5828 1 9 . 1 1 103 103 MET H H 103 8.409 8.409 8.118 0.291 26021 5829 1 9 . 1 1 104 104 LYS N N 104 119.750 119.750 116.939 2.811 26021 5830 1 9 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.063 0.004 26021 5831 1 9 . 1 1 104 104 LYS C C 104 179.301 179.301 178.810 0.491 26021 5832 1 9 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.783 0.980 26021 5833 1 9 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.810 0.237 26021 5834 1 9 . 1 1 104 104 LYS H H 104 7.916 7.916 7.380 0.536 26021 5835 1 9 . 1 1 105 105 ARG N N 105 117.967 117.967 119.352 -1.385 26021 5836 1 9 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.119 -0.093 26021 5837 1 9 . 1 1 105 105 ARG C C 105 178.777 178.777 178.170 0.607 26021 5838 1 9 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.189 0.175 26021 5839 1 9 . 1 1 105 105 ARG CB C 105 30.997 30.997 29.843 1.154 26021 5840 1 9 . 1 1 105 105 ARG H H 105 7.719 7.719 7.411 0.308 26021 5841 1 9 . 1 1 106 106 THR N N 106 117.211 117.211 112.945 4.266 26021 5842 1 9 . 1 1 106 106 THR HA H 106 4.301 4.301 4.154 0.147 26021 5843 1 9 . 1 1 106 106 THR C C 106 176.254 176.254 176.199 0.055 26021 5844 1 9 . 1 1 106 106 THR CA C 106 67.860 67.860 65.888 1.972 26021 5845 1 9 . 1 1 106 106 THR CB C 106 67.860 67.860 68.216 -0.356 26021 5846 1 9 . 1 1 106 106 THR H H 106 8.152 8.152 7.843 0.309 26021 5847 1 9 . 1 1 107 107 THR N N 107 117.939 117.939 115.972 1.967 26021 5848 1 9 . 1 1 107 107 THR HA H 107 3.971 3.971 3.909 0.062 26021 5849 1 9 . 1 1 107 107 THR C C 107 176.780 176.780 176.162 0.618 26021 5850 1 9 . 1 1 107 107 THR CA C 107 66.822 66.822 65.694 1.128 26021 5851 1 9 . 1 1 107 107 THR CB C 107 68.818 68.818 68.750 0.068 26021 5852 1 9 . 1 1 107 107 THR H H 107 8.651 8.651 7.555 1.096 26021 5853 1 9 . 1 1 108 108 LYS N N 108 120.867 120.867 121.214 -0.347 26021 5854 1 9 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.032 -0.010 26021 5855 1 9 . 1 1 108 108 LYS C C 108 179.045 179.045 178.675 0.370 26021 5856 1 9 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.877 0.957 26021 5857 1 9 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.009 0.464 26021 5858 1 9 . 1 1 108 108 LYS H H 108 7.694 7.694 7.686 0.008 26021 5859 1 9 . 1 1 109 109 LEU N N 109 119.472 119.472 118.601 0.871 26021 5860 1 9 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.341 -0.020 26021 5861 1 9 . 1 1 109 109 LEU C C 109 179.974 179.974 179.520 0.454 26021 5862 1 9 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.531 0.062 26021 5863 1 9 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.249 -0.389 26021 5864 1 9 . 1 1 109 109 LEU H H 109 7.559 7.559 7.490 0.069 26021 5865 1 9 . 1 1 110 110 LEU N N 110 121.832 121.832 119.452 2.380 26021 5866 1 9 . 1 1 110 110 LEU HA H 110 4.191 4.191 3.975 0.216 26021 5867 1 9 . 1 1 110 110 LEU C C 110 178.101 178.101 178.761 -0.660 26021 5868 1 9 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.858 0.034 26021 5869 1 9 . 1 1 110 110 LEU CB C 110 41.884 41.884 40.997 0.887 26021 5870 1 9 . 1 1 110 110 LEU H H 110 8.567 8.567 7.862 0.705 26021 5871 1 9 . 1 1 111 111 LYS N N 111 117.972 117.972 117.210 0.762 26021 5872 1 9 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.145 -0.166 26021 5873 1 9 . 1 1 111 111 LYS C C 111 177.677 177.677 177.886 -0.209 26021 5874 1 9 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.910 -0.125 26021 5875 1 9 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.285 -0.076 26021 5876 1 9 . 1 1 111 111 LYS H H 111 7.965 7.965 7.945 0.020 26021 5877 1 9 . 1 1 112 112 LYS N N 112 115.433 115.433 117.416 -1.983 26021 5878 1 9 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.239 -0.129 26021 5879 1 9 . 1 1 112 112 LYS C C 112 178.270 178.270 178.326 -0.056 26021 5880 1 9 . 1 1 112 112 LYS CA C 112 58.951 58.951 57.536 1.415 26021 5881 1 9 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.687 0.104 26021 5882 1 9 . 1 1 112 112 LYS H H 112 7.334 7.334 7.882 -0.548 26021 5883 1 9 . 1 1 113 113 VAL N N 113 114.861 114.861 116.085 -1.224 26021 5884 1 9 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.761 0.070 26021 5885 1 9 . 1 1 113 113 VAL C C 113 176.999 176.999 177.467 -0.468 26021 5886 1 9 . 1 1 113 113 VAL CA C 113 63.505 63.505 64.613 -1.108 26021 5887 1 9 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.882 0.405 26021 5888 1 9 . 1 1 113 113 VAL H H 113 7.298 7.298 7.431 -0.133 26021 5889 1 9 . 1 1 114 114 VAL N N 114 121.457 121.457 119.605 1.852 26021 5890 1 9 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.734 -0.012 26021 5891 1 9 . 1 1 114 114 VAL C C 114 177.737 177.737 177.219 0.518 26021 5892 1 9 . 1 1 114 114 VAL CA C 114 65.224 65.224 65.299 -0.075 26021 5893 1 9 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.196 0.557 26021 5894 1 9 . 1 1 114 114 VAL H H 114 7.855 7.855 7.601 0.254 26021 5895 1 9 . 1 1 115 115 ASP N N 115 120.804 120.804 120.436 0.368 26021 5896 1 9 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.406 0.049 26021 5897 1 9 . 1 1 115 115 ASP C C 115 177.380 177.380 177.176 0.204 26021 5898 1 9 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.794 -0.873 26021 5899 1 9 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.692 -0.320 26021 5900 1 9 . 1 1 115 115 ASP H H 115 8.311 8.311 8.345 -0.034 26021 5901 1 9 . 1 1 116 116 LYS N N 116 119.582 119.582 117.249 2.333 26021 5902 1 9 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.257 -0.162 26021 5903 1 9 . 1 1 116 116 LYS C C 116 177.077 177.077 178.978 -1.901 26021 5904 1 9 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.649 0.062 26021 5905 1 9 . 1 1 116 116 LYS CB C 116 33.488 33.488 32.950 0.538 26021 5906 1 9 . 1 1 116 116 LYS H H 116 7.639 7.639 7.773 -0.134 26021 5907 1 9 . 1 1 117 117 HIS N N 117 115.246 115.246 116.261 -1.015 26021 5908 1 9 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.425 0.200 26021 5909 1 9 . 1 1 117 117 HIS C C 117 175.497 175.497 176.708 -1.211 26021 5910 1 9 . 1 1 117 117 HIS CA C 117 56.175 56.175 55.987 0.188 26021 5911 1 9 . 1 1 117 117 HIS CB C 117 30.475 30.475 29.753 0.722 26021 5912 1 9 . 1 1 117 117 HIS H H 117 8.108 8.108 7.453 0.655 26021 5913 1 9 . 1 1 118 118 GLY N N 118 109.944 109.944 108.043 1.901 26021 5914 1 9 . 1 1 118 118 GLY C C 118 174.093 174.093 174.588 -0.495 26021 5915 1 9 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.707 0.357 26021 5916 1 9 . 1 1 118 118 GLY H H 118 8.153 8.153 7.966 0.187 26021 5917 1 9 . 1 1 119 119 ILE N N 119 118.468 118.468 122.224 -3.756 26021 5918 1 9 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.953 0.169 26021 5919 1 9 . 1 1 119 119 ILE C C 119 174.777 174.777 175.639 -0.862 26021 5920 1 9 . 1 1 119 119 ILE CA C 119 61.101 61.101 60.626 0.475 26021 5921 1 9 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.096 2.535 26021 5922 1 9 . 1 1 119 119 ILE H H 119 7.828 7.828 7.410 0.418 26021 5923 1 10 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.562 0.187 26021 5924 1 10 . 1 1 4 4 ASN C C 4 175.260 175.260 176.327 -1.067 26021 5925 1 10 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.422 -0.591 26021 5926 1 10 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.676 0.005 26021 5927 1 10 . 1 1 5 5 ALA N N 5 123.648 123.648 120.901 2.747 26021 5928 1 10 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.642 -0.352 26021 5929 1 10 . 1 1 5 5 ALA C C 5 178.256 178.256 178.545 -0.289 26021 5930 1 10 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.892 1.189 26021 5931 1 10 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.433 0.591 26021 5932 1 10 . 1 1 5 5 ALA H H 5 8.520 8.520 8.286 0.234 26021 5933 1 10 . 1 1 6 6 GLY N N 6 107.044 107.044 107.490 -0.446 26021 5934 1 10 . 1 1 6 6 GLY C C 6 174.961 174.961 175.370 -0.409 26021 5935 1 10 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.598 -0.768 26021 5936 1 10 . 1 1 6 6 GLY H H 6 8.350 8.350 7.596 0.754 26021 5937 1 10 . 1 1 7 7 ALA N N 7 123.366 123.366 124.127 -0.761 26021 5938 1 10 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.147 0.069 26021 5939 1 10 . 1 1 7 7 ALA C C 7 179.006 179.006 178.767 0.239 26021 5940 1 10 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.593 -0.890 26021 5941 1 10 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.415 0.429 26021 5942 1 10 . 1 1 7 7 ALA H H 7 8.078 8.078 7.997 0.081 26021 5943 1 10 . 1 1 8 8 ILE N N 8 117.376 117.376 118.375 -0.999 26021 5944 1 10 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.761 0.019 26021 5945 1 10 . 1 1 8 8 ILE C C 8 177.032 177.032 178.294 -1.262 26021 5946 1 10 . 1 1 8 8 ILE CA C 8 63.158 63.158 63.918 -0.760 26021 5947 1 10 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.984 -1.695 26021 5948 1 10 . 1 1 8 8 ILE H H 8 7.943 7.943 7.389 0.554 26021 5949 1 10 . 1 1 9 9 ALA N N 9 121.414 121.414 122.415 -1.001 26021 5950 1 10 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.222 -0.289 26021 5951 1 10 . 1 1 9 9 ALA C C 9 180.515 180.515 179.155 1.360 26021 5952 1 10 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.684 0.414 26021 5953 1 10 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.137 0.023 26021 5954 1 10 . 1 1 9 9 ALA H H 9 8.062 8.062 7.871 0.191 26021 5955 1 10 . 1 1 10 10 LYS N N 10 114.594 114.594 118.832 -4.238 26021 5956 1 10 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.109 0.055 26021 5957 1 10 . 1 1 10 10 LYS C C 10 178.099 178.099 177.808 0.291 26021 5958 1 10 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.343 -0.503 26021 5959 1 10 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.313 0.156 26021 5960 1 10 . 1 1 10 10 LYS H H 10 7.554 7.554 7.708 -0.154 26021 5961 1 10 . 1 1 11 11 LEU N N 11 119.662 119.662 117.978 1.684 26021 5962 1 10 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.152 -0.074 26021 5963 1 10 . 1 1 11 11 LEU C C 11 177.930 177.930 178.088 -0.158 26021 5964 1 10 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.009 0.547 26021 5965 1 10 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.874 1.214 26021 5966 1 10 . 1 1 11 11 LEU H H 11 7.814 7.814 7.340 0.474 26021 5967 1 10 . 1 1 12 12 ILE N N 12 117.945 117.945 120.564 -2.619 26021 5968 1 10 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.934 -0.242 26021 5969 1 10 . 1 1 12 12 ILE CA C 12 67.629 67.629 65.999 1.630 26021 5970 1 10 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.736 1.674 26021 5971 1 10 . 1 1 12 12 ILE H H 12 7.426 7.426 7.517 -0.091 26021 5972 1 10 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.300 0.103 26021 5973 1 10 . 1 1 13 13 PRO C C 13 179.030 179.030 178.802 0.228 26021 5974 1 10 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.134 0.110 26021 5975 1 10 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.024 -0.215 26021 5976 1 10 . 1 1 14 14 LYS N N 14 117.855 117.855 118.603 -0.748 26021 5977 1 10 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.099 0.046 26021 5978 1 10 . 1 1 14 14 LYS C C 14 178.565 178.565 178.280 0.285 26021 5979 1 10 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.307 0.126 26021 5980 1 10 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.135 0.790 26021 5981 1 10 . 1 1 14 14 LYS H H 14 6.685 6.685 7.476 -0.791 26021 5982 1 10 . 1 1 15 15 LEU N N 15 118.008 118.008 118.337 -0.329 26021 5983 1 10 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.280 -0.277 26021 5984 1 10 . 1 1 15 15 LEU C C 15 178.662 178.662 178.936 -0.274 26021 5985 1 10 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.967 0.745 26021 5986 1 10 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.359 -0.360 26021 5987 1 10 . 1 1 15 15 LEU H H 15 8.148 8.148 7.529 0.619 26021 5988 1 10 . 1 1 16 16 GLY N N 16 103.895 103.895 107.204 -3.309 26021 5989 1 10 . 1 1 16 16 GLY C C 16 176.838 176.838 176.634 0.204 26021 5990 1 10 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.189 0.176 26021 5991 1 10 . 1 1 16 16 GLY H H 16 8.104 8.104 8.012 0.092 26021 5992 1 10 . 1 1 17 17 GLU N N 17 121.655 121.655 122.434 -0.779 26021 5993 1 10 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.167 -0.034 26021 5994 1 10 . 1 1 17 17 GLU C C 17 179.007 179.007 178.196 0.811 26021 5995 1 10 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.600 0.211 26021 5996 1 10 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.451 -0.318 26021 5997 1 10 . 1 1 17 17 GLU H H 17 7.817 7.817 7.659 0.158 26021 5998 1 10 . 1 1 18 18 LEU N N 18 117.834 117.834 116.838 0.996 26021 5999 1 10 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.338 -0.220 26021 6000 1 10 . 1 1 18 18 LEU C C 18 177.658 177.658 177.368 0.290 26021 6001 1 10 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.067 1.962 26021 6002 1 10 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.304 0.366 26021 6003 1 10 . 1 1 18 18 LEU H H 18 7.389 7.389 7.988 -0.599 26021 6004 1 10 . 1 1 19 19 LEU N N 19 113.694 113.694 116.914 -3.220 26021 6005 1 10 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.432 -0.270 26021 6006 1 10 . 1 1 19 19 LEU C C 19 178.123 178.123 177.814 0.309 26021 6007 1 10 . 1 1 19 19 LEU CA C 19 55.852 55.852 54.709 1.143 26021 6008 1 10 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.279 -0.059 26021 6009 1 10 . 1 1 19 19 LEU H H 19 7.269 7.269 7.670 -0.401 26021 6010 1 10 . 1 1 20 20 VAL N N 20 112.778 112.778 115.128 -2.350 26021 6011 1 10 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.149 0.294 26021 6012 1 10 . 1 1 20 20 VAL C C 20 177.021 177.021 177.032 -0.011 26021 6013 1 10 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.669 -1.814 26021 6014 1 10 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.372 0.406 26021 6015 1 10 . 1 1 20 20 VAL H H 20 7.356 7.356 7.358 -0.002 26021 6016 1 10 . 1 1 21 21 GLY N N 21 108.962 108.962 107.795 1.167 26021 6017 1 10 . 1 1 21 21 GLY C C 21 173.813 173.813 174.351 -0.538 26021 6018 1 10 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.691 0.355 26021 6019 1 10 . 1 1 21 21 GLY H H 21 7.925 7.925 8.408 -0.483 26021 6020 1 10 . 1 1 22 22 GLU N N 22 120.607 120.607 122.875 -2.268 26021 6021 1 10 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.620 -0.342 26021 6022 1 10 . 1 1 22 22 GLU C C 22 175.869 175.869 175.430 0.439 26021 6023 1 10 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.532 0.498 26021 6024 1 10 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.379 -0.698 26021 6025 1 10 . 1 1 22 22 GLU H H 22 8.300 8.300 8.681 -0.381 26021 6026 1 10 . 1 1 23 23 TYR N N 23 120.738 120.738 119.121 1.617 26021 6027 1 10 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.979 -0.422 26021 6028 1 10 . 1 1 23 23 TYR C C 23 175.264 175.264 174.291 0.973 26021 6029 1 10 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.150 0.411 26021 6030 1 10 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.240 0.006 26021 6031 1 10 . 1 1 23 23 TYR H H 23 7.756 7.756 7.448 0.308 26021 6032 1 10 . 1 1 24 24 LYS N N 24 122.095 122.095 121.797 0.298 26021 6033 1 10 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.492 -0.309 26021 6034 1 10 . 1 1 24 24 LYS C C 24 175.742 175.742 174.865 0.877 26021 6035 1 10 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.598 0.520 26021 6036 1 10 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.901 -0.182 26021 6037 1 10 . 1 1 24 24 LYS H H 24 8.692 8.692 8.483 0.209 26021 6038 1 10 . 1 1 25 25 LEU N N 25 121.123 121.123 120.170 0.953 26021 6039 1 10 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.512 -0.020 26021 6040 1 10 . 1 1 25 25 LEU C C 25 177.487 177.487 176.130 1.357 26021 6041 1 10 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.578 0.756 26021 6042 1 10 . 1 1 25 25 LEU CB C 25 43.758 43.758 45.103 -1.345 26021 6043 1 10 . 1 1 25 25 LEU H H 25 8.088 8.088 7.794 0.294 26021 6044 1 10 . 1 1 26 26 HIS N N 26 122.993 122.993 119.148 3.845 26021 6045 1 10 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.791 -0.290 26021 6046 1 10 . 1 1 26 26 HIS C C 26 176.716 176.716 176.475 0.241 26021 6047 1 10 . 1 1 26 26 HIS CA C 26 57.197 57.197 54.483 2.714 26021 6048 1 10 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.806 0.551 26021 6049 1 10 . 1 1 26 26 HIS H H 26 8.882 8.882 8.336 0.546 26021 6050 1 10 . 1 1 27 27 LYS N N 27 124.894 124.894 120.663 4.231 26021 6051 1 10 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.269 -0.321 26021 6052 1 10 . 1 1 27 27 LYS C C 27 178.873 178.873 178.418 0.455 26021 6053 1 10 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.677 1.334 26021 6054 1 10 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.411 0.031 26021 6055 1 10 . 1 1 27 27 LYS H H 27 8.699 8.699 8.558 0.141 26021 6056 1 10 . 1 1 28 28 GLY N N 28 111.258 111.258 104.732 6.526 26021 6057 1 10 . 1 1 28 28 GLY C C 28 176.131 176.131 175.098 1.033 26021 6058 1 10 . 1 1 28 28 GLY CA C 28 46.490 46.490 45.716 0.774 26021 6059 1 10 . 1 1 28 28 GLY H H 28 9.814 9.814 8.338 1.476 26021 6060 1 10 . 1 1 29 29 VAL N N 29 122.719 122.719 121.223 1.496 26021 6061 1 10 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.848 0.044 26021 6062 1 10 . 1 1 29 29 VAL C C 29 177.628 177.628 177.747 -0.119 26021 6063 1 10 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.431 0.089 26021 6064 1 10 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.880 -0.138 26021 6065 1 10 . 1 1 29 29 VAL H H 29 7.431 7.431 7.590 -0.159 26021 6066 1 10 . 1 1 30 30 LYS N N 30 119.791 119.791 119.652 0.139 26021 6067 1 10 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.785 -0.150 26021 6068 1 10 . 1 1 30 30 LYS C C 30 177.666 177.666 177.638 0.028 26021 6069 1 10 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.509 1.515 26021 6070 1 10 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.617 0.788 26021 6071 1 10 . 1 1 30 30 LYS H H 30 8.255 8.255 7.782 0.473 26021 6072 1 10 . 1 1 31 31 LYS N N 31 117.918 117.918 118.658 -0.740 26021 6073 1 10 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.122 -0.006 26021 6074 1 10 . 1 1 31 31 LYS C C 31 177.784 177.784 178.160 -0.376 26021 6075 1 10 . 1 1 31 31 LYS CA C 31 58.703 58.703 58.904 -0.201 26021 6076 1 10 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.573 0.272 26021 6077 1 10 . 1 1 31 31 LYS H H 31 7.689 7.689 8.036 -0.347 26021 6078 1 10 . 1 1 32 32 ASN N N 32 116.347 116.347 118.055 -1.708 26021 6079 1 10 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.456 0.064 26021 6080 1 10 . 1 1 32 32 ASN C C 32 177.764 177.764 177.445 0.319 26021 6081 1 10 . 1 1 32 32 ASN CA C 32 56.315 56.315 56.055 0.260 26021 6082 1 10 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.876 -0.244 26021 6083 1 10 . 1 1 32 32 ASN H H 32 7.556 7.556 7.978 -0.422 26021 6084 1 10 . 1 1 33 33 ILE N N 33 120.592 120.592 120.682 -0.090 26021 6085 1 10 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.696 -0.414 26021 6086 1 10 . 1 1 33 33 ILE C C 33 177.074 177.074 177.409 -0.335 26021 6087 1 10 . 1 1 33 33 ILE CA C 33 65.888 65.888 64.570 1.318 26021 6088 1 10 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.900 -0.722 26021 6089 1 10 . 1 1 33 33 ILE H H 33 8.236 8.236 7.700 0.536 26021 6090 1 10 . 1 1 34 34 GLU N N 34 120.595 120.595 119.302 1.293 26021 6091 1 10 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.861 -0.073 26021 6092 1 10 . 1 1 34 34 GLU C C 34 179.739 179.739 178.964 0.775 26021 6093 1 10 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.622 0.617 26021 6094 1 10 . 1 1 34 34 GLU CB C 34 29.845 29.845 29.006 0.839 26021 6095 1 10 . 1 1 34 34 GLU H H 34 8.551 8.551 8.284 0.267 26021 6096 1 10 . 1 1 35 35 ASP N N 35 120.600 120.600 120.830 -0.230 26021 6097 1 10 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.484 -0.072 26021 6098 1 10 . 1 1 35 35 ASP C C 35 178.681 178.681 178.286 0.395 26021 6099 1 10 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.796 0.666 26021 6100 1 10 . 1 1 35 35 ASP CB C 35 39.750 39.750 41.125 -1.375 26021 6101 1 10 . 1 1 35 35 ASP H H 35 8.670 8.670 7.696 0.974 26021 6102 1 10 . 1 1 36 36 LEU N N 36 123.004 123.004 121.021 1.983 26021 6103 1 10 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.221 -0.126 26021 6104 1 10 . 1 1 36 36 LEU C C 36 178.035 178.035 178.982 -0.947 26021 6105 1 10 . 1 1 36 36 LEU CA C 36 58.028 58.028 58.144 -0.116 26021 6106 1 10 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.061 -0.185 26021 6107 1 10 . 1 1 36 36 LEU H H 36 8.166 8.166 7.989 0.177 26021 6108 1 10 . 1 1 37 37 LEU N N 37 120.178 120.178 119.260 0.918 26021 6109 1 10 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.029 -0.173 26021 6110 1 10 . 1 1 37 37 LEU C C 37 178.128 178.128 178.124 0.004 26021 6111 1 10 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.232 0.443 26021 6112 1 10 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.481 0.674 26021 6113 1 10 . 1 1 37 37 LEU H H 37 8.736 8.736 8.364 0.372 26021 6114 1 10 . 1 1 38 38 LYS N N 38 118.110 118.110 119.291 -1.181 26021 6115 1 10 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.960 -0.027 26021 6116 1 10 . 1 1 38 38 LYS C C 38 179.533 179.533 178.636 0.897 26021 6117 1 10 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.664 0.609 26021 6118 1 10 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.231 0.046 26021 6119 1 10 . 1 1 38 38 LYS H H 38 7.770 7.770 7.443 0.327 26021 6120 1 10 . 1 1 39 39 GLU N N 39 119.265 119.265 118.694 0.571 26021 6121 1 10 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.140 0.162 26021 6122 1 10 . 1 1 39 39 GLU C C 39 179.720 179.720 179.315 0.405 26021 6123 1 10 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.870 -0.112 26021 6124 1 10 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.114 0.476 26021 6125 1 10 . 1 1 39 39 GLU H H 39 7.709 7.709 8.025 -0.316 26021 6126 1 10 . 1 1 40 40 LEU N N 40 119.007 119.007 120.701 -1.694 26021 6127 1 10 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.158 -0.108 26021 6128 1 10 . 1 1 40 40 LEU C C 40 179.690 179.690 178.766 0.924 26021 6129 1 10 . 1 1 40 40 LEU CA C 40 57.651 57.651 56.726 0.925 26021 6130 1 10 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.242 0.443 26021 6131 1 10 . 1 1 40 40 LEU H H 40 8.851 8.851 7.980 0.871 26021 6132 1 10 . 1 1 41 41 LYS N N 41 120.500 120.500 119.278 1.222 26021 6133 1 10 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.019 -0.067 26021 6134 1 10 . 1 1 41 41 LYS C C 41 180.223 180.223 179.206 1.017 26021 6135 1 10 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.607 1.284 26021 6136 1 10 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.129 -0.062 26021 6137 1 10 . 1 1 41 41 LYS H H 41 8.482 8.482 8.303 0.179 26021 6138 1 10 . 1 1 42 42 THR N N 42 119.555 119.555 112.267 7.288 26021 6139 1 10 . 1 1 42 42 THR HA H 42 4.000 4.000 4.180 -0.180 26021 6140 1 10 . 1 1 42 42 THR C C 42 176.633 176.633 176.625 0.008 26021 6141 1 10 . 1 1 42 42 THR CA C 42 66.574 66.574 65.452 1.122 26021 6142 1 10 . 1 1 42 42 THR CB C 42 67.924 67.924 68.834 -0.909 26021 6143 1 10 . 1 1 42 42 THR H H 42 7.863 7.863 7.562 0.301 26021 6144 1 10 . 1 1 43 43 MET N N 43 122.839 122.839 121.508 1.331 26021 6145 1 10 . 1 1 43 43 MET HA H 43 4.022 4.022 4.148 -0.126 26021 6146 1 10 . 1 1 43 43 MET C C 43 177.290 177.290 178.495 -1.205 26021 6147 1 10 . 1 1 43 43 MET CA C 43 59.731 59.731 58.562 1.169 26021 6148 1 10 . 1 1 43 43 MET CB C 43 33.610 33.610 31.437 2.173 26021 6149 1 10 . 1 1 43 43 MET H H 43 8.714 8.714 7.562 1.152 26021 6150 1 10 . 1 1 44 44 ASN N N 44 118.049 118.049 118.037 0.012 26021 6151 1 10 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.320 0.054 26021 6152 1 10 . 1 1 44 44 ASN C C 44 176.297 176.297 177.452 -1.155 26021 6153 1 10 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.564 0.330 26021 6154 1 10 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.468 0.938 26021 6155 1 10 . 1 1 44 44 ASN H H 44 8.988 8.988 8.546 0.442 26021 6156 1 10 . 1 1 45 45 ALA N N 45 119.260 119.260 121.089 -1.829 26021 6157 1 10 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.210 -0.144 26021 6158 1 10 . 1 1 45 45 ALA C C 45 180.476 180.476 179.225 1.251 26021 6159 1 10 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.385 0.883 26021 6160 1 10 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.228 -0.540 26021 6161 1 10 . 1 1 45 45 ALA H H 45 7.675 7.675 7.448 0.227 26021 6162 1 10 . 1 1 46 46 ALA N N 46 121.126 121.126 123.241 -2.115 26021 6163 1 10 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.033 0.083 26021 6164 1 10 . 1 1 46 46 ALA C C 46 179.314 179.314 179.230 0.084 26021 6165 1 10 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.371 -0.385 26021 6166 1 10 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.603 -0.381 26021 6167 1 10 . 1 1 46 46 ALA H H 46 7.872 7.872 7.825 0.047 26021 6168 1 10 . 1 1 47 47 LEU N N 47 119.328 119.328 116.388 2.940 26021 6169 1 10 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.098 0.093 26021 6170 1 10 . 1 1 47 47 LEU C C 47 180.403 180.403 178.535 1.868 26021 6171 1 10 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.069 -0.023 26021 6172 1 10 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.386 0.563 26021 6173 1 10 . 1 1 47 47 LEU H H 47 8.529 8.529 7.785 0.744 26021 6174 1 10 . 1 1 48 48 ILE N N 48 121.653 121.653 118.895 2.758 26021 6175 1 10 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.660 0.042 26021 6176 1 10 . 1 1 48 48 ILE C C 48 178.730 178.730 178.205 0.525 26021 6177 1 10 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.621 0.289 26021 6178 1 10 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.641 0.271 26021 6179 1 10 . 1 1 48 48 ILE H H 48 8.386 8.386 7.205 1.181 26021 6180 1 10 . 1 1 49 49 LYS N N 49 119.896 119.896 119.007 0.889 26021 6181 1 10 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.022 0.021 26021 6182 1 10 . 1 1 49 49 LYS C C 49 179.999 179.999 179.631 0.368 26021 6183 1 10 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.243 -0.186 26021 6184 1 10 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.208 -0.247 26021 6185 1 10 . 1 1 49 49 LYS H H 49 7.456 7.456 7.558 -0.102 26021 6186 1 10 . 1 1 50 50 ILE N N 50 119.964 119.964 116.001 3.963 26021 6187 1 10 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.261 -0.525 26021 6188 1 10 . 1 1 50 50 ILE C C 50 177.960 177.960 177.979 -0.019 26021 6189 1 10 . 1 1 50 50 ILE CA C 50 64.349 64.349 64.237 0.112 26021 6190 1 10 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.655 0.477 26021 6191 1 10 . 1 1 50 50 ILE H H 50 8.154 8.154 8.777 -0.623 26021 6192 1 10 . 1 1 51 51 GLY N N 51 106.709 106.709 107.742 -1.033 26021 6193 1 10 . 1 1 51 51 GLY C C 51 174.461 174.461 175.000 -0.539 26021 6194 1 10 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.275 -0.366 26021 6195 1 10 . 1 1 51 51 GLY H H 51 7.932 7.932 7.819 0.113 26021 6196 1 10 . 1 1 52 52 GLU N N 52 118.736 118.736 119.301 -0.565 26021 6197 1 10 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.200 0.120 26021 6198 1 10 . 1 1 52 52 GLU C C 52 176.789 176.789 177.032 -0.243 26021 6199 1 10 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.347 -1.073 26021 6200 1 10 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.165 -0.053 26021 6201 1 10 . 1 1 52 52 GLU H H 52 7.597 7.597 7.559 0.038 26021 6202 1 10 . 1 1 53 53 VAL N N 53 122.982 122.982 118.481 4.501 26021 6203 1 10 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.435 -0.174 26021 6204 1 10 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.100 1.285 26021 6205 1 10 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.017 1.805 26021 6206 1 10 . 1 1 53 53 VAL H H 53 7.511 7.511 7.569 -0.058 26021 6207 1 10 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.810 -0.165 26021 6208 1 10 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.604 -0.026 26021 6209 1 10 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.052 0.482 26021 6210 1 10 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.326 -0.135 26021 6211 1 10 . 1 1 55 55 PRO C C 55 178.258 178.258 177.641 0.617 26021 6212 1 10 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.861 0.567 26021 6213 1 10 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.807 0.039 26021 6214 1 10 . 1 1 56 56 ASP N N 56 114.117 114.117 118.305 -4.188 26021 6215 1 10 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.450 0.041 26021 6216 1 10 . 1 1 56 56 ASP C C 56 176.696 176.696 176.777 -0.081 26021 6217 1 10 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.685 -0.547 26021 6218 1 10 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.571 -0.845 26021 6219 1 10 . 1 1 56 56 ASP H H 56 8.489 8.489 8.374 0.115 26021 6220 1 10 . 1 1 57 57 GLN N N 57 117.641 117.641 117.041 0.600 26021 6221 1 10 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.381 -0.007 26021 6222 1 10 . 1 1 57 57 GLN C C 57 175.765 175.765 175.809 -0.044 26021 6223 1 10 . 1 1 57 57 GLN CA C 57 55.290 55.290 54.834 0.456 26021 6224 1 10 . 1 1 57 57 GLN CB C 57 29.646 29.646 28.481 1.165 26021 6225 1 10 . 1 1 57 57 GLN H H 57 8.206 8.206 7.750 0.456 26021 6226 1 10 . 1 1 58 58 LEU N N 58 122.141 122.141 117.774 4.367 26021 6227 1 10 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.566 -0.116 26021 6228 1 10 . 1 1 58 58 LEU C C 58 176.849 176.849 175.631 1.218 26021 6229 1 10 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.471 0.523 26021 6230 1 10 . 1 1 58 58 LEU CB C 58 43.231 43.231 43.843 -0.612 26021 6231 1 10 . 1 1 58 58 LEU H H 58 7.152 7.152 7.177 -0.025 26021 6232 1 10 . 1 1 59 59 ASP N N 59 125.643 125.643 121.432 4.211 26021 6233 1 10 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.949 -0.230 26021 6234 1 10 . 1 1 59 59 ASP C C 59 177.249 177.249 177.022 0.227 26021 6235 1 10 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.804 0.599 26021 6236 1 10 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.427 -1.195 26021 6237 1 10 . 1 1 59 59 ASP H H 59 9.312 9.312 8.186 1.126 26021 6238 1 10 . 1 1 60 60 SER N N 60 116.550 116.550 114.775 1.775 26021 6239 1 10 . 1 1 60 60 SER HA H 60 4.124 4.124 4.140 -0.016 26021 6240 1 10 . 1 1 60 60 SER C C 60 176.840 176.840 176.643 0.197 26021 6241 1 10 . 1 1 60 60 SER CA C 60 61.722 61.722 61.526 0.196 26021 6242 1 10 . 1 1 60 60 SER CB C 60 62.815 62.815 63.297 -0.482 26021 6243 1 10 . 1 1 60 60 SER H H 60 8.647 8.647 8.462 0.185 26021 6244 1 10 . 1 1 61 61 GLN N N 61 121.394 121.394 119.031 2.363 26021 6245 1 10 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.159 -0.028 26021 6246 1 10 . 1 1 61 61 GLN C C 61 178.629 178.629 177.965 0.664 26021 6247 1 10 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.823 -0.070 26021 6248 1 10 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.551 -0.298 26021 6249 1 10 . 1 1 61 61 GLN H H 61 8.453 8.453 8.369 0.084 26021 6250 1 10 . 1 1 62 62 ASP N N 62 122.187 122.187 120.146 2.041 26021 6251 1 10 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.439 0.180 26021 6252 1 10 . 1 1 62 62 ASP C C 62 178.318 178.318 178.399 -0.081 26021 6253 1 10 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.316 0.146 26021 6254 1 10 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.623 0.413 26021 6255 1 10 . 1 1 62 62 ASP H H 62 8.311 8.311 7.640 0.671 26021 6256 1 10 . 1 1 63 63 LYS N N 63 120.325 120.325 118.213 2.112 26021 6257 1 10 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.109 -0.100 26021 6258 1 10 . 1 1 63 63 LYS C C 63 178.765 178.765 179.354 -0.589 26021 6259 1 10 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.738 1.015 26021 6260 1 10 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.104 0.349 26021 6261 1 10 . 1 1 63 63 LYS H H 63 7.923 7.923 7.742 0.181 26021 6262 1 10 . 1 1 64 64 LEU N N 64 119.491 119.491 118.592 0.899 26021 6263 1 10 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.255 -0.029 26021 6264 1 10 . 1 1 64 64 LEU C C 64 179.526 179.526 178.760 0.766 26021 6265 1 10 . 1 1 64 64 LEU CA C 64 57.798 57.798 56.959 0.839 26021 6266 1 10 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.091 0.684 26021 6267 1 10 . 1 1 64 64 LEU H H 64 7.820 7.820 7.792 0.028 26021 6268 1 10 . 1 1 65 65 TRP N N 65 120.674 120.674 122.582 -1.908 26021 6269 1 10 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.253 0.055 26021 6270 1 10 . 1 1 65 65 TRP C C 65 177.379 177.379 177.722 -0.343 26021 6271 1 10 . 1 1 65 65 TRP CA C 65 61.802 61.802 61.566 0.236 26021 6272 1 10 . 1 1 65 65 TRP CB C 65 28.411 28.411 29.100 -0.689 26021 6273 1 10 . 1 1 65 65 TRP H H 65 8.196 8.196 7.891 0.305 26021 6274 1 10 . 1 1 66 66 ALA N N 66 120.606 120.606 119.819 0.787 26021 6275 1 10 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.476 0.233 26021 6276 1 10 . 1 1 66 66 ALA C C 66 180.376 180.376 179.405 0.971 26021 6277 1 10 . 1 1 66 66 ALA CA C 66 55.564 55.564 55.012 0.552 26021 6278 1 10 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.912 -0.258 26021 6279 1 10 . 1 1 66 66 ALA H H 66 8.305 8.305 7.980 0.325 26021 6280 1 10 . 1 1 67 67 ASP N N 67 119.175 119.175 118.060 1.115 26021 6281 1 10 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.368 0.082 26021 6282 1 10 . 1 1 67 67 ASP C C 67 178.757 178.757 178.124 0.633 26021 6283 1 10 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.656 0.836 26021 6284 1 10 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.806 -0.652 26021 6285 1 10 . 1 1 67 67 ASP H H 67 7.945 7.945 7.639 0.306 26021 6286 1 10 . 1 1 68 68 GLU N N 68 122.322 122.322 119.397 2.925 26021 6287 1 10 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.286 -0.271 26021 6288 1 10 . 1 1 68 68 GLU C C 68 180.055 180.055 179.236 0.819 26021 6289 1 10 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.257 0.854 26021 6290 1 10 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.407 0.240 26021 6291 1 10 . 1 1 68 68 GLU H H 68 8.168 8.168 7.750 0.418 26021 6292 1 10 . 1 1 69 69 VAL N N 69 122.135 122.135 118.683 3.452 26021 6293 1 10 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.651 -0.399 26021 6294 1 10 . 1 1 69 69 VAL C C 69 177.736 177.736 177.851 -0.115 26021 6295 1 10 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.847 0.693 26021 6296 1 10 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.219 0.023 26021 6297 1 10 . 1 1 69 69 VAL H H 69 8.424 8.424 7.456 0.968 26021 6298 1 10 . 1 1 70 70 ARG N N 70 121.373 121.373 119.186 2.187 26021 6299 1 10 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.052 -0.360 26021 6300 1 10 . 1 1 70 70 ARG C C 70 179.117 179.117 178.827 0.290 26021 6301 1 10 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.700 1.465 26021 6302 1 10 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.971 -0.317 26021 6303 1 10 . 1 1 70 70 ARG H H 70 7.916 7.916 7.297 0.619 26021 6304 1 10 . 1 1 71 71 GLU N N 71 119.075 119.075 119.839 -0.764 26021 6305 1 10 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.091 -0.028 26021 6306 1 10 . 1 1 71 71 GLU C C 71 179.119 179.119 179.077 0.042 26021 6307 1 10 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.113 0.574 26021 6308 1 10 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.711 0.559 26021 6309 1 10 . 1 1 71 71 GLU H H 71 8.031 8.031 8.676 -0.645 26021 6310 1 10 . 1 1 72 72 LEU N N 72 120.503 120.503 120.981 -0.478 26021 6311 1 10 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.074 -0.017 26021 6312 1 10 . 1 1 72 72 LEU C C 72 178.734 178.734 178.597 0.137 26021 6313 1 10 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.913 0.509 26021 6314 1 10 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.823 -0.415 26021 6315 1 10 . 1 1 72 72 LEU H H 72 8.175 8.175 7.663 0.512 26021 6316 1 10 . 1 1 73 73 SER N N 73 115.243 115.243 115.844 -0.601 26021 6317 1 10 . 1 1 73 73 SER HA H 73 3.824 3.824 4.014 -0.190 26021 6318 1 10 . 1 1 73 73 SER C C 73 175.697 175.697 176.370 -0.673 26021 6319 1 10 . 1 1 73 73 SER CA C 73 62.384 62.384 61.363 1.021 26021 6320 1 10 . 1 1 73 73 SER CB C 73 62.093 62.093 62.864 -0.771 26021 6321 1 10 . 1 1 73 73 SER H H 73 8.411 8.411 8.298 0.113 26021 6322 1 10 . 1 1 74 74 TYR N N 74 121.342 121.342 122.201 -0.859 26021 6323 1 10 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.174 0.317 26021 6324 1 10 . 1 1 74 74 TYR C C 74 178.747 178.747 177.569 1.178 26021 6325 1 10 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.928 -0.493 26021 6326 1 10 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.439 -0.932 26021 6327 1 10 . 1 1 74 74 TYR H H 74 7.314 7.314 7.792 -0.478 26021 6328 1 10 . 1 1 75 75 VAL N N 75 120.779 120.779 118.371 2.408 26021 6329 1 10 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.759 0.102 26021 6330 1 10 . 1 1 75 75 VAL C C 75 179.788 179.788 178.194 1.594 26021 6331 1 10 . 1 1 75 75 VAL CA C 75 66.048 66.048 66.326 -0.278 26021 6332 1 10 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.772 -0.058 26021 6333 1 10 . 1 1 75 75 VAL H H 75 7.740 7.740 7.763 -0.023 26021 6334 1 10 . 1 1 76 76 ILE N N 76 120.598 120.598 119.984 0.614 26021 6335 1 10 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.647 0.053 26021 6336 1 10 . 1 1 76 76 ILE C C 76 177.066 177.066 177.980 -0.914 26021 6337 1 10 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.694 1.226 26021 6338 1 10 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.238 0.147 26021 6339 1 10 . 1 1 76 76 ILE H H 76 8.584 8.584 7.258 1.326 26021 6340 1 10 . 1 1 77 77 GLU N N 77 120.468 120.468 119.818 0.650 26021 6341 1 10 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.935 -0.286 26021 6342 1 10 . 1 1 77 77 GLU C C 77 177.502 177.502 178.774 -1.272 26021 6343 1 10 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.823 1.039 26021 6344 1 10 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.687 0.665 26021 6345 1 10 . 1 1 77 77 GLU H H 77 8.445 8.445 7.881 0.564 26021 6346 1 10 . 1 1 78 78 ASP N N 78 117.382 117.382 119.953 -2.571 26021 6347 1 10 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.451 -0.060 26021 6348 1 10 . 1 1 78 78 ASP C C 78 177.382 177.382 178.136 -0.754 26021 6349 1 10 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.911 0.584 26021 6350 1 10 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.077 1.858 26021 6351 1 10 . 1 1 78 78 ASP H H 78 7.885 7.885 7.746 0.139 26021 6352 1 10 . 1 1 79 79 ALA N N 79 120.171 120.171 121.935 -1.764 26021 6353 1 10 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.017 0.033 26021 6354 1 10 . 1 1 79 79 ALA C C 79 181.193 181.193 179.428 1.765 26021 6355 1 10 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.304 -0.249 26021 6356 1 10 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.628 -0.208 26021 6357 1 10 . 1 1 79 79 ALA H H 79 7.754 7.754 7.975 -0.221 26021 6358 1 10 . 1 1 80 80 VAL N N 80 119.541 119.541 112.054 7.487 26021 6359 1 10 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.867 -0.190 26021 6360 1 10 . 1 1 80 80 VAL C C 80 177.096 177.096 177.703 -0.607 26021 6361 1 10 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.698 2.386 26021 6362 1 10 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.977 -0.534 26021 6363 1 10 . 1 1 80 80 VAL H H 80 8.635 8.635 7.332 1.303 26021 6364 1 10 . 1 1 81 81 ASP N N 81 121.140 121.140 121.663 -0.523 26021 6365 1 10 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.467 0.002 26021 6366 1 10 . 1 1 81 81 ASP C C 81 179.569 179.569 178.130 1.439 26021 6367 1 10 . 1 1 81 81 ASP CA C 81 57.929 57.929 56.913 1.016 26021 6368 1 10 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.761 -0.826 26021 6369 1 10 . 1 1 81 81 ASP H H 81 8.575 8.575 8.602 -0.027 26021 6370 1 10 . 1 1 82 82 LYS N N 82 118.159 118.159 119.007 -0.848 26021 6371 1 10 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.045 -0.024 26021 6372 1 10 . 1 1 82 82 LYS C C 82 178.890 178.890 178.301 0.589 26021 6373 1 10 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.787 0.280 26021 6374 1 10 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.343 0.245 26021 6375 1 10 . 1 1 82 82 LYS H H 82 8.079 8.079 8.011 0.068 26021 6376 1 10 . 1 1 83 83 PHE N N 83 120.900 120.900 120.496 0.404 26021 6377 1 10 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.146 0.130 26021 6378 1 10 . 1 1 83 83 PHE C C 83 177.269 177.269 176.513 0.756 26021 6379 1 10 . 1 1 83 83 PHE CA C 83 60.943 60.943 61.987 -1.044 26021 6380 1 10 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.168 0.579 26021 6381 1 10 . 1 1 83 83 PHE H H 83 8.015 8.015 7.654 0.361 26021 6382 1 10 . 1 1 84 84 LEU N N 84 118.209 118.209 115.201 3.008 26021 6383 1 10 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.151 -0.209 26021 6384 1 10 . 1 1 84 84 LEU C C 84 178.774 178.774 177.876 0.898 26021 6385 1 10 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.149 0.021 26021 6386 1 10 . 1 1 84 84 LEU CB C 84 42.193 42.193 40.773 1.420 26021 6387 1 10 . 1 1 84 84 LEU H H 84 8.338 8.338 7.726 0.612 26021 6388 1 10 . 1 1 85 85 VAL N N 85 116.078 116.078 119.251 -3.173 26021 6389 1 10 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.662 0.329 26021 6390 1 10 . 1 1 85 85 VAL C C 85 177.252 177.252 177.014 0.238 26021 6391 1 10 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.591 -1.411 26021 6392 1 10 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.557 0.333 26021 6393 1 10 . 1 1 85 85 VAL H H 85 7.447 7.447 7.140 0.307 26021 6394 1 10 . 1 1 86 86 ARG N N 86 120.842 120.842 118.217 2.625 26021 6395 1 10 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.719 -0.492 26021 6396 1 10 . 1 1 86 86 ARG C C 86 177.520 177.520 179.258 -1.738 26021 6397 1 10 . 1 1 86 86 ARG CA C 86 57.059 57.059 56.622 0.437 26021 6398 1 10 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.348 -0.085 26021 6399 1 10 . 1 1 86 86 ARG H H 86 7.598 7.598 7.491 0.107 26021 6400 1 10 . 1 1 87 87 VAL N N 87 119.293 119.293 117.928 1.365 26021 6401 1 10 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.737 0.088 26021 6402 1 10 . 1 1 87 87 VAL C C 87 176.121 176.121 177.034 -0.913 26021 6403 1 10 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.366 -1.928 26021 6404 1 10 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.534 1.238 26021 6405 1 10 . 1 1 87 87 VAL H H 87 7.994 7.994 7.448 0.546 26021 6406 1 10 . 1 1 88 88 HIS N N 88 120.016 120.016 117.909 2.107 26021 6407 1 10 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.337 0.300 26021 6408 1 10 . 1 1 88 88 HIS C C 88 175.639 175.639 176.097 -0.458 26021 6409 1 10 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.298 0.053 26021 6410 1 10 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.400 -0.719 26021 6411 1 10 . 1 1 88 88 HIS H H 88 7.969 7.969 7.760 0.209 26021 6412 1 10 . 1 1 89 89 GLY N N 89 109.587 109.587 107.102 2.485 26021 6413 1 10 . 1 1 89 89 GLY C C 89 173.730 173.730 174.171 -0.441 26021 6414 1 10 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.110 0.059 26021 6415 1 10 . 1 1 89 89 GLY H H 89 8.083 8.083 8.350 -0.267 26021 6416 1 10 . 1 1 90 90 VAL N N 90 118.224 118.224 119.161 -0.937 26021 6417 1 10 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.615 -0.477 26021 6418 1 10 . 1 1 90 90 VAL C C 90 176.018 176.018 174.495 1.523 26021 6419 1 10 . 1 1 90 90 VAL CA C 90 62.425 62.425 59.696 2.729 26021 6420 1 10 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.508 -0.892 26021 6421 1 10 . 1 1 90 90 VAL H H 90 7.944 7.944 7.795 0.149 26021 6422 1 10 . 1 1 91 91 GLU N N 91 124.313 124.313 119.085 5.228 26021 6423 1 10 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.655 -0.049 26021 6424 1 10 . 1 1 91 91 GLU CA C 91 54.176 54.176 53.421 0.755 26021 6425 1 10 . 1 1 91 91 GLU CB C 91 29.760 29.760 30.159 -0.399 26021 6426 1 10 . 1 1 91 91 GLU H H 91 8.423 8.423 8.311 0.112 26021 6427 1 10 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.652 -0.315 26021 6428 1 10 . 1 1 92 92 PRO C C 92 176.504 176.504 175.659 0.845 26021 6429 1 10 . 1 1 92 92 PRO CA C 92 63.372 63.372 62.961 0.411 26021 6430 1 10 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.193 -0.026 26021 6431 1 10 . 1 1 93 93 ASP N N 93 120.275 120.275 117.330 2.945 26021 6432 1 10 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.747 -0.175 26021 6433 1 10 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.427 0.543 26021 6434 1 10 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.294 -1.778 26021 6435 1 10 . 1 1 93 93 ASP H H 93 8.286 8.286 8.197 0.089 26021 6436 1 10 . 1 1 94 94 ASP N N 94 121.181 121.181 119.697 1.484 26021 6437 1 10 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.711 -0.146 26021 6438 1 10 . 1 1 94 94 ASP C C 94 176.474 176.474 177.998 -1.524 26021 6439 1 10 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.241 -0.868 26021 6440 1 10 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.969 -0.745 26021 6441 1 10 . 1 1 94 94 ASP H H 94 8.259 8.259 8.710 -0.451 26021 6442 1 10 . 1 1 95 95 ASN N N 95 118.728 118.728 119.319 -0.591 26021 6443 1 10 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.607 0.087 26021 6444 1 10 . 1 1 95 95 ASN C C 95 176.272 176.272 177.867 -1.595 26021 6445 1 10 . 1 1 95 95 ASN CA C 95 53.986 53.986 56.100 -2.114 26021 6446 1 10 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.859 -0.131 26021 6447 1 10 . 1 1 95 95 ASN H H 95 8.474 8.474 8.510 -0.036 26021 6448 1 10 . 1 1 96 96 THR N N 96 113.868 113.868 115.206 -1.338 26021 6449 1 10 . 1 1 96 96 THR HA H 96 4.220 4.220 3.935 0.285 26021 6450 1 10 . 1 1 96 96 THR C C 96 175.107 175.107 175.707 -0.600 26021 6451 1 10 . 1 1 96 96 THR CA C 96 63.200 63.200 65.300 -2.100 26021 6452 1 10 . 1 1 96 96 THR CB C 96 69.475 69.475 68.477 0.998 26021 6453 1 10 . 1 1 96 96 THR H H 96 8.263 8.263 8.096 0.167 26021 6454 1 10 . 1 1 97 97 ASN N N 97 119.954 119.954 119.454 0.500 26021 6455 1 10 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.460 0.156 26021 6456 1 10 . 1 1 97 97 ASN C C 97 176.275 176.275 176.308 -0.033 26021 6457 1 10 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.890 -0.934 26021 6458 1 10 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.601 0.091 26021 6459 1 10 . 1 1 97 97 ASN H H 97 8.431 8.431 7.665 0.766 26021 6460 1 10 . 1 1 98 98 GLY N N 98 108.847 108.847 107.610 1.237 26021 6461 1 10 . 1 1 98 98 GLY C C 98 175.533 175.533 175.141 0.392 26021 6462 1 10 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.041 -0.030 26021 6463 1 10 . 1 1 98 98 GLY H H 98 8.338 8.338 8.162 0.176 26021 6464 1 10 . 1 1 99 99 PHE N N 99 118.492 118.492 119.609 -1.117 26021 6465 1 10 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.103 0.145 26021 6466 1 10 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.447 1.512 26021 6467 1 10 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.218 -1.059 26021 6468 1 10 . 1 1 99 99 PHE H H 99 8.370 8.370 8.544 -0.174 26021 6469 1 10 . 1 1 100 100 LYS N N 100 120.987 120.987 119.027 1.960 26021 6470 1 10 . 1 1 100 100 LYS H H 100 8.256 8.256 8.286 -0.030 26021 6471 1 10 . 1 1 101 101 GLY N N 101 108.186 108.186 107.597 0.589 26021 6472 1 10 . 1 1 101 101 GLY C C 101 177.075 177.075 175.920 1.155 26021 6473 1 10 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.119 0.783 26021 6474 1 10 . 1 1 101 101 GLY H H 101 8.300 8.300 7.601 0.699 26021 6475 1 10 . 1 1 102 102 LEU N N 102 121.439 121.439 124.012 -2.573 26021 6476 1 10 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.092 0.005 26021 6477 1 10 . 1 1 102 102 LEU C C 102 179.836 179.836 178.322 1.514 26021 6478 1 10 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.847 -0.489 26021 6479 1 10 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.700 0.070 26021 6480 1 10 . 1 1 102 102 LEU H H 102 7.777 7.777 7.562 0.215 26021 6481 1 10 . 1 1 103 103 MET N N 103 122.290 122.290 117.359 4.931 26021 6482 1 10 . 1 1 103 103 MET HA H 103 4.220 4.220 4.130 0.090 26021 6483 1 10 . 1 1 103 103 MET C C 103 177.739 177.739 178.000 -0.261 26021 6484 1 10 . 1 1 103 103 MET CA C 103 58.739 58.739 57.541 1.198 26021 6485 1 10 . 1 1 103 103 MET CB C 103 31.895 31.895 31.795 0.100 26021 6486 1 10 . 1 1 103 103 MET H H 103 8.409 8.409 8.250 0.159 26021 6487 1 10 . 1 1 104 104 LYS N N 104 119.750 119.750 119.039 0.711 26021 6488 1 10 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.052 0.015 26021 6489 1 10 . 1 1 104 104 LYS C C 104 179.301 179.301 179.307 -0.006 26021 6490 1 10 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.988 0.776 26021 6491 1 10 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.958 0.089 26021 6492 1 10 . 1 1 104 104 LYS H H 104 7.916 7.916 7.401 0.515 26021 6493 1 10 . 1 1 105 105 ARG N N 105 117.967 117.967 119.450 -1.483 26021 6494 1 10 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.141 -0.115 26021 6495 1 10 . 1 1 105 105 ARG C C 105 178.777 178.777 178.636 0.141 26021 6496 1 10 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.803 -0.439 26021 6497 1 10 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.364 0.633 26021 6498 1 10 . 1 1 105 105 ARG H H 105 7.719 7.719 8.122 -0.403 26021 6499 1 10 . 1 1 106 106 THR N N 106 117.211 117.211 112.791 4.420 26021 6500 1 10 . 1 1 106 106 THR HA H 106 4.301 4.301 4.232 0.069 26021 6501 1 10 . 1 1 106 106 THR C C 106 176.254 176.254 176.346 -0.092 26021 6502 1 10 . 1 1 106 106 THR CA C 106 67.860 67.860 65.688 2.172 26021 6503 1 10 . 1 1 106 106 THR CB C 106 67.860 67.860 68.055 -0.195 26021 6504 1 10 . 1 1 106 106 THR H H 106 8.152 8.152 7.761 0.391 26021 6505 1 10 . 1 1 107 107 THR N N 107 117.939 117.939 118.177 -0.238 26021 6506 1 10 . 1 1 107 107 THR HA H 107 3.971 3.971 3.877 0.094 26021 6507 1 10 . 1 1 107 107 THR C C 107 176.780 176.780 176.239 0.541 26021 6508 1 10 . 1 1 107 107 THR CA C 107 66.822 66.822 67.280 -0.458 26021 6509 1 10 . 1 1 107 107 THR CB C 107 68.818 68.818 68.564 0.254 26021 6510 1 10 . 1 1 107 107 THR H H 107 8.651 8.651 7.927 0.724 26021 6511 1 10 . 1 1 108 108 LYS N N 108 120.867 120.867 121.342 -0.475 26021 6512 1 10 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.041 -0.019 26021 6513 1 10 . 1 1 108 108 LYS C C 108 179.045 179.045 179.064 -0.019 26021 6514 1 10 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.386 0.448 26021 6515 1 10 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.274 0.199 26021 6516 1 10 . 1 1 108 108 LYS H H 108 7.694 7.694 7.631 0.063 26021 6517 1 10 . 1 1 109 109 LEU N N 109 119.472 119.472 118.571 0.901 26021 6518 1 10 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.294 0.027 26021 6519 1 10 . 1 1 109 109 LEU C C 109 179.974 179.974 178.982 0.992 26021 6520 1 10 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.361 0.232 26021 6521 1 10 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.330 -0.470 26021 6522 1 10 . 1 1 109 109 LEU H H 109 7.559 7.559 7.535 0.024 26021 6523 1 10 . 1 1 110 110 LEU N N 110 121.832 121.832 119.349 2.483 26021 6524 1 10 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.126 0.065 26021 6525 1 10 . 1 1 110 110 LEU C C 110 178.101 178.101 179.137 -1.036 26021 6526 1 10 . 1 1 110 110 LEU CA C 110 57.892 57.892 58.074 -0.182 26021 6527 1 10 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.537 0.347 26021 6528 1 10 . 1 1 110 110 LEU H H 110 8.567 8.567 8.388 0.179 26021 6529 1 10 . 1 1 111 111 LYS N N 111 117.972 117.972 117.315 0.657 26021 6530 1 10 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.085 -0.106 26021 6531 1 10 . 1 1 111 111 LYS C C 111 177.677 177.677 178.333 -0.656 26021 6532 1 10 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.861 -0.076 26021 6533 1 10 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.245 -0.036 26021 6534 1 10 . 1 1 111 111 LYS H H 111 7.965 7.965 7.978 -0.013 26021 6535 1 10 . 1 1 112 112 LYS N N 112 115.433 115.433 119.605 -4.172 26021 6536 1 10 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.028 0.082 26021 6537 1 10 . 1 1 112 112 LYS C C 112 178.270 178.270 179.072 -0.802 26021 6538 1 10 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.365 0.586 26021 6539 1 10 . 1 1 112 112 LYS CB C 112 32.791 32.791 31.990 0.801 26021 6540 1 10 . 1 1 112 112 LYS H H 112 7.334 7.334 7.680 -0.346 26021 6541 1 10 . 1 1 113 113 VAL N N 113 114.861 114.861 116.300 -1.439 26021 6542 1 10 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.578 0.253 26021 6543 1 10 . 1 1 113 113 VAL C C 113 176.999 176.999 177.332 -0.333 26021 6544 1 10 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.800 -2.295 26021 6545 1 10 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.141 1.146 26021 6546 1 10 . 1 1 113 113 VAL H H 113 7.298 7.298 7.321 -0.023 26021 6547 1 10 . 1 1 114 114 VAL N N 114 121.457 121.457 120.744 0.713 26021 6548 1 10 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.632 0.090 26021 6549 1 10 . 1 1 114 114 VAL C C 114 177.737 177.737 178.283 -0.546 26021 6550 1 10 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.601 -1.377 26021 6551 1 10 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.203 0.550 26021 6552 1 10 . 1 1 114 114 VAL H H 114 7.855 7.855 7.689 0.166 26021 6553 1 10 . 1 1 115 115 ASP N N 115 120.804 120.804 118.083 2.721 26021 6554 1 10 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.448 0.007 26021 6555 1 10 . 1 1 115 115 ASP C C 115 177.380 177.380 177.050 0.330 26021 6556 1 10 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.095 -0.174 26021 6557 1 10 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.826 -0.454 26021 6558 1 10 . 1 1 115 115 ASP H H 115 8.311 8.311 7.777 0.534 26021 6559 1 10 . 1 1 116 116 LYS N N 116 119.582 119.582 118.218 1.364 26021 6560 1 10 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.083 0.012 26021 6561 1 10 . 1 1 116 116 LYS C C 116 177.077 177.077 177.736 -0.659 26021 6562 1 10 . 1 1 116 116 LYS CA C 116 57.711 57.711 58.029 -0.318 26021 6563 1 10 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.656 -0.168 26021 6564 1 10 . 1 1 116 116 LYS H H 116 7.639 7.639 7.533 0.106 26021 6565 1 10 . 1 1 117 117 HIS N N 117 115.246 115.246 112.361 2.885 26021 6566 1 10 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.788 -0.163 26021 6567 1 10 . 1 1 117 117 HIS C C 117 175.497 175.497 175.722 -0.225 26021 6568 1 10 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.589 -0.414 26021 6569 1 10 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.373 -1.898 26021 6570 1 10 . 1 1 117 117 HIS H H 117 8.108 8.108 8.495 -0.387 26021 6571 1 10 . 1 1 118 118 GLY N N 118 109.944 109.944 109.157 0.787 26021 6572 1 10 . 1 1 118 118 GLY C C 118 174.093 174.093 174.087 0.006 26021 6573 1 10 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.017 1.047 26021 6574 1 10 . 1 1 118 118 GLY H H 118 8.153 8.153 7.774 0.379 26021 6575 1 10 . 1 1 119 119 ILE N N 119 118.468 118.468 121.816 -3.348 26021 6576 1 10 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.898 0.224 26021 6577 1 10 . 1 1 119 119 ILE C C 119 174.777 174.777 175.968 -1.191 26021 6578 1 10 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.519 -0.418 26021 6579 1 10 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.666 1.965 26021 6580 1 10 . 1 1 119 119 ILE H H 119 7.828 7.828 7.745 0.083 26021 6581 1 11 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.729 0.020 26021 6582 1 11 . 1 1 4 4 ASN C C 4 175.260 175.260 175.816 -0.556 26021 6583 1 11 . 1 1 4 4 ASN CA C 4 53.831 53.831 53.773 0.058 26021 6584 1 11 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.624 0.056 26021 6585 1 11 . 1 1 5 5 ALA N N 5 123.648 123.648 122.228 1.420 26021 6586 1 11 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.630 -0.340 26021 6587 1 11 . 1 1 5 5 ALA C C 5 178.256 178.256 178.871 -0.615 26021 6588 1 11 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.695 1.386 26021 6589 1 11 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.553 0.472 26021 6590 1 11 . 1 1 5 5 ALA H H 5 8.520 8.520 8.415 0.105 26021 6591 1 11 . 1 1 6 6 GLY N N 6 107.044 107.044 108.110 -1.066 26021 6592 1 11 . 1 1 6 6 GLY C C 6 174.961 174.961 175.507 -0.546 26021 6593 1 11 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.741 -0.911 26021 6594 1 11 . 1 1 6 6 GLY H H 6 8.350 8.350 8.494 -0.144 26021 6595 1 11 . 1 1 7 7 ALA N N 7 123.366 123.366 123.489 -0.123 26021 6596 1 11 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.005 0.211 26021 6597 1 11 . 1 1 7 7 ALA C C 7 179.006 179.006 179.070 -0.064 26021 6598 1 11 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.472 -0.769 26021 6599 1 11 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.635 0.209 26021 6600 1 11 . 1 1 7 7 ALA H H 7 8.078 8.078 7.874 0.204 26021 6601 1 11 . 1 1 8 8 ILE N N 8 117.376 117.376 119.323 -1.947 26021 6602 1 11 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.607 0.173 26021 6603 1 11 . 1 1 8 8 ILE C C 8 177.032 177.032 178.395 -1.363 26021 6604 1 11 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.679 -1.521 26021 6605 1 11 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.705 -1.416 26021 6606 1 11 . 1 1 8 8 ILE H H 8 7.943 7.943 7.437 0.506 26021 6607 1 11 . 1 1 9 9 ALA N N 9 121.414 121.414 121.944 -0.530 26021 6608 1 11 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.057 -0.124 26021 6609 1 11 . 1 1 9 9 ALA C C 9 180.515 180.515 179.202 1.313 26021 6610 1 11 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.673 0.425 26021 6611 1 11 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.163 -0.002 26021 6612 1 11 . 1 1 9 9 ALA H H 9 8.062 8.062 7.735 0.327 26021 6613 1 11 . 1 1 10 10 LYS N N 10 114.594 114.594 119.169 -4.575 26021 6614 1 11 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.118 0.046 26021 6615 1 11 . 1 1 10 10 LYS C C 10 178.099 178.099 177.655 0.444 26021 6616 1 11 . 1 1 10 10 LYS CA C 10 57.840 57.840 57.548 0.292 26021 6617 1 11 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.050 0.420 26021 6618 1 11 . 1 1 10 10 LYS H H 10 7.554 7.554 7.848 -0.294 26021 6619 1 11 . 1 1 11 11 LEU N N 11 119.662 119.662 118.011 1.651 26021 6620 1 11 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.168 -0.090 26021 6621 1 11 . 1 1 11 11 LEU C C 11 177.930 177.930 178.113 -0.183 26021 6622 1 11 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.025 0.531 26021 6623 1 11 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.699 1.389 26021 6624 1 11 . 1 1 11 11 LEU H H 11 7.814 7.814 7.244 0.570 26021 6625 1 11 . 1 1 12 12 ILE N N 12 117.945 117.945 121.032 -3.087 26021 6626 1 11 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.896 -0.204 26021 6627 1 11 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.108 1.521 26021 6628 1 11 . 1 1 12 12 ILE CB C 12 36.410 36.410 35.005 1.405 26021 6629 1 11 . 1 1 12 12 ILE H H 12 7.426 7.426 7.824 -0.398 26021 6630 1 11 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.291 0.112 26021 6631 1 11 . 1 1 13 13 PRO C C 13 179.030 179.030 178.806 0.224 26021 6632 1 11 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.093 0.151 26021 6633 1 11 . 1 1 13 13 PRO CB C 13 30.809 30.809 30.986 -0.177 26021 6634 1 11 . 1 1 14 14 LYS N N 14 117.855 117.855 119.165 -1.310 26021 6635 1 11 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.089 0.056 26021 6636 1 11 . 1 1 14 14 LYS C C 14 178.565 178.565 178.428 0.137 26021 6637 1 11 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.539 -0.106 26021 6638 1 11 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.224 0.701 26021 6639 1 11 . 1 1 14 14 LYS H H 14 6.685 6.685 7.549 -0.864 26021 6640 1 11 . 1 1 15 15 LEU N N 15 118.008 118.008 116.953 1.055 26021 6641 1 11 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.410 -0.407 26021 6642 1 11 . 1 1 15 15 LEU C C 15 178.662 178.662 179.084 -0.422 26021 6643 1 11 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.194 1.518 26021 6644 1 11 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.301 -0.302 26021 6645 1 11 . 1 1 15 15 LEU H H 15 8.148 8.148 7.524 0.624 26021 6646 1 11 . 1 1 16 16 GLY N N 16 103.895 103.895 108.007 -4.112 26021 6647 1 11 . 1 1 16 16 GLY C C 16 176.838 176.838 175.985 0.853 26021 6648 1 11 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.050 0.315 26021 6649 1 11 . 1 1 16 16 GLY H H 16 8.104 8.104 8.116 -0.012 26021 6650 1 11 . 1 1 17 17 GLU N N 17 121.655 121.655 121.222 0.433 26021 6651 1 11 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.306 -0.173 26021 6652 1 11 . 1 1 17 17 GLU C C 17 179.007 179.007 179.030 -0.023 26021 6653 1 11 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.476 0.335 26021 6654 1 11 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.886 -0.753 26021 6655 1 11 . 1 1 17 17 GLU H H 17 7.817 7.817 7.836 -0.019 26021 6656 1 11 . 1 1 18 18 LEU N N 18 117.834 117.834 120.214 -2.380 26021 6657 1 11 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.402 -0.284 26021 6658 1 11 . 1 1 18 18 LEU C C 18 177.658 177.658 176.733 0.925 26021 6659 1 11 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.571 1.458 26021 6660 1 11 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.394 0.276 26021 6661 1 11 . 1 1 18 18 LEU H H 18 7.389 7.389 8.011 -0.622 26021 6662 1 11 . 1 1 19 19 LEU N N 19 113.694 113.694 115.926 -2.232 26021 6663 1 11 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.398 -0.236 26021 6664 1 11 . 1 1 19 19 LEU C C 19 178.123 178.123 178.069 0.054 26021 6665 1 11 . 1 1 19 19 LEU CA C 19 55.852 55.852 54.756 1.096 26021 6666 1 11 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.575 0.645 26021 6667 1 11 . 1 1 19 19 LEU H H 19 7.269 7.269 7.339 -0.070 26021 6668 1 11 . 1 1 20 20 VAL N N 20 112.778 112.778 112.772 0.006 26021 6669 1 11 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.114 0.329 26021 6670 1 11 . 1 1 20 20 VAL C C 20 177.021 177.021 177.230 -0.209 26021 6671 1 11 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.296 -1.441 26021 6672 1 11 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.266 0.512 26021 6673 1 11 . 1 1 20 20 VAL H H 20 7.356 7.356 7.552 -0.196 26021 6674 1 11 . 1 1 21 21 GLY N N 21 108.962 108.962 106.983 1.979 26021 6675 1 11 . 1 1 21 21 GLY C C 21 173.813 173.813 175.047 -1.234 26021 6676 1 11 . 1 1 21 21 GLY CA C 21 45.046 45.046 45.998 -0.952 26021 6677 1 11 . 1 1 21 21 GLY H H 21 7.925 7.925 8.156 -0.231 26021 6678 1 11 . 1 1 22 22 GLU N N 22 120.607 120.607 122.864 -2.257 26021 6679 1 11 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.215 0.063 26021 6680 1 11 . 1 1 22 22 GLU C C 22 175.869 175.869 175.773 0.096 26021 6681 1 11 . 1 1 22 22 GLU CA C 22 56.030 56.030 56.362 -0.333 26021 6682 1 11 . 1 1 22 22 GLU CB C 22 28.681 28.681 27.354 1.327 26021 6683 1 11 . 1 1 22 22 GLU H H 22 8.300 8.300 8.512 -0.212 26021 6684 1 11 . 1 1 23 23 TYR N N 23 120.738 120.738 123.149 -2.411 26021 6685 1 11 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.770 -0.213 26021 6686 1 11 . 1 1 23 23 TYR C C 23 175.264 175.264 175.852 -0.588 26021 6687 1 11 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.594 -0.033 26021 6688 1 11 . 1 1 23 23 TYR CB C 23 39.246 39.246 40.896 -1.650 26021 6689 1 11 . 1 1 23 23 TYR H H 23 7.756 7.756 7.801 -0.045 26021 6690 1 11 . 1 1 24 24 LYS N N 24 122.095 122.095 123.295 -1.200 26021 6691 1 11 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.586 -0.403 26021 6692 1 11 . 1 1 24 24 LYS C C 24 175.742 175.742 174.726 1.016 26021 6693 1 11 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.320 -0.202 26021 6694 1 11 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.404 -0.685 26021 6695 1 11 . 1 1 24 24 LYS H H 24 8.692 8.692 8.695 -0.003 26021 6696 1 11 . 1 1 25 25 LEU N N 25 121.123 121.123 118.980 2.143 26021 6697 1 11 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.432 0.060 26021 6698 1 11 . 1 1 25 25 LEU C C 25 177.487 177.487 175.869 1.618 26021 6699 1 11 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.762 0.572 26021 6700 1 11 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.568 -0.810 26021 6701 1 11 . 1 1 25 25 LEU H H 25 8.088 8.088 7.338 0.750 26021 6702 1 11 . 1 1 26 26 HIS N N 26 122.993 122.993 119.375 3.618 26021 6703 1 11 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.567 -0.066 26021 6704 1 11 . 1 1 26 26 HIS C C 26 176.716 176.716 176.142 0.574 26021 6705 1 11 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.864 0.333 26021 6706 1 11 . 1 1 26 26 HIS CB C 26 31.357 31.357 31.469 -0.112 26021 6707 1 11 . 1 1 26 26 HIS H H 26 8.882 8.882 8.427 0.455 26021 6708 1 11 . 1 1 27 27 LYS N N 27 124.894 124.894 124.343 0.551 26021 6709 1 11 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.221 -0.273 26021 6710 1 11 . 1 1 27 27 LYS C C 27 178.873 178.873 177.915 0.958 26021 6711 1 11 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.002 2.009 26021 6712 1 11 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.157 0.285 26021 6713 1 11 . 1 1 27 27 LYS H H 27 8.699 8.699 8.519 0.180 26021 6714 1 11 . 1 1 28 28 GLY N N 28 111.258 111.258 106.699 4.559 26021 6715 1 11 . 1 1 28 28 GLY C C 28 176.131 176.131 175.437 0.694 26021 6716 1 11 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.270 0.221 26021 6717 1 11 . 1 1 28 28 GLY H H 28 9.814 9.814 8.505 1.309 26021 6718 1 11 . 1 1 29 29 VAL N N 29 122.719 122.719 122.076 0.643 26021 6719 1 11 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.621 0.271 26021 6720 1 11 . 1 1 29 29 VAL C C 29 177.628 177.628 177.950 -0.322 26021 6721 1 11 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.944 -0.423 26021 6722 1 11 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.578 0.164 26021 6723 1 11 . 1 1 29 29 VAL H H 29 7.431 7.431 7.363 0.068 26021 6724 1 11 . 1 1 30 30 LYS N N 30 119.791 119.791 118.363 1.428 26021 6725 1 11 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.987 -0.352 26021 6726 1 11 . 1 1 30 30 LYS C C 30 177.666 177.666 178.255 -0.589 26021 6727 1 11 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.345 1.679 26021 6728 1 11 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.537 0.868 26021 6729 1 11 . 1 1 30 30 LYS H H 30 8.255 8.255 7.686 0.569 26021 6730 1 11 . 1 1 31 31 LYS N N 31 117.918 117.918 117.606 0.312 26021 6731 1 11 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.029 0.087 26021 6732 1 11 . 1 1 31 31 LYS C C 31 177.784 177.784 177.943 -0.159 26021 6733 1 11 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.036 -0.334 26021 6734 1 11 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.144 -0.299 26021 6735 1 11 . 1 1 31 31 LYS H H 31 7.689 7.689 7.472 0.217 26021 6736 1 11 . 1 1 32 32 ASN N N 32 116.347 116.347 117.490 -1.143 26021 6737 1 11 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.522 -0.002 26021 6738 1 11 . 1 1 32 32 ASN C C 32 177.764 177.764 177.065 0.699 26021 6739 1 11 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.250 1.065 26021 6740 1 11 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.869 -0.237 26021 6741 1 11 . 1 1 32 32 ASN H H 32 7.556 7.556 7.726 -0.170 26021 6742 1 11 . 1 1 33 33 ILE N N 33 120.592 120.592 119.878 0.714 26021 6743 1 11 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.602 -0.320 26021 6744 1 11 . 1 1 33 33 ILE C C 33 177.074 177.074 177.524 -0.450 26021 6745 1 11 . 1 1 33 33 ILE CA C 33 65.888 65.888 64.153 1.735 26021 6746 1 11 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.677 0.501 26021 6747 1 11 . 1 1 33 33 ILE H H 33 8.236 8.236 7.467 0.769 26021 6748 1 11 . 1 1 34 34 GLU N N 34 120.595 120.595 118.838 1.757 26021 6749 1 11 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.916 -0.128 26021 6750 1 11 . 1 1 34 34 GLU C C 34 179.739 179.739 178.783 0.956 26021 6751 1 11 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.768 0.471 26021 6752 1 11 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.785 1.060 26021 6753 1 11 . 1 1 34 34 GLU H H 34 8.551 8.551 7.988 0.563 26021 6754 1 11 . 1 1 35 35 ASP N N 35 120.600 120.600 119.924 0.676 26021 6755 1 11 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.570 -0.158 26021 6756 1 11 . 1 1 35 35 ASP C C 35 178.681 178.681 178.513 0.168 26021 6757 1 11 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.334 1.128 26021 6758 1 11 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.524 -0.774 26021 6759 1 11 . 1 1 35 35 ASP H H 35 8.670 8.670 7.947 0.723 26021 6760 1 11 . 1 1 36 36 LEU N N 36 123.004 123.004 120.659 2.345 26021 6761 1 11 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.245 -0.150 26021 6762 1 11 . 1 1 36 36 LEU C C 36 178.035 178.035 178.721 -0.686 26021 6763 1 11 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.273 0.755 26021 6764 1 11 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.319 -0.443 26021 6765 1 11 . 1 1 36 36 LEU H H 36 8.166 8.166 7.617 0.549 26021 6766 1 11 . 1 1 37 37 LEU N N 37 120.178 120.178 120.065 0.113 26021 6767 1 11 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.087 -0.231 26021 6768 1 11 . 1 1 37 37 LEU C C 37 178.128 178.128 178.053 0.075 26021 6769 1 11 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.734 0.941 26021 6770 1 11 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.628 0.527 26021 6771 1 11 . 1 1 37 37 LEU H H 37 8.736 8.736 8.595 0.141 26021 6772 1 11 . 1 1 38 38 LYS N N 38 118.110 118.110 118.581 -0.471 26021 6773 1 11 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.946 -0.013 26021 6774 1 11 . 1 1 38 38 LYS C C 38 179.533 179.533 178.881 0.652 26021 6775 1 11 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.151 0.122 26021 6776 1 11 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.005 0.272 26021 6777 1 11 . 1 1 38 38 LYS H H 38 7.770 7.770 7.840 -0.070 26021 6778 1 11 . 1 1 39 39 GLU N N 39 119.265 119.265 118.975 0.290 26021 6779 1 11 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.171 0.131 26021 6780 1 11 . 1 1 39 39 GLU C C 39 179.720 179.720 178.840 0.880 26021 6781 1 11 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.164 -0.407 26021 6782 1 11 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.084 0.506 26021 6783 1 11 . 1 1 39 39 GLU H H 39 7.709 7.709 7.580 0.129 26021 6784 1 11 . 1 1 40 40 LEU N N 40 119.007 119.007 120.732 -1.725 26021 6785 1 11 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.145 -0.095 26021 6786 1 11 . 1 1 40 40 LEU C C 40 179.690 179.690 179.136 0.554 26021 6787 1 11 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.271 0.380 26021 6788 1 11 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.235 0.450 26021 6789 1 11 . 1 1 40 40 LEU H H 40 8.851 8.851 7.310 1.541 26021 6790 1 11 . 1 1 41 41 LYS N N 41 120.500 120.500 118.679 1.821 26021 6791 1 11 . 1 1 41 41 LYS HA H 41 3.952 3.952 3.915 0.037 26021 6792 1 11 . 1 1 41 41 LYS C C 41 180.223 180.223 179.211 1.012 26021 6793 1 11 . 1 1 41 41 LYS CA C 41 60.891 60.891 60.298 0.593 26021 6794 1 11 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.066 0.001 26021 6795 1 11 . 1 1 41 41 LYS H H 41 8.482 8.482 8.698 -0.216 26021 6796 1 11 . 1 1 42 42 THR N N 42 119.555 119.555 114.069 5.486 26021 6797 1 11 . 1 1 42 42 THR HA H 42 4.000 4.000 4.053 -0.053 26021 6798 1 11 . 1 1 42 42 THR C C 42 176.633 176.633 176.619 0.014 26021 6799 1 11 . 1 1 42 42 THR CA C 42 66.574 66.574 65.282 1.292 26021 6800 1 11 . 1 1 42 42 THR CB C 42 67.924 67.924 68.804 -0.880 26021 6801 1 11 . 1 1 42 42 THR H H 42 7.863 7.863 7.610 0.253 26021 6802 1 11 . 1 1 43 43 MET N N 43 122.839 122.839 119.921 2.918 26021 6803 1 11 . 1 1 43 43 MET HA H 43 4.022 4.022 4.139 -0.117 26021 6804 1 11 . 1 1 43 43 MET C C 43 177.290 177.290 178.604 -1.314 26021 6805 1 11 . 1 1 43 43 MET CA C 43 59.731 59.731 58.978 0.753 26021 6806 1 11 . 1 1 43 43 MET CB C 43 33.610 33.610 32.553 1.057 26021 6807 1 11 . 1 1 43 43 MET H H 43 8.714 8.714 7.519 1.195 26021 6808 1 11 . 1 1 44 44 ASN N N 44 118.049 118.049 118.465 -0.416 26021 6809 1 11 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.353 0.021 26021 6810 1 11 . 1 1 44 44 ASN C C 44 176.297 176.297 177.029 -0.732 26021 6811 1 11 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.424 0.470 26021 6812 1 11 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.420 0.985 26021 6813 1 11 . 1 1 44 44 ASN H H 44 8.988 8.988 7.862 1.126 26021 6814 1 11 . 1 1 45 45 ALA N N 45 119.260 119.260 120.970 -1.710 26021 6815 1 11 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.085 -0.019 26021 6816 1 11 . 1 1 45 45 ALA C C 45 180.476 180.476 179.154 1.322 26021 6817 1 11 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.618 0.650 26021 6818 1 11 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.183 -0.496 26021 6819 1 11 . 1 1 45 45 ALA H H 45 7.675 7.675 7.499 0.176 26021 6820 1 11 . 1 1 46 46 ALA N N 46 121.126 121.126 121.655 -0.529 26021 6821 1 11 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.098 0.018 26021 6822 1 11 . 1 1 46 46 ALA C C 46 179.314 179.314 178.972 0.342 26021 6823 1 11 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.142 -0.157 26021 6824 1 11 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.784 -0.562 26021 6825 1 11 . 1 1 46 46 ALA H H 46 7.872 7.872 7.705 0.167 26021 6826 1 11 . 1 1 47 47 LEU N N 47 119.328 119.328 116.935 2.393 26021 6827 1 11 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.134 0.057 26021 6828 1 11 . 1 1 47 47 LEU C C 47 180.403 180.403 178.459 1.944 26021 6829 1 11 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.907 0.139 26021 6830 1 11 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.443 0.507 26021 6831 1 11 . 1 1 47 47 LEU H H 47 8.529 8.529 7.712 0.817 26021 6832 1 11 . 1 1 48 48 ILE N N 48 121.653 121.653 117.719 3.934 26021 6833 1 11 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.729 -0.027 26021 6834 1 11 . 1 1 48 48 ILE C C 48 178.730 178.730 178.219 0.511 26021 6835 1 11 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.938 -0.028 26021 6836 1 11 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.618 0.294 26021 6837 1 11 . 1 1 48 48 ILE H H 48 8.386 8.386 7.118 1.268 26021 6838 1 11 . 1 1 49 49 LYS N N 49 119.896 119.896 119.472 0.424 26021 6839 1 11 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.127 -0.084 26021 6840 1 11 . 1 1 49 49 LYS C C 49 179.999 179.999 179.173 0.826 26021 6841 1 11 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.216 -0.159 26021 6842 1 11 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.248 -0.287 26021 6843 1 11 . 1 1 49 49 LYS H H 49 7.456 7.456 7.426 0.030 26021 6844 1 11 . 1 1 50 50 ILE N N 50 119.964 119.964 115.945 4.019 26021 6845 1 11 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.093 -0.357 26021 6846 1 11 . 1 1 50 50 ILE C C 50 177.960 177.960 177.915 0.045 26021 6847 1 11 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.991 0.358 26021 6848 1 11 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.690 0.442 26021 6849 1 11 . 1 1 50 50 ILE H H 50 8.154 8.154 8.710 -0.556 26021 6850 1 11 . 1 1 51 51 GLY N N 51 106.709 106.709 107.299 -0.590 26021 6851 1 11 . 1 1 51 51 GLY C C 51 174.461 174.461 175.092 -0.631 26021 6852 1 11 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.887 0.022 26021 6853 1 11 . 1 1 51 51 GLY H H 51 7.932 7.932 7.803 0.129 26021 6854 1 11 . 1 1 52 52 GLU N N 52 118.736 118.736 119.130 -0.394 26021 6855 1 11 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.196 0.124 26021 6856 1 11 . 1 1 52 52 GLU C C 52 176.789 176.789 177.075 -0.286 26021 6857 1 11 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.697 -1.423 26021 6858 1 11 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.051 0.061 26021 6859 1 11 . 1 1 52 52 GLU H H 52 7.597 7.597 7.657 -0.060 26021 6860 1 11 . 1 1 53 53 VAL N N 53 122.982 122.982 116.823 6.159 26021 6861 1 11 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.291 -0.030 26021 6862 1 11 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.479 1.906 26021 6863 1 11 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.959 1.863 26021 6864 1 11 . 1 1 53 53 VAL H H 53 7.511 7.511 7.393 0.118 26021 6865 1 11 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.804 -0.159 26021 6866 1 11 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.618 -0.040 26021 6867 1 11 . 1 1 54 54 PRO CB C 54 31.535 31.535 30.998 0.537 26021 6868 1 11 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.330 -0.139 26021 6869 1 11 . 1 1 55 55 PRO C C 55 178.258 178.258 178.032 0.226 26021 6870 1 11 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.915 0.513 26021 6871 1 11 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.745 0.101 26021 6872 1 11 . 1 1 56 56 ASP N N 56 114.117 114.117 118.875 -4.758 26021 6873 1 11 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.482 0.009 26021 6874 1 11 . 1 1 56 56 ASP C C 56 176.696 176.696 176.765 -0.069 26021 6875 1 11 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.653 -0.515 26021 6876 1 11 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.751 -1.025 26021 6877 1 11 . 1 1 56 56 ASP H H 56 8.489 8.489 8.340 0.149 26021 6878 1 11 . 1 1 57 57 GLN N N 57 117.641 117.641 116.860 0.781 26021 6879 1 11 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.407 -0.033 26021 6880 1 11 . 1 1 57 57 GLN C C 57 175.765 175.765 175.203 0.562 26021 6881 1 11 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.146 0.144 26021 6882 1 11 . 1 1 57 57 GLN CB C 57 29.646 29.646 28.966 0.680 26021 6883 1 11 . 1 1 57 57 GLN H H 57 8.206 8.206 7.633 0.573 26021 6884 1 11 . 1 1 58 58 LEU N N 58 122.141 122.141 121.724 0.417 26021 6885 1 11 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.399 0.051 26021 6886 1 11 . 1 1 58 58 LEU C C 58 176.849 176.849 176.535 0.314 26021 6887 1 11 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.527 0.468 26021 6888 1 11 . 1 1 58 58 LEU CB C 58 43.231 43.231 41.912 1.319 26021 6889 1 11 . 1 1 58 58 LEU H H 58 7.152 7.152 7.177 -0.025 26021 6890 1 11 . 1 1 59 59 ASP N N 59 125.643 125.643 125.221 0.422 26021 6891 1 11 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.899 -0.180 26021 6892 1 11 . 1 1 59 59 ASP C C 59 177.249 177.249 176.757 0.492 26021 6893 1 11 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.988 0.415 26021 6894 1 11 . 1 1 59 59 ASP CB C 59 42.232 42.232 42.543 -0.311 26021 6895 1 11 . 1 1 59 59 ASP H H 59 9.312 9.312 8.433 0.879 26021 6896 1 11 . 1 1 60 60 SER N N 60 116.550 116.550 115.803 0.747 26021 6897 1 11 . 1 1 60 60 SER HA H 60 4.124 4.124 4.200 -0.076 26021 6898 1 11 . 1 1 60 60 SER C C 60 176.840 176.840 176.589 0.251 26021 6899 1 11 . 1 1 60 60 SER CA C 60 61.722 61.722 61.347 0.374 26021 6900 1 11 . 1 1 60 60 SER CB C 60 62.815 62.815 63.342 -0.527 26021 6901 1 11 . 1 1 60 60 SER H H 60 8.647 8.647 8.509 0.138 26021 6902 1 11 . 1 1 61 61 GLN N N 61 121.394 121.394 120.533 0.861 26021 6903 1 11 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.163 -0.032 26021 6904 1 11 . 1 1 61 61 GLN C C 61 178.629 178.629 177.877 0.752 26021 6905 1 11 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.652 0.101 26021 6906 1 11 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.568 -0.315 26021 6907 1 11 . 1 1 61 61 GLN H H 61 8.453 8.453 8.472 -0.019 26021 6908 1 11 . 1 1 62 62 ASP N N 62 122.187 122.187 119.471 2.716 26021 6909 1 11 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.514 0.105 26021 6910 1 11 . 1 1 62 62 ASP C C 62 178.318 178.318 178.221 0.097 26021 6911 1 11 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.708 -0.246 26021 6912 1 11 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.508 0.528 26021 6913 1 11 . 1 1 62 62 ASP H H 62 8.311 8.311 8.577 -0.266 26021 6914 1 11 . 1 1 63 63 LYS N N 63 120.325 120.325 117.899 2.426 26021 6915 1 11 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.125 -0.116 26021 6916 1 11 . 1 1 63 63 LYS C C 63 178.765 178.765 179.020 -0.255 26021 6917 1 11 . 1 1 63 63 LYS CA C 63 59.753 59.753 59.028 0.725 26021 6918 1 11 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.097 0.356 26021 6919 1 11 . 1 1 63 63 LYS H H 63 7.923 7.923 7.775 0.148 26021 6920 1 11 . 1 1 64 64 LEU N N 64 119.491 119.491 119.933 -0.442 26021 6921 1 11 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.163 0.063 26021 6922 1 11 . 1 1 64 64 LEU C C 64 179.526 179.526 178.436 1.090 26021 6923 1 11 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.953 -0.154 26021 6924 1 11 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.891 -0.116 26021 6925 1 11 . 1 1 64 64 LEU H H 64 7.820 7.820 7.629 0.191 26021 6926 1 11 . 1 1 65 65 TRP N N 65 120.674 120.674 121.997 -1.323 26021 6927 1 11 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.224 0.084 26021 6928 1 11 . 1 1 65 65 TRP C C 65 177.379 177.379 177.049 0.330 26021 6929 1 11 . 1 1 65 65 TRP CA C 65 61.802 61.802 61.109 0.693 26021 6930 1 11 . 1 1 65 65 TRP CB C 65 28.411 28.411 29.166 -0.755 26021 6931 1 11 . 1 1 65 65 TRP H H 65 8.196 8.196 7.872 0.324 26021 6932 1 11 . 1 1 66 66 ALA N N 66 120.606 120.606 120.349 0.257 26021 6933 1 11 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.438 0.271 26021 6934 1 11 . 1 1 66 66 ALA C C 66 180.376 180.376 178.877 1.499 26021 6935 1 11 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.745 0.820 26021 6936 1 11 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.822 -0.168 26021 6937 1 11 . 1 1 66 66 ALA H H 66 8.305 8.305 7.987 0.318 26021 6938 1 11 . 1 1 67 67 ASP N N 67 119.175 119.175 118.805 0.370 26021 6939 1 11 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.272 0.178 26021 6940 1 11 . 1 1 67 67 ASP C C 67 178.757 178.757 178.236 0.521 26021 6941 1 11 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.516 -0.023 26021 6942 1 11 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.889 -0.735 26021 6943 1 11 . 1 1 67 67 ASP H H 67 7.945 7.945 7.665 0.280 26021 6944 1 11 . 1 1 68 68 GLU N N 68 122.322 122.322 118.793 3.529 26021 6945 1 11 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.241 -0.226 26021 6946 1 11 . 1 1 68 68 GLU C C 68 180.055 180.055 179.330 0.725 26021 6947 1 11 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.231 0.879 26021 6948 1 11 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.630 0.017 26021 6949 1 11 . 1 1 68 68 GLU H H 68 8.168 8.168 7.670 0.498 26021 6950 1 11 . 1 1 69 69 VAL N N 69 122.135 122.135 119.725 2.410 26021 6951 1 11 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.611 -0.359 26021 6952 1 11 . 1 1 69 69 VAL C C 69 177.736 177.736 177.935 -0.199 26021 6953 1 11 . 1 1 69 69 VAL CA C 69 66.539 66.539 66.193 0.346 26021 6954 1 11 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.538 -0.296 26021 6955 1 11 . 1 1 69 69 VAL H H 69 8.424 8.424 7.183 1.241 26021 6956 1 11 . 1 1 70 70 ARG N N 70 121.373 121.373 119.029 2.344 26021 6957 1 11 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.976 -0.284 26021 6958 1 11 . 1 1 70 70 ARG C C 70 179.117 179.117 178.819 0.298 26021 6959 1 11 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.578 1.587 26021 6960 1 11 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.944 -0.290 26021 6961 1 11 . 1 1 70 70 ARG H H 70 7.916 7.916 8.181 -0.265 26021 6962 1 11 . 1 1 71 71 GLU N N 71 119.075 119.075 120.106 -1.031 26021 6963 1 11 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.006 0.057 26021 6964 1 11 . 1 1 71 71 GLU C C 71 179.119 179.119 178.945 0.174 26021 6965 1 11 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.161 0.526 26021 6966 1 11 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.769 0.501 26021 6967 1 11 . 1 1 71 71 GLU H H 71 8.031 8.031 8.527 -0.496 26021 6968 1 11 . 1 1 72 72 LEU N N 72 120.503 120.503 121.336 -0.833 26021 6969 1 11 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.051 0.006 26021 6970 1 11 . 1 1 72 72 LEU C C 72 178.734 178.734 178.259 0.475 26021 6971 1 11 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.104 0.318 26021 6972 1 11 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.598 -0.190 26021 6973 1 11 . 1 1 72 72 LEU H H 72 8.175 8.175 7.562 0.613 26021 6974 1 11 . 1 1 73 73 SER N N 73 115.243 115.243 114.779 0.464 26021 6975 1 11 . 1 1 73 73 SER HA H 73 3.824 3.824 3.984 -0.160 26021 6976 1 11 . 1 1 73 73 SER C C 73 175.697 175.697 176.465 -0.768 26021 6977 1 11 . 1 1 73 73 SER CA C 73 62.384 62.384 61.364 1.020 26021 6978 1 11 . 1 1 73 73 SER CB C 73 62.093 62.093 62.967 -0.874 26021 6979 1 11 . 1 1 73 73 SER H H 73 8.411 8.411 7.799 0.612 26021 6980 1 11 . 1 1 74 74 TYR N N 74 121.342 121.342 120.389 0.953 26021 6981 1 11 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.246 0.245 26021 6982 1 11 . 1 1 74 74 TYR C C 74 178.747 178.747 178.515 0.232 26021 6983 1 11 . 1 1 74 74 TYR CA C 74 60.435 60.435 61.341 -0.906 26021 6984 1 11 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.037 -0.530 26021 6985 1 11 . 1 1 74 74 TYR H H 74 7.314 7.314 7.899 -0.585 26021 6986 1 11 . 1 1 75 75 VAL N N 75 120.779 120.779 119.365 1.414 26021 6987 1 11 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.797 0.064 26021 6988 1 11 . 1 1 75 75 VAL C C 75 179.788 179.788 178.275 1.513 26021 6989 1 11 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.492 0.556 26021 6990 1 11 . 1 1 75 75 VAL CB C 75 31.714 31.714 30.911 0.803 26021 6991 1 11 . 1 1 75 75 VAL H H 75 7.740 7.740 7.803 -0.063 26021 6992 1 11 . 1 1 76 76 ILE N N 76 120.598 120.598 119.537 1.061 26021 6993 1 11 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.689 0.011 26021 6994 1 11 . 1 1 76 76 ILE C C 76 177.066 177.066 177.840 -0.774 26021 6995 1 11 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.408 1.511 26021 6996 1 11 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.331 0.054 26021 6997 1 11 . 1 1 76 76 ILE H H 76 8.584 8.584 7.274 1.310 26021 6998 1 11 . 1 1 77 77 GLU N N 77 120.468 120.468 120.509 -0.041 26021 6999 1 11 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.928 -0.279 26021 7000 1 11 . 1 1 77 77 GLU C C 77 177.502 177.502 178.617 -1.115 26021 7001 1 11 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.869 0.993 26021 7002 1 11 . 1 1 77 77 GLU CB C 77 29.352 29.352 29.041 0.311 26021 7003 1 11 . 1 1 77 77 GLU H H 77 8.445 8.445 8.393 0.052 26021 7004 1 11 . 1 1 78 78 ASP N N 78 117.382 117.382 120.058 -2.676 26021 7005 1 11 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.382 0.009 26021 7006 1 11 . 1 1 78 78 ASP C C 78 177.382 177.382 177.981 -0.599 26021 7007 1 11 . 1 1 78 78 ASP CA C 78 57.495 57.495 57.445 0.050 26021 7008 1 11 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.323 1.612 26021 7009 1 11 . 1 1 78 78 ASP H H 78 7.885 7.885 7.752 0.133 26021 7010 1 11 . 1 1 79 79 ALA N N 79 120.171 120.171 121.112 -0.941 26021 7011 1 11 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.123 -0.073 26021 7012 1 11 . 1 1 79 79 ALA C C 79 181.193 181.193 179.733 1.460 26021 7013 1 11 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.088 -0.033 26021 7014 1 11 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.487 -0.067 26021 7015 1 11 . 1 1 79 79 ALA H H 79 7.754 7.754 8.116 -0.362 26021 7016 1 11 . 1 1 80 80 VAL N N 80 119.541 119.541 115.571 3.970 26021 7017 1 11 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.918 -0.241 26021 7018 1 11 . 1 1 80 80 VAL C C 80 177.096 177.096 177.677 -0.581 26021 7019 1 11 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.490 2.594 26021 7020 1 11 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.594 -0.151 26021 7021 1 11 . 1 1 80 80 VAL H H 80 8.635 8.635 7.532 1.103 26021 7022 1 11 . 1 1 81 81 ASP N N 81 121.140 121.140 120.660 0.480 26021 7023 1 11 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.368 0.101 26021 7024 1 11 . 1 1 81 81 ASP C C 81 179.569 179.569 177.928 1.641 26021 7025 1 11 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.383 0.546 26021 7026 1 11 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.874 -0.939 26021 7027 1 11 . 1 1 81 81 ASP H H 81 8.575 8.575 8.478 0.097 26021 7028 1 11 . 1 1 82 82 LYS N N 82 118.159 118.159 118.114 0.045 26021 7029 1 11 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.040 -0.019 26021 7030 1 11 . 1 1 82 82 LYS C C 82 178.890 178.890 178.871 0.019 26021 7031 1 11 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.480 0.587 26021 7032 1 11 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.808 0.779 26021 7033 1 11 . 1 1 82 82 LYS H H 82 8.079 8.079 7.576 0.503 26021 7034 1 11 . 1 1 83 83 PHE N N 83 120.900 120.900 120.026 0.874 26021 7035 1 11 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.365 -0.089 26021 7036 1 11 . 1 1 83 83 PHE C C 83 177.269 177.269 176.654 0.615 26021 7037 1 11 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.459 0.484 26021 7038 1 11 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.510 0.237 26021 7039 1 11 . 1 1 83 83 PHE H H 83 8.015 8.015 7.808 0.207 26021 7040 1 11 . 1 1 84 84 LEU N N 84 118.209 118.209 119.040 -0.831 26021 7041 1 11 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.132 -0.190 26021 7042 1 11 . 1 1 84 84 LEU C C 84 178.774 178.774 177.951 0.823 26021 7043 1 11 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.337 0.832 26021 7044 1 11 . 1 1 84 84 LEU CB C 84 42.193 42.193 40.968 1.225 26021 7045 1 11 . 1 1 84 84 LEU H H 84 8.338 8.338 7.760 0.578 26021 7046 1 11 . 1 1 85 85 VAL N N 85 116.078 116.078 120.281 -4.203 26021 7047 1 11 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.766 0.225 26021 7048 1 11 . 1 1 85 85 VAL C C 85 177.252 177.252 177.071 0.181 26021 7049 1 11 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.362 -1.182 26021 7050 1 11 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.401 0.489 26021 7051 1 11 . 1 1 85 85 VAL H H 85 7.447 7.447 7.270 0.177 26021 7052 1 11 . 1 1 86 86 ARG N N 86 120.842 120.842 117.348 3.494 26021 7053 1 11 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.081 0.146 26021 7054 1 11 . 1 1 86 86 ARG C C 86 177.520 177.520 179.114 -1.594 26021 7055 1 11 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.559 -1.500 26021 7056 1 11 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.834 0.429 26021 7057 1 11 . 1 1 86 86 ARG H H 86 7.598 7.598 7.388 0.210 26021 7058 1 11 . 1 1 87 87 VAL N N 87 119.293 119.293 117.111 2.182 26021 7059 1 11 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.820 0.005 26021 7060 1 11 . 1 1 87 87 VAL C C 87 176.121 176.121 177.616 -1.495 26021 7061 1 11 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.287 -1.849 26021 7062 1 11 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.077 0.695 26021 7063 1 11 . 1 1 87 87 VAL H H 87 7.994 7.994 8.084 -0.090 26021 7064 1 11 . 1 1 88 88 HIS N N 88 120.016 120.016 117.812 2.204 26021 7065 1 11 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.427 0.210 26021 7066 1 11 . 1 1 88 88 HIS C C 88 175.639 175.639 176.124 -0.485 26021 7067 1 11 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.227 0.124 26021 7068 1 11 . 1 1 88 88 HIS CB C 88 29.681 29.681 29.913 -0.232 26021 7069 1 11 . 1 1 88 88 HIS H H 88 7.969 7.969 8.312 -0.343 26021 7070 1 11 . 1 1 89 89 GLY N N 89 109.587 109.587 108.626 0.961 26021 7071 1 11 . 1 1 89 89 GLY C C 89 173.730 173.730 174.344 -0.614 26021 7072 1 11 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.721 -0.552 26021 7073 1 11 . 1 1 89 89 GLY H H 89 8.083 8.083 8.039 0.044 26021 7074 1 11 . 1 1 90 90 VAL N N 90 118.224 118.224 120.789 -2.565 26021 7075 1 11 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.374 -0.236 26021 7076 1 11 . 1 1 90 90 VAL C C 90 176.018 176.018 174.708 1.310 26021 7077 1 11 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.192 2.233 26021 7078 1 11 . 1 1 90 90 VAL CB C 90 32.616 32.616 34.620 -2.004 26021 7079 1 11 . 1 1 90 90 VAL H H 90 7.944 7.944 7.346 0.598 26021 7080 1 11 . 1 1 91 91 GLU N N 91 124.313 124.313 126.178 -1.865 26021 7081 1 11 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.556 0.050 26021 7082 1 11 . 1 1 91 91 GLU CA C 91 54.176 54.176 53.599 0.577 26021 7083 1 11 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.109 0.651 26021 7084 1 11 . 1 1 91 91 GLU H H 91 8.423 8.423 8.420 0.003 26021 7085 1 11 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.487 -0.150 26021 7086 1 11 . 1 1 92 92 PRO C C 92 176.504 176.504 175.622 0.882 26021 7087 1 11 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.198 0.174 26021 7088 1 11 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.240 -0.073 26021 7089 1 11 . 1 1 93 93 ASP N N 93 120.275 120.275 121.960 -1.685 26021 7090 1 11 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.840 -0.268 26021 7091 1 11 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.447 0.523 26021 7092 1 11 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.936 -3.421 26021 7093 1 11 . 1 1 93 93 ASP H H 93 8.286 8.286 7.960 0.326 26021 7094 1 11 . 1 1 94 94 ASP N N 94 121.181 121.181 120.567 0.614 26021 7095 1 11 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.568 -0.003 26021 7096 1 11 . 1 1 94 94 ASP C C 94 176.474 176.474 177.799 -1.325 26021 7097 1 11 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.997 -1.624 26021 7098 1 11 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.533 -0.308 26021 7099 1 11 . 1 1 94 94 ASP H H 94 8.259 8.259 8.684 -0.425 26021 7100 1 11 . 1 1 95 95 ASN N N 95 118.728 118.728 119.063 -0.335 26021 7101 1 11 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.540 0.154 26021 7102 1 11 . 1 1 95 95 ASN C C 95 176.272 176.272 177.245 -0.973 26021 7103 1 11 . 1 1 95 95 ASN CA C 95 53.986 53.986 56.169 -2.183 26021 7104 1 11 . 1 1 95 95 ASN CB C 95 38.729 38.729 37.936 0.793 26021 7105 1 11 . 1 1 95 95 ASN H H 95 8.474 8.474 8.725 -0.251 26021 7106 1 11 . 1 1 96 96 THR N N 96 113.868 113.868 110.685 3.183 26021 7107 1 11 . 1 1 96 96 THR HA H 96 4.220 4.220 4.059 0.161 26021 7108 1 11 . 1 1 96 96 THR C C 96 175.107 175.107 175.876 -0.769 26021 7109 1 11 . 1 1 96 96 THR CA C 96 63.200 63.200 64.935 -1.735 26021 7110 1 11 . 1 1 96 96 THR CB C 96 69.475 69.475 68.245 1.230 26021 7111 1 11 . 1 1 96 96 THR H H 96 8.263 8.263 8.259 0.004 26021 7112 1 11 . 1 1 97 97 ASN N N 97 119.954 119.954 119.846 0.108 26021 7113 1 11 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.487 0.129 26021 7114 1 11 . 1 1 97 97 ASN C C 97 176.275 176.275 176.406 -0.131 26021 7115 1 11 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.763 -0.807 26021 7116 1 11 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.326 0.366 26021 7117 1 11 . 1 1 97 97 ASN H H 97 8.431 8.431 8.040 0.391 26021 7118 1 11 . 1 1 98 98 GLY N N 98 108.847 108.847 106.957 1.890 26021 7119 1 11 . 1 1 98 98 GLY C C 98 175.533 175.533 175.306 0.227 26021 7120 1 11 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.274 -0.263 26021 7121 1 11 . 1 1 98 98 GLY H H 98 8.338 8.338 7.879 0.459 26021 7122 1 11 . 1 1 99 99 PHE N N 99 118.492 118.492 119.921 -1.429 26021 7123 1 11 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.085 0.163 26021 7124 1 11 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.106 0.853 26021 7125 1 11 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.083 -0.924 26021 7126 1 11 . 1 1 99 99 PHE H H 99 8.370 8.370 8.613 -0.243 26021 7127 1 11 . 1 1 100 100 LYS N N 100 120.987 120.987 120.296 0.691 26021 7128 1 11 . 1 1 100 100 LYS H H 100 8.256 8.256 8.347 -0.091 26021 7129 1 11 . 1 1 101 101 GLY N N 101 108.186 108.186 106.374 1.812 26021 7130 1 11 . 1 1 101 101 GLY C C 101 177.075 177.075 175.817 1.258 26021 7131 1 11 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.096 0.805 26021 7132 1 11 . 1 1 101 101 GLY H H 101 8.300 8.300 7.578 0.722 26021 7133 1 11 . 1 1 102 102 LEU N N 102 121.439 121.439 123.620 -2.181 26021 7134 1 11 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.913 0.184 26021 7135 1 11 . 1 1 102 102 LEU C C 102 179.836 179.836 178.035 1.801 26021 7136 1 11 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.470 -0.112 26021 7137 1 11 . 1 1 102 102 LEU CB C 102 41.770 41.770 42.179 -0.409 26021 7138 1 11 . 1 1 102 102 LEU H H 102 7.777 7.777 7.591 0.186 26021 7139 1 11 . 1 1 103 103 MET N N 103 122.290 122.290 117.205 5.085 26021 7140 1 11 . 1 1 103 103 MET HA H 103 4.220 4.220 3.924 0.296 26021 7141 1 11 . 1 1 103 103 MET C C 103 177.739 177.739 177.882 -0.143 26021 7142 1 11 . 1 1 103 103 MET CA C 103 58.739 58.739 57.864 0.875 26021 7143 1 11 . 1 1 103 103 MET CB C 103 31.895 31.895 31.795 0.100 26021 7144 1 11 . 1 1 103 103 MET H H 103 8.409 8.409 7.976 0.433 26021 7145 1 11 . 1 1 104 104 LYS N N 104 119.750 119.750 118.020 1.730 26021 7146 1 11 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.082 -0.015 26021 7147 1 11 . 1 1 104 104 LYS C C 104 179.301 179.301 179.249 0.052 26021 7148 1 11 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.615 1.149 26021 7149 1 11 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.766 0.281 26021 7150 1 11 . 1 1 104 104 LYS H H 104 7.916 7.916 7.449 0.467 26021 7151 1 11 . 1 1 105 105 ARG N N 105 117.967 117.967 119.040 -1.073 26021 7152 1 11 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.087 -0.061 26021 7153 1 11 . 1 1 105 105 ARG C C 105 178.777 178.777 178.393 0.384 26021 7154 1 11 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.577 -0.213 26021 7155 1 11 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.356 0.641 26021 7156 1 11 . 1 1 105 105 ARG H H 105 7.719 7.719 8.051 -0.332 26021 7157 1 11 . 1 1 106 106 THR N N 106 117.211 117.211 112.610 4.601 26021 7158 1 11 . 1 1 106 106 THR HA H 106 4.301 4.301 4.235 0.066 26021 7159 1 11 . 1 1 106 106 THR C C 106 176.254 176.254 176.053 0.201 26021 7160 1 11 . 1 1 106 106 THR CA C 106 67.860 67.860 65.565 2.295 26021 7161 1 11 . 1 1 106 106 THR CB C 106 67.860 67.860 68.832 -0.971 26021 7162 1 11 . 1 1 106 106 THR H H 106 8.152 8.152 7.879 0.273 26021 7163 1 11 . 1 1 107 107 THR N N 107 117.939 117.939 116.551 1.388 26021 7164 1 11 . 1 1 107 107 THR HA H 107 3.971 3.971 3.929 0.042 26021 7165 1 11 . 1 1 107 107 THR C C 107 176.780 176.780 176.315 0.465 26021 7166 1 11 . 1 1 107 107 THR CA C 107 66.822 66.822 66.028 0.794 26021 7167 1 11 . 1 1 107 107 THR CB C 107 68.818 68.818 68.649 0.169 26021 7168 1 11 . 1 1 107 107 THR H H 107 8.651 8.651 7.763 0.888 26021 7169 1 11 . 1 1 108 108 LYS N N 108 120.867 120.867 120.745 0.122 26021 7170 1 11 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.088 -0.066 26021 7171 1 11 . 1 1 108 108 LYS C C 108 179.045 179.045 179.429 -0.384 26021 7172 1 11 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.291 0.543 26021 7173 1 11 . 1 1 108 108 LYS CB C 108 32.473 32.473 31.952 0.521 26021 7174 1 11 . 1 1 108 108 LYS H H 108 7.694 7.694 7.624 0.070 26021 7175 1 11 . 1 1 109 109 LEU N N 109 119.472 119.472 120.456 -0.984 26021 7176 1 11 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.314 0.007 26021 7177 1 11 . 1 1 109 109 LEU C C 109 179.974 179.974 179.653 0.321 26021 7178 1 11 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.535 0.058 26021 7179 1 11 . 1 1 109 109 LEU CB C 109 41.860 41.860 41.976 -0.116 26021 7180 1 11 . 1 1 109 109 LEU H H 109 7.559 7.559 7.445 0.114 26021 7181 1 11 . 1 1 110 110 LEU N N 110 121.832 121.832 120.552 1.280 26021 7182 1 11 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.064 0.127 26021 7183 1 11 . 1 1 110 110 LEU C C 110 178.101 178.101 178.533 -0.432 26021 7184 1 11 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.831 0.061 26021 7185 1 11 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.360 0.524 26021 7186 1 11 . 1 1 110 110 LEU H H 110 8.567 8.567 8.401 0.166 26021 7187 1 11 . 1 1 111 111 LYS N N 111 117.972 117.972 118.338 -0.366 26021 7188 1 11 . 1 1 111 111 LYS HA H 111 3.979 3.979 3.956 0.023 26021 7189 1 11 . 1 1 111 111 LYS C C 111 177.677 177.677 178.792 -1.115 26021 7190 1 11 . 1 1 111 111 LYS CA C 111 58.785 58.785 59.113 -0.328 26021 7191 1 11 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.804 0.405 26021 7192 1 11 . 1 1 111 111 LYS H H 111 7.965 7.965 8.066 -0.101 26021 7193 1 11 . 1 1 112 112 LYS N N 112 115.433 115.433 119.309 -3.876 26021 7194 1 11 . 1 1 112 112 LYS HA H 112 4.110 4.110 3.976 0.134 26021 7195 1 11 . 1 1 112 112 LYS C C 112 178.270 178.270 178.446 -0.176 26021 7196 1 11 . 1 1 112 112 LYS CA C 112 58.951 58.951 59.200 -0.249 26021 7197 1 11 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.050 0.741 26021 7198 1 11 . 1 1 112 112 LYS H H 112 7.334 7.334 7.521 -0.187 26021 7199 1 11 . 1 1 113 113 VAL N N 113 114.861 114.861 115.173 -0.312 26021 7200 1 11 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.995 -0.164 26021 7201 1 11 . 1 1 113 113 VAL C C 113 176.999 176.999 176.943 0.056 26021 7202 1 11 . 1 1 113 113 VAL CA C 113 63.505 63.505 64.423 -0.918 26021 7203 1 11 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.751 0.536 26021 7204 1 11 . 1 1 113 113 VAL H H 113 7.298 7.298 7.596 -0.298 26021 7205 1 11 . 1 1 114 114 VAL N N 114 121.457 121.457 122.284 -0.827 26021 7206 1 11 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.651 0.071 26021 7207 1 11 . 1 1 114 114 VAL C C 114 177.737 177.737 178.116 -0.379 26021 7208 1 11 . 1 1 114 114 VAL CA C 114 65.224 65.224 67.125 -1.901 26021 7209 1 11 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.246 0.507 26021 7210 1 11 . 1 1 114 114 VAL H H 114 7.855 7.855 7.914 -0.059 26021 7211 1 11 . 1 1 115 115 ASP N N 115 120.804 120.804 118.823 1.981 26021 7212 1 11 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.445 0.010 26021 7213 1 11 . 1 1 115 115 ASP C C 115 177.380 177.380 176.893 0.487 26021 7214 1 11 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.395 -0.473 26021 7215 1 11 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.723 -0.351 26021 7216 1 11 . 1 1 115 115 ASP H H 115 8.311 8.311 7.833 0.478 26021 7217 1 11 . 1 1 116 116 LYS N N 116 119.582 119.582 118.557 1.025 26021 7218 1 11 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.072 0.023 26021 7219 1 11 . 1 1 116 116 LYS C C 116 177.077 177.077 177.801 -0.724 26021 7220 1 11 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.869 -0.158 26021 7221 1 11 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.685 -0.197 26021 7222 1 11 . 1 1 116 116 LYS H H 116 7.639 7.639 7.502 0.137 26021 7223 1 11 . 1 1 117 117 HIS N N 117 115.246 115.246 112.351 2.895 26021 7224 1 11 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.796 -0.171 26021 7225 1 11 . 1 1 117 117 HIS C C 117 175.497 175.497 175.800 -0.303 26021 7226 1 11 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.510 -0.335 26021 7227 1 11 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.361 -1.885 26021 7228 1 11 . 1 1 117 117 HIS H H 117 8.108 8.108 8.377 -0.269 26021 7229 1 11 . 1 1 118 118 GLY N N 118 109.944 109.944 109.117 0.827 26021 7230 1 11 . 1 1 118 118 GLY C C 118 174.093 174.093 174.106 -0.013 26021 7231 1 11 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.990 1.074 26021 7232 1 11 . 1 1 118 118 GLY H H 118 8.153 8.153 7.769 0.384 26021 7233 1 11 . 1 1 119 119 ILE N N 119 118.468 118.468 122.108 -3.640 26021 7234 1 11 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.900 0.222 26021 7235 1 11 . 1 1 119 119 ILE C C 119 174.777 174.777 176.403 -1.626 26021 7236 1 11 . 1 1 119 119 ILE CA C 119 61.101 61.101 60.949 0.152 26021 7237 1 11 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.960 1.671 26021 7238 1 11 . 1 1 119 119 ILE H H 119 7.828 7.828 7.754 0.074 26021 7239 1 12 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.675 0.074 26021 7240 1 12 . 1 1 4 4 ASN C C 4 175.260 175.260 175.698 -0.438 26021 7241 1 12 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.105 -0.274 26021 7242 1 12 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.597 0.084 26021 7243 1 12 . 1 1 5 5 ALA N N 5 123.648 123.648 122.303 1.345 26021 7244 1 12 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.642 -0.352 26021 7245 1 12 . 1 1 5 5 ALA C C 5 178.256 178.256 178.545 -0.289 26021 7246 1 12 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.904 1.177 26021 7247 1 12 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.889 0.136 26021 7248 1 12 . 1 1 5 5 ALA H H 5 8.520 8.520 8.166 0.354 26021 7249 1 12 . 1 1 6 6 GLY N N 6 107.044 107.044 107.983 -0.939 26021 7250 1 12 . 1 1 6 6 GLY C C 6 174.961 174.961 175.524 -0.563 26021 7251 1 12 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.856 -1.026 26021 7252 1 12 . 1 1 6 6 GLY H H 6 8.350 8.350 7.916 0.434 26021 7253 1 12 . 1 1 7 7 ALA N N 7 123.366 123.366 123.385 -0.019 26021 7254 1 12 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.153 0.063 26021 7255 1 12 . 1 1 7 7 ALA C C 7 179.006 179.006 178.788 0.218 26021 7256 1 12 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.384 -0.681 26021 7257 1 12 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.436 0.408 26021 7258 1 12 . 1 1 7 7 ALA H H 7 8.078 8.078 8.152 -0.075 26021 7259 1 12 . 1 1 8 8 ILE N N 8 117.376 117.376 118.649 -1.273 26021 7260 1 12 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.698 0.082 26021 7261 1 12 . 1 1 8 8 ILE C C 8 177.032 177.032 178.169 -1.137 26021 7262 1 12 . 1 1 8 8 ILE CA C 8 63.158 63.158 63.957 -0.799 26021 7263 1 12 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.073 -1.784 26021 7264 1 12 . 1 1 8 8 ILE H H 8 7.943 7.943 7.381 0.562 26021 7265 1 12 . 1 1 9 9 ALA N N 9 121.414 121.414 122.766 -1.352 26021 7266 1 12 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.024 -0.091 26021 7267 1 12 . 1 1 9 9 ALA C C 9 180.515 180.515 179.044 1.471 26021 7268 1 12 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.760 0.339 26021 7269 1 12 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.151 0.010 26021 7270 1 12 . 1 1 9 9 ALA H H 9 8.062 8.062 8.001 0.061 26021 7271 1 12 . 1 1 10 10 LYS N N 10 114.594 114.594 118.912 -4.318 26021 7272 1 12 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.116 0.048 26021 7273 1 12 . 1 1 10 10 LYS C C 10 178.099 178.099 178.086 0.013 26021 7274 1 12 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.397 -0.557 26021 7275 1 12 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.320 0.149 26021 7276 1 12 . 1 1 10 10 LYS H H 10 7.554 7.554 7.757 -0.203 26021 7277 1 12 . 1 1 11 11 LEU N N 11 119.662 119.662 118.471 1.191 26021 7278 1 12 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.140 -0.062 26021 7279 1 12 . 1 1 11 11 LEU C C 11 177.930 177.930 177.936 -0.006 26021 7280 1 12 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.206 0.350 26021 7281 1 12 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.800 1.288 26021 7282 1 12 . 1 1 11 11 LEU H H 11 7.814 7.814 7.399 0.415 26021 7283 1 12 . 1 1 12 12 ILE N N 12 117.945 117.945 120.571 -2.626 26021 7284 1 12 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.900 -0.208 26021 7285 1 12 . 1 1 12 12 ILE CA C 12 67.629 67.629 65.891 1.738 26021 7286 1 12 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.761 1.649 26021 7287 1 12 . 1 1 12 12 ILE H H 12 7.426 7.426 7.473 -0.047 26021 7288 1 12 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.280 0.123 26021 7289 1 12 . 1 1 13 13 PRO C C 13 179.030 179.030 178.564 0.466 26021 7290 1 12 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.020 0.224 26021 7291 1 12 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.143 -0.334 26021 7292 1 12 . 1 1 14 14 LYS N N 14 117.855 117.855 119.315 -1.460 26021 7293 1 12 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.032 0.113 26021 7294 1 12 . 1 1 14 14 LYS C C 14 178.565 178.565 179.723 -1.158 26021 7295 1 12 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.531 -0.098 26021 7296 1 12 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.129 0.796 26021 7297 1 12 . 1 1 14 14 LYS H H 14 6.685 6.685 7.333 -0.648 26021 7298 1 12 . 1 1 15 15 LEU N N 15 118.008 118.008 117.955 0.053 26021 7299 1 12 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.176 -0.173 26021 7300 1 12 . 1 1 15 15 LEU C C 15 178.662 178.662 179.112 -0.450 26021 7301 1 12 . 1 1 15 15 LEU CA C 15 57.712 57.712 57.182 0.530 26021 7302 1 12 . 1 1 15 15 LEU CB C 15 41.999 41.999 41.805 0.194 26021 7303 1 12 . 1 1 15 15 LEU H H 15 8.148 8.148 7.692 0.456 26021 7304 1 12 . 1 1 16 16 GLY N N 16 103.895 103.895 106.626 -2.731 26021 7305 1 12 . 1 1 16 16 GLY C C 16 176.838 176.838 175.144 1.694 26021 7306 1 12 . 1 1 16 16 GLY CA C 16 47.365 47.365 46.617 0.748 26021 7307 1 12 . 1 1 16 16 GLY H H 16 8.104 8.104 7.837 0.267 26021 7308 1 12 . 1 1 17 17 GLU N N 17 121.655 121.655 121.451 0.204 26021 7309 1 12 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.121 0.012 26021 7310 1 12 . 1 1 17 17 GLU C C 17 179.007 179.007 178.133 0.874 26021 7311 1 12 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.104 -0.293 26021 7312 1 12 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.596 -0.463 26021 7313 1 12 . 1 1 17 17 GLU H H 17 7.817 7.817 7.527 0.289 26021 7314 1 12 . 1 1 18 18 LEU N N 18 117.834 117.834 117.326 0.508 26021 7315 1 12 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.326 -0.208 26021 7316 1 12 . 1 1 18 18 LEU C C 18 177.658 177.658 177.990 -0.332 26021 7317 1 12 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.863 1.166 26021 7318 1 12 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.875 -0.205 26021 7319 1 12 . 1 1 18 18 LEU H H 18 7.389 7.389 7.531 -0.142 26021 7320 1 12 . 1 1 19 19 LEU N N 19 113.694 113.694 118.185 -4.491 26021 7321 1 12 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.434 -0.272 26021 7322 1 12 . 1 1 19 19 LEU C C 19 178.123 178.123 178.961 -0.838 26021 7323 1 12 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.661 0.191 26021 7324 1 12 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.940 0.280 26021 7325 1 12 . 1 1 19 19 LEU H H 19 7.269 7.269 7.686 -0.417 26021 7326 1 12 . 1 1 20 20 VAL N N 20 112.778 112.778 115.471 -2.693 26021 7327 1 12 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.082 0.361 26021 7328 1 12 . 1 1 20 20 VAL C C 20 177.021 177.021 176.610 0.411 26021 7329 1 12 . 1 1 20 20 VAL CA C 20 61.855 61.855 64.186 -2.332 26021 7330 1 12 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.125 0.653 26021 7331 1 12 . 1 1 20 20 VAL H H 20 7.356 7.356 7.653 -0.297 26021 7332 1 12 . 1 1 21 21 GLY N N 21 108.962 108.962 108.490 0.472 26021 7333 1 12 . 1 1 21 21 GLY C C 21 173.813 173.813 173.656 0.157 26021 7334 1 12 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.738 0.308 26021 7335 1 12 . 1 1 21 21 GLY H H 21 7.925 7.925 8.308 -0.383 26021 7336 1 12 . 1 1 22 22 GLU N N 22 120.607 120.607 120.917 -0.310 26021 7337 1 12 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.513 -0.235 26021 7338 1 12 . 1 1 22 22 GLU C C 22 175.869 175.869 175.352 0.517 26021 7339 1 12 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.248 0.782 26021 7340 1 12 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.300 -0.619 26021 7341 1 12 . 1 1 22 22 GLU H H 22 8.300 8.300 8.395 -0.095 26021 7342 1 12 . 1 1 23 23 TYR N N 23 120.738 120.738 120.173 0.565 26021 7343 1 12 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.005 -0.448 26021 7344 1 12 . 1 1 23 23 TYR C C 23 175.264 175.264 174.307 0.957 26021 7345 1 12 . 1 1 23 23 TYR CA C 23 57.561 57.561 56.536 1.025 26021 7346 1 12 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.317 -0.071 26021 7347 1 12 . 1 1 23 23 TYR H H 23 7.756 7.756 7.437 0.319 26021 7348 1 12 . 1 1 24 24 LYS N N 24 122.095 122.095 121.222 0.873 26021 7349 1 12 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.589 -0.406 26021 7350 1 12 . 1 1 24 24 LYS C C 24 175.742 175.742 174.804 0.938 26021 7351 1 12 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.185 -0.067 26021 7352 1 12 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.178 0.541 26021 7353 1 12 . 1 1 24 24 LYS H H 24 8.692 8.692 8.492 0.200 26021 7354 1 12 . 1 1 25 25 LEU N N 25 121.123 121.123 118.987 2.136 26021 7355 1 12 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.598 -0.106 26021 7356 1 12 . 1 1 25 25 LEU C C 25 177.487 177.487 175.859 1.628 26021 7357 1 12 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.765 0.569 26021 7358 1 12 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.716 -0.958 26021 7359 1 12 . 1 1 25 25 LEU H H 25 8.088 8.088 7.670 0.418 26021 7360 1 12 . 1 1 26 26 HIS N N 26 122.993 122.993 119.225 3.768 26021 7361 1 12 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.644 -0.143 26021 7362 1 12 . 1 1 26 26 HIS C C 26 176.716 176.716 176.087 0.629 26021 7363 1 12 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.599 0.598 26021 7364 1 12 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.945 0.412 26021 7365 1 12 . 1 1 26 26 HIS H H 26 8.882 8.882 8.496 0.386 26021 7366 1 12 . 1 1 27 27 LYS N N 27 124.894 124.894 124.190 0.704 26021 7367 1 12 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.177 -0.229 26021 7368 1 12 . 1 1 27 27 LYS C C 27 178.873 178.873 178.588 0.285 26021 7369 1 12 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.814 1.197 26021 7370 1 12 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.430 0.012 26021 7371 1 12 . 1 1 27 27 LYS H H 27 8.699 8.699 7.988 0.711 26021 7372 1 12 . 1 1 28 28 GLY N N 28 111.258 111.258 107.632 3.626 26021 7373 1 12 . 1 1 28 28 GLY C C 28 176.131 176.131 176.079 0.052 26021 7374 1 12 . 1 1 28 28 GLY CA C 28 46.490 46.490 47.052 -0.562 26021 7375 1 12 . 1 1 28 28 GLY H H 28 9.814 9.814 7.836 1.978 26021 7376 1 12 . 1 1 29 29 VAL N N 29 122.719 122.719 122.357 0.362 26021 7377 1 12 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.607 0.285 26021 7378 1 12 . 1 1 29 29 VAL C C 29 177.628 177.628 177.691 -0.063 26021 7379 1 12 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.440 0.080 26021 7380 1 12 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.050 0.692 26021 7381 1 12 . 1 1 29 29 VAL H H 29 7.431 7.431 7.455 -0.024 26021 7382 1 12 . 1 1 30 30 LYS N N 30 119.791 119.791 119.616 0.175 26021 7383 1 12 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.984 -0.349 26021 7384 1 12 . 1 1 30 30 LYS C C 30 177.666 177.666 179.058 -1.392 26021 7385 1 12 . 1 1 30 30 LYS CA C 30 61.024 61.024 60.141 0.883 26021 7386 1 12 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.881 0.524 26021 7387 1 12 . 1 1 30 30 LYS H H 30 8.255 8.255 8.171 0.084 26021 7388 1 12 . 1 1 31 31 LYS N N 31 117.918 117.918 117.863 0.055 26021 7389 1 12 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.245 -0.129 26021 7390 1 12 . 1 1 31 31 LYS C C 31 177.784 177.784 178.972 -1.188 26021 7391 1 12 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.456 -0.753 26021 7392 1 12 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.262 -0.417 26021 7393 1 12 . 1 1 31 31 LYS H H 31 7.689 7.689 7.995 -0.306 26021 7394 1 12 . 1 1 32 32 ASN N N 32 116.347 116.347 117.659 -1.312 26021 7395 1 12 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.434 0.086 26021 7396 1 12 . 1 1 32 32 ASN C C 32 177.764 177.764 177.429 0.335 26021 7397 1 12 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.827 0.488 26021 7398 1 12 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.672 -0.040 26021 7399 1 12 . 1 1 32 32 ASN H H 32 7.556 7.556 7.736 -0.180 26021 7400 1 12 . 1 1 33 33 ILE N N 33 120.592 120.592 120.193 0.399 26021 7401 1 12 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.792 -0.510 26021 7402 1 12 . 1 1 33 33 ILE C C 33 177.074 177.074 177.640 -0.566 26021 7403 1 12 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.608 2.280 26021 7404 1 12 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.132 0.046 26021 7405 1 12 . 1 1 33 33 ILE H H 33 8.236 8.236 8.270 -0.034 26021 7406 1 12 . 1 1 34 34 GLU N N 34 120.595 120.595 119.921 0.674 26021 7407 1 12 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.843 -0.055 26021 7408 1 12 . 1 1 34 34 GLU C C 34 179.739 179.739 178.388 1.351 26021 7409 1 12 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.720 0.519 26021 7410 1 12 . 1 1 34 34 GLU CB C 34 29.845 29.845 29.000 0.845 26021 7411 1 12 . 1 1 34 34 GLU H H 34 8.551 8.551 8.757 -0.206 26021 7412 1 12 . 1 1 35 35 ASP N N 35 120.600 120.600 120.205 0.395 26021 7413 1 12 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.476 -0.064 26021 7414 1 12 . 1 1 35 35 ASP C C 35 178.681 178.681 178.544 0.137 26021 7415 1 12 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.900 0.562 26021 7416 1 12 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.605 -0.855 26021 7417 1 12 . 1 1 35 35 ASP H H 35 8.670 8.670 7.730 0.940 26021 7418 1 12 . 1 1 36 36 LEU N N 36 123.004 123.004 119.852 3.152 26021 7419 1 12 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.050 0.045 26021 7420 1 12 . 1 1 36 36 LEU C C 36 178.035 178.035 178.757 -0.722 26021 7421 1 12 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.595 0.433 26021 7422 1 12 . 1 1 36 36 LEU CB C 36 41.876 41.876 41.877 -0.001 26021 7423 1 12 . 1 1 36 36 LEU H H 36 8.166 8.166 7.647 0.519 26021 7424 1 12 . 1 1 37 37 LEU N N 37 120.178 120.178 119.901 0.277 26021 7425 1 12 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.074 -0.218 26021 7426 1 12 . 1 1 37 37 LEU C C 37 178.128 178.128 178.145 -0.017 26021 7427 1 12 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.627 1.048 26021 7428 1 12 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.495 0.660 26021 7429 1 12 . 1 1 37 37 LEU H H 37 8.736 8.736 7.741 0.995 26021 7430 1 12 . 1 1 38 38 LYS N N 38 118.110 118.110 119.212 -1.102 26021 7431 1 12 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.904 0.029 26021 7432 1 12 . 1 1 38 38 LYS C C 38 179.533 179.533 179.183 0.350 26021 7433 1 12 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.103 0.170 26021 7434 1 12 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.001 0.276 26021 7435 1 12 . 1 1 38 38 LYS H H 38 7.770 7.770 7.919 -0.149 26021 7436 1 12 . 1 1 39 39 GLU N N 39 119.265 119.265 118.147 1.118 26021 7437 1 12 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.178 0.124 26021 7438 1 12 . 1 1 39 39 GLU C C 39 179.720 179.720 179.072 0.648 26021 7439 1 12 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.549 0.209 26021 7440 1 12 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.510 0.080 26021 7441 1 12 . 1 1 39 39 GLU H H 39 7.709 7.709 7.597 0.112 26021 7442 1 12 . 1 1 40 40 LEU N N 40 119.007 119.007 120.835 -1.828 26021 7443 1 12 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.105 -0.055 26021 7444 1 12 . 1 1 40 40 LEU C C 40 179.690 179.690 178.993 0.697 26021 7445 1 12 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.002 0.649 26021 7446 1 12 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.977 0.708 26021 7447 1 12 . 1 1 40 40 LEU H H 40 8.851 8.851 7.998 0.853 26021 7448 1 12 . 1 1 41 41 LYS N N 41 120.500 120.500 119.496 1.004 26021 7449 1 12 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.041 -0.089 26021 7450 1 12 . 1 1 41 41 LYS C C 41 180.223 180.223 179.183 1.040 26021 7451 1 12 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.592 1.299 26021 7452 1 12 . 1 1 41 41 LYS CB C 41 32.067 32.067 31.950 0.117 26021 7453 1 12 . 1 1 41 41 LYS H H 41 8.482 8.482 8.170 0.312 26021 7454 1 12 . 1 1 42 42 THR N N 42 119.555 119.555 114.948 4.607 26021 7455 1 12 . 1 1 42 42 THR HA H 42 4.000 4.000 4.128 -0.128 26021 7456 1 12 . 1 1 42 42 THR C C 42 176.633 176.633 176.739 -0.106 26021 7457 1 12 . 1 1 42 42 THR CA C 42 66.574 66.574 65.040 1.534 26021 7458 1 12 . 1 1 42 42 THR CB C 42 67.924 67.924 68.693 -0.769 26021 7459 1 12 . 1 1 42 42 THR H H 42 7.863 7.863 7.474 0.389 26021 7460 1 12 . 1 1 43 43 MET N N 43 122.839 122.839 120.190 2.649 26021 7461 1 12 . 1 1 43 43 MET HA H 43 4.022 4.022 4.062 -0.040 26021 7462 1 12 . 1 1 43 43 MET C C 43 177.290 177.290 177.945 -0.655 26021 7463 1 12 . 1 1 43 43 MET CA C 43 59.731 59.731 59.281 0.450 26021 7464 1 12 . 1 1 43 43 MET CB C 43 33.610 33.610 31.606 2.004 26021 7465 1 12 . 1 1 43 43 MET H H 43 8.714 8.714 7.933 0.781 26021 7466 1 12 . 1 1 44 44 ASN N N 44 118.049 118.049 117.289 0.760 26021 7467 1 12 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.310 0.064 26021 7468 1 12 . 1 1 44 44 ASN C C 44 176.297 176.297 177.349 -1.052 26021 7469 1 12 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.411 0.483 26021 7470 1 12 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.807 0.599 26021 7471 1 12 . 1 1 44 44 ASN H H 44 8.988 8.988 7.740 1.248 26021 7472 1 12 . 1 1 45 45 ALA N N 45 119.260 119.260 121.759 -2.499 26021 7473 1 12 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.170 -0.104 26021 7474 1 12 . 1 1 45 45 ALA C C 45 180.476 180.476 179.074 1.402 26021 7475 1 12 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.405 0.863 26021 7476 1 12 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.270 -0.582 26021 7477 1 12 . 1 1 45 45 ALA H H 45 7.675 7.675 7.328 0.347 26021 7478 1 12 . 1 1 46 46 ALA N N 46 121.126 121.126 122.669 -1.543 26021 7479 1 12 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.018 0.098 26021 7480 1 12 . 1 1 46 46 ALA C C 46 179.314 179.314 179.141 0.173 26021 7481 1 12 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.370 -0.384 26021 7482 1 12 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.566 -0.344 26021 7483 1 12 . 1 1 46 46 ALA H H 46 7.872 7.872 7.700 0.172 26021 7484 1 12 . 1 1 47 47 LEU N N 47 119.328 119.328 116.315 3.013 26021 7485 1 12 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.970 0.221 26021 7486 1 12 . 1 1 47 47 LEU C C 47 180.403 180.403 178.521 1.882 26021 7487 1 12 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.984 0.062 26021 7488 1 12 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.357 0.593 26021 7489 1 12 . 1 1 47 47 LEU H H 47 8.529 8.529 7.559 0.970 26021 7490 1 12 . 1 1 48 48 ILE N N 48 121.653 121.653 118.193 3.460 26021 7491 1 12 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.708 -0.006 26021 7492 1 12 . 1 1 48 48 ILE C C 48 178.730 178.730 177.650 1.080 26021 7493 1 12 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.329 0.581 26021 7494 1 12 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.728 0.184 26021 7495 1 12 . 1 1 48 48 ILE H H 48 8.386 8.386 7.094 1.292 26021 7496 1 12 . 1 1 49 49 LYS N N 49 119.896 119.896 119.329 0.567 26021 7497 1 12 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.173 -0.130 26021 7498 1 12 . 1 1 49 49 LYS C C 49 179.999 179.999 179.182 0.817 26021 7499 1 12 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.189 -0.132 26021 7500 1 12 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.775 -0.814 26021 7501 1 12 . 1 1 49 49 LYS H H 49 7.456 7.456 7.661 -0.205 26021 7502 1 12 . 1 1 50 50 ILE N N 50 119.964 119.964 114.568 5.396 26021 7503 1 12 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.222 -0.486 26021 7504 1 12 . 1 1 50 50 ILE C C 50 177.960 177.960 177.155 0.805 26021 7505 1 12 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.558 0.791 26021 7506 1 12 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.963 0.169 26021 7507 1 12 . 1 1 50 50 ILE H H 50 8.154 8.154 8.520 -0.366 26021 7508 1 12 . 1 1 51 51 GLY N N 51 106.709 106.709 106.241 0.468 26021 7509 1 12 . 1 1 51 51 GLY C C 51 174.461 174.461 174.340 0.121 26021 7510 1 12 . 1 1 51 51 GLY CA C 51 45.909 45.909 44.787 1.122 26021 7511 1 12 . 1 1 51 51 GLY H H 51 7.932 7.932 7.653 0.279 26021 7512 1 12 . 1 1 52 52 GLU N N 52 118.736 118.736 120.125 -1.389 26021 7513 1 12 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.424 -0.104 26021 7514 1 12 . 1 1 52 52 GLU C C 52 176.789 176.789 176.522 0.267 26021 7515 1 12 . 1 1 52 52 GLU CA C 52 56.274 56.274 56.809 -0.534 26021 7516 1 12 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.697 -0.585 26021 7517 1 12 . 1 1 52 52 GLU H H 52 7.597 7.597 7.758 -0.161 26021 7518 1 12 . 1 1 53 53 VAL N N 53 122.982 122.982 117.874 5.108 26021 7519 1 12 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.482 -0.221 26021 7520 1 12 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.697 1.688 26021 7521 1 12 . 1 1 53 53 VAL CB C 53 32.822 32.822 32.090 0.732 26021 7522 1 12 . 1 1 53 53 VAL H H 53 7.511 7.511 7.505 0.006 26021 7523 1 12 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.704 -0.059 26021 7524 1 12 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.559 0.020 26021 7525 1 12 . 1 1 54 54 PRO CB C 54 31.535 31.535 30.697 0.838 26021 7526 1 12 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.337 -0.146 26021 7527 1 12 . 1 1 55 55 PRO C C 55 178.258 178.258 178.047 0.211 26021 7528 1 12 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.776 0.652 26021 7529 1 12 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.729 0.117 26021 7530 1 12 . 1 1 56 56 ASP N N 56 114.117 114.117 119.712 -5.595 26021 7531 1 12 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.461 0.030 26021 7532 1 12 . 1 1 56 56 ASP C C 56 176.696 176.696 176.911 -0.215 26021 7533 1 12 . 1 1 56 56 ASP CA C 56 55.138 55.138 56.299 -1.161 26021 7534 1 12 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.647 -0.921 26021 7535 1 12 . 1 1 56 56 ASP H H 56 8.489 8.489 8.793 -0.304 26021 7536 1 12 . 1 1 57 57 GLN N N 57 117.641 117.641 114.998 2.643 26021 7537 1 12 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.484 -0.110 26021 7538 1 12 . 1 1 57 57 GLN C C 57 175.765 175.765 175.488 0.277 26021 7539 1 12 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.017 0.273 26021 7540 1 12 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.430 0.216 26021 7541 1 12 . 1 1 57 57 GLN H H 57 8.206 8.206 7.690 0.516 26021 7542 1 12 . 1 1 58 58 LEU N N 58 122.141 122.141 123.049 -0.908 26021 7543 1 12 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.409 0.041 26021 7544 1 12 . 1 1 58 58 LEU C C 58 176.849 176.849 176.185 0.664 26021 7545 1 12 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.370 0.625 26021 7546 1 12 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.644 0.587 26021 7547 1 12 . 1 1 58 58 LEU H H 58 7.152 7.152 7.531 -0.379 26021 7548 1 12 . 1 1 59 59 ASP N N 59 125.643 125.643 121.038 4.605 26021 7549 1 12 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.827 -0.108 26021 7550 1 12 . 1 1 59 59 ASP C C 59 177.249 177.249 177.126 0.123 26021 7551 1 12 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.852 0.551 26021 7552 1 12 . 1 1 59 59 ASP CB C 59 42.232 42.232 44.022 -1.790 26021 7553 1 12 . 1 1 59 59 ASP H H 59 9.312 9.312 8.495 0.817 26021 7554 1 12 . 1 1 60 60 SER N N 60 116.550 116.550 116.856 -0.306 26021 7555 1 12 . 1 1 60 60 SER HA H 60 4.124 4.124 4.228 -0.104 26021 7556 1 12 . 1 1 60 60 SER C C 60 176.840 176.840 176.152 0.688 26021 7557 1 12 . 1 1 60 60 SER CA C 60 61.722 61.722 61.206 0.516 26021 7558 1 12 . 1 1 60 60 SER CB C 60 62.815 62.815 63.427 -0.612 26021 7559 1 12 . 1 1 60 60 SER H H 60 8.647 8.647 8.627 0.020 26021 7560 1 12 . 1 1 61 61 GLN N N 61 121.394 121.394 120.818 0.576 26021 7561 1 12 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.144 -0.013 26021 7562 1 12 . 1 1 61 61 GLN C C 61 178.629 178.629 177.602 1.027 26021 7563 1 12 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.683 0.070 26021 7564 1 12 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.577 -0.324 26021 7565 1 12 . 1 1 61 61 GLN H H 61 8.453 8.453 8.404 0.049 26021 7566 1 12 . 1 1 62 62 ASP N N 62 122.187 122.187 117.966 4.221 26021 7567 1 12 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.434 0.185 26021 7568 1 12 . 1 1 62 62 ASP C C 62 178.318 178.318 178.301 0.017 26021 7569 1 12 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.914 -0.452 26021 7570 1 12 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.227 0.809 26021 7571 1 12 . 1 1 62 62 ASP H H 62 8.311 8.311 8.687 -0.376 26021 7572 1 12 . 1 1 63 63 LYS N N 63 120.325 120.325 118.589 1.736 26021 7573 1 12 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.174 -0.165 26021 7574 1 12 . 1 1 63 63 LYS C C 63 178.765 178.765 178.917 -0.152 26021 7575 1 12 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.345 1.408 26021 7576 1 12 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.087 0.366 26021 7577 1 12 . 1 1 63 63 LYS H H 63 7.923 7.923 7.645 0.278 26021 7578 1 12 . 1 1 64 64 LEU N N 64 119.491 119.491 119.767 -0.276 26021 7579 1 12 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.131 0.095 26021 7580 1 12 . 1 1 64 64 LEU C C 64 179.526 179.526 178.813 0.713 26021 7581 1 12 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.925 -0.127 26021 7582 1 12 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.793 -0.018 26021 7583 1 12 . 1 1 64 64 LEU H H 64 7.820 7.820 7.720 0.100 26021 7584 1 12 . 1 1 65 65 TRP N N 65 120.674 120.674 121.521 -0.847 26021 7585 1 12 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.283 0.025 26021 7586 1 12 . 1 1 65 65 TRP C C 65 177.379 177.379 177.339 0.040 26021 7587 1 12 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.942 0.860 26021 7588 1 12 . 1 1 65 65 TRP CB C 65 28.411 28.411 29.210 -0.800 26021 7589 1 12 . 1 1 65 65 TRP H H 65 8.196 8.196 7.672 0.524 26021 7590 1 12 . 1 1 66 66 ALA N N 66 120.606 120.606 120.298 0.308 26021 7591 1 12 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.469 0.240 26021 7592 1 12 . 1 1 66 66 ALA C C 66 180.376 180.376 179.522 0.854 26021 7593 1 12 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.743 0.821 26021 7594 1 12 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.943 -0.289 26021 7595 1 12 . 1 1 66 66 ALA H H 66 8.305 8.305 7.716 0.589 26021 7596 1 12 . 1 1 67 67 ASP N N 67 119.175 119.175 118.283 0.892 26021 7597 1 12 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.331 0.119 26021 7598 1 12 . 1 1 67 67 ASP C C 67 178.757 178.757 177.812 0.945 26021 7599 1 12 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.640 0.852 26021 7600 1 12 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.861 -0.707 26021 7601 1 12 . 1 1 67 67 ASP H H 67 7.945 7.945 7.675 0.270 26021 7602 1 12 . 1 1 68 68 GLU N N 68 122.322 122.322 119.359 2.963 26021 7603 1 12 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.245 -0.230 26021 7604 1 12 . 1 1 68 68 GLU C C 68 180.055 180.055 179.034 1.021 26021 7605 1 12 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.266 0.844 26021 7606 1 12 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.415 0.233 26021 7607 1 12 . 1 1 68 68 GLU H H 68 8.168 8.168 7.509 0.659 26021 7608 1 12 . 1 1 69 69 VAL N N 69 122.135 122.135 117.520 4.615 26021 7609 1 12 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.623 -0.371 26021 7610 1 12 . 1 1 69 69 VAL C C 69 177.736 177.736 178.144 -0.408 26021 7611 1 12 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.867 0.672 26021 7612 1 12 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.195 0.047 26021 7613 1 12 . 1 1 69 69 VAL H H 69 8.424 8.424 7.151 1.273 26021 7614 1 12 . 1 1 70 70 ARG N N 70 121.373 121.373 119.518 1.855 26021 7615 1 12 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.895 -0.203 26021 7616 1 12 . 1 1 70 70 ARG C C 70 179.117 179.117 178.690 0.427 26021 7617 1 12 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.922 1.243 26021 7618 1 12 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.815 -0.161 26021 7619 1 12 . 1 1 70 70 ARG H H 70 7.916 7.916 7.286 0.630 26021 7620 1 12 . 1 1 71 71 GLU N N 71 119.075 119.075 120.367 -1.292 26021 7621 1 12 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.682 0.381 26021 7622 1 12 . 1 1 71 71 GLU C C 71 179.119 179.119 178.704 0.415 26021 7623 1 12 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.937 0.750 26021 7624 1 12 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.884 0.386 26021 7625 1 12 . 1 1 71 71 GLU H H 71 8.031 8.031 8.538 -0.507 26021 7626 1 12 . 1 1 72 72 LEU N N 72 120.503 120.503 120.955 -0.452 26021 7627 1 12 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.042 0.015 26021 7628 1 12 . 1 1 72 72 LEU C C 72 178.734 178.734 178.497 0.237 26021 7629 1 12 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.004 0.418 26021 7630 1 12 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.828 -0.420 26021 7631 1 12 . 1 1 72 72 LEU H H 72 8.175 8.175 7.545 0.630 26021 7632 1 12 . 1 1 73 73 SER N N 73 115.243 115.243 115.631 -0.388 26021 7633 1 12 . 1 1 73 73 SER HA H 73 3.824 3.824 4.008 -0.184 26021 7634 1 12 . 1 1 73 73 SER C C 73 175.697 175.697 176.418 -0.721 26021 7635 1 12 . 1 1 73 73 SER CA C 73 62.384 62.384 61.039 1.345 26021 7636 1 12 . 1 1 73 73 SER CB C 73 62.093 62.093 62.705 -0.612 26021 7637 1 12 . 1 1 73 73 SER H H 73 8.411 8.411 7.895 0.516 26021 7638 1 12 . 1 1 74 74 TYR N N 74 121.342 121.342 120.289 1.053 26021 7639 1 12 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.610 -0.119 26021 7640 1 12 . 1 1 74 74 TYR C C 74 178.747 178.747 177.917 0.830 26021 7641 1 12 . 1 1 74 74 TYR CA C 74 60.435 60.435 59.477 0.958 26021 7642 1 12 . 1 1 74 74 TYR CB C 74 37.507 37.507 37.914 -0.407 26021 7643 1 12 . 1 1 74 74 TYR H H 74 7.314 7.314 7.326 -0.012 26021 7644 1 12 . 1 1 75 75 VAL N N 75 120.779 120.779 117.456 3.323 26021 7645 1 12 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.771 0.090 26021 7646 1 12 . 1 1 75 75 VAL C C 75 179.788 179.788 178.061 1.727 26021 7647 1 12 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.449 0.599 26021 7648 1 12 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.543 0.171 26021 7649 1 12 . 1 1 75 75 VAL H H 75 7.740 7.740 7.800 -0.060 26021 7650 1 12 . 1 1 76 76 ILE N N 76 120.598 120.598 120.360 0.238 26021 7651 1 12 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.656 0.044 26021 7652 1 12 . 1 1 76 76 ILE C C 76 177.066 177.066 178.058 -0.992 26021 7653 1 12 . 1 1 76 76 ILE CA C 76 65.919 65.919 65.071 0.848 26021 7654 1 12 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.193 0.192 26021 7655 1 12 . 1 1 76 76 ILE H H 76 8.584 8.584 7.379 1.205 26021 7656 1 12 . 1 1 77 77 GLU N N 77 120.468 120.468 120.147 0.321 26021 7657 1 12 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.990 -0.341 26021 7658 1 12 . 1 1 77 77 GLU C C 77 177.502 177.502 178.494 -0.992 26021 7659 1 12 . 1 1 77 77 GLU CA C 77 60.862 60.862 60.104 0.758 26021 7660 1 12 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.798 0.554 26021 7661 1 12 . 1 1 77 77 GLU H H 77 8.445 8.445 8.204 0.241 26021 7662 1 12 . 1 1 78 78 ASP N N 78 117.382 117.382 119.707 -2.325 26021 7663 1 12 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.418 -0.027 26021 7664 1 12 . 1 1 78 78 ASP C C 78 177.382 177.382 178.093 -0.711 26021 7665 1 12 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.916 0.579 26021 7666 1 12 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.107 1.828 26021 7667 1 12 . 1 1 78 78 ASP H H 78 7.885 7.885 8.097 -0.212 26021 7668 1 12 . 1 1 79 79 ALA N N 79 120.171 120.171 122.003 -1.832 26021 7669 1 12 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.136 -0.086 26021 7670 1 12 . 1 1 79 79 ALA C C 79 181.193 181.193 179.544 1.649 26021 7671 1 12 . 1 1 79 79 ALA CA C 79 55.055 55.055 54.973 0.082 26021 7672 1 12 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.346 0.073 26021 7673 1 12 . 1 1 79 79 ALA H H 79 7.754 7.754 7.972 -0.218 26021 7674 1 12 . 1 1 80 80 VAL N N 80 119.541 119.541 118.175 1.366 26021 7675 1 12 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.990 -0.313 26021 7676 1 12 . 1 1 80 80 VAL C C 80 177.096 177.096 177.484 -0.388 26021 7677 1 12 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.146 2.938 26021 7678 1 12 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.795 -0.352 26021 7679 1 12 . 1 1 80 80 VAL H H 80 8.635 8.635 7.666 0.969 26021 7680 1 12 . 1 1 81 81 ASP N N 81 121.140 121.140 121.321 -0.181 26021 7681 1 12 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.385 0.084 26021 7682 1 12 . 1 1 81 81 ASP C C 81 179.569 179.569 178.857 0.712 26021 7683 1 12 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.335 0.594 26021 7684 1 12 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.805 -0.870 26021 7685 1 12 . 1 1 81 81 ASP H H 81 8.575 8.575 8.211 0.364 26021 7686 1 12 . 1 1 82 82 LYS N N 82 118.159 118.159 119.139 -0.980 26021 7687 1 12 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.053 -0.032 26021 7688 1 12 . 1 1 82 82 LYS C C 82 178.890 178.890 179.133 -0.243 26021 7689 1 12 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.729 0.338 26021 7690 1 12 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.942 0.645 26021 7691 1 12 . 1 1 82 82 LYS H H 82 8.079 8.079 7.623 0.456 26021 7692 1 12 . 1 1 83 83 PHE N N 83 120.900 120.900 120.054 0.846 26021 7693 1 12 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.384 -0.108 26021 7694 1 12 . 1 1 83 83 PHE C C 83 177.269 177.269 176.856 0.413 26021 7695 1 12 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.351 0.592 26021 7696 1 12 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.359 0.388 26021 7697 1 12 . 1 1 83 83 PHE H H 83 8.015 8.015 8.287 -0.272 26021 7698 1 12 . 1 1 84 84 LEU N N 84 118.209 118.209 118.839 -0.630 26021 7699 1 12 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.104 -0.162 26021 7700 1 12 . 1 1 84 84 LEU C C 84 178.774 178.774 177.957 0.817 26021 7701 1 12 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.222 0.947 26021 7702 1 12 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.127 1.066 26021 7703 1 12 . 1 1 84 84 LEU H H 84 8.338 8.338 7.851 0.487 26021 7704 1 12 . 1 1 85 85 VAL N N 85 116.078 116.078 120.189 -4.111 26021 7705 1 12 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.619 0.372 26021 7706 1 12 . 1 1 85 85 VAL C C 85 177.252 177.252 177.305 -0.053 26021 7707 1 12 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.792 -1.612 26021 7708 1 12 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.785 0.105 26021 7709 1 12 . 1 1 85 85 VAL H H 85 7.447 7.447 7.309 0.138 26021 7710 1 12 . 1 1 86 86 ARG N N 86 120.842 120.842 117.782 3.060 26021 7711 1 12 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.012 0.215 26021 7712 1 12 . 1 1 86 86 ARG C C 86 177.520 177.520 178.963 -1.443 26021 7713 1 12 . 1 1 86 86 ARG CA C 86 57.059 57.059 59.267 -2.208 26021 7714 1 12 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.290 -0.027 26021 7715 1 12 . 1 1 86 86 ARG H H 86 7.598 7.598 7.368 0.230 26021 7716 1 12 . 1 1 87 87 VAL N N 87 119.293 119.293 117.345 1.948 26021 7717 1 12 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.799 0.026 26021 7718 1 12 . 1 1 87 87 VAL C C 87 176.121 176.121 176.891 -0.770 26021 7719 1 12 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.209 -1.771 26021 7720 1 12 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.856 0.916 26021 7721 1 12 . 1 1 87 87 VAL H H 87 7.994 7.994 8.032 -0.038 26021 7722 1 12 . 1 1 88 88 HIS N N 88 120.016 120.016 116.797 3.219 26021 7723 1 12 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.673 -0.036 26021 7724 1 12 . 1 1 88 88 HIS C C 88 175.639 175.639 175.483 0.156 26021 7725 1 12 . 1 1 88 88 HIS CA C 88 56.351 56.351 55.707 0.644 26021 7726 1 12 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.690 -1.009 26021 7727 1 12 . 1 1 88 88 HIS H H 88 7.969 7.969 8.232 -0.263 26021 7728 1 12 . 1 1 89 89 GLY N N 89 109.587 109.587 108.906 0.681 26021 7729 1 12 . 1 1 89 89 GLY C C 89 173.730 173.730 174.829 -1.099 26021 7730 1 12 . 1 1 89 89 GLY CA C 89 45.169 45.169 46.028 -0.859 26021 7731 1 12 . 1 1 89 89 GLY H H 89 8.083 8.083 7.703 0.380 26021 7732 1 12 . 1 1 90 90 VAL N N 90 118.224 118.224 118.141 0.083 26021 7733 1 12 . 1 1 90 90 VAL HA H 90 4.138 4.138 3.927 0.211 26021 7734 1 12 . 1 1 90 90 VAL C C 90 176.018 176.018 175.957 0.061 26021 7735 1 12 . 1 1 90 90 VAL CA C 90 62.425 62.425 63.270 -0.846 26021 7736 1 12 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.617 -0.001 26021 7737 1 12 . 1 1 90 90 VAL H H 90 7.944 7.944 7.477 0.467 26021 7738 1 12 . 1 1 91 91 GLU N N 91 124.313 124.313 124.042 0.271 26021 7739 1 12 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.652 -0.046 26021 7740 1 12 . 1 1 91 91 GLU CA C 91 54.176 54.176 53.714 0.462 26021 7741 1 12 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.955 -0.195 26021 7742 1 12 . 1 1 91 91 GLU H H 91 8.423 8.423 8.317 0.106 26021 7743 1 12 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.461 -0.124 26021 7744 1 12 . 1 1 92 92 PRO C C 92 176.504 176.504 175.641 0.863 26021 7745 1 12 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.276 0.096 26021 7746 1 12 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.234 -0.067 26021 7747 1 12 . 1 1 93 93 ASP N N 93 120.275 120.275 122.390 -2.115 26021 7748 1 12 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.664 -0.092 26021 7749 1 12 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.983 -0.013 26021 7750 1 12 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.725 -2.210 26021 7751 1 12 . 1 1 93 93 ASP H H 93 8.286 8.286 8.184 0.102 26021 7752 1 12 . 1 1 94 94 ASP N N 94 121.181 121.181 121.007 0.174 26021 7753 1 12 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.755 -0.190 26021 7754 1 12 . 1 1 94 94 ASP C C 94 176.474 176.474 176.975 -0.501 26021 7755 1 12 . 1 1 94 94 ASP CA C 94 54.373 54.373 54.422 -0.049 26021 7756 1 12 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.621 -0.396 26021 7757 1 12 . 1 1 94 94 ASP H H 94 8.259 8.259 8.542 -0.283 26021 7758 1 12 . 1 1 95 95 ASN N N 95 118.728 118.728 118.717 0.011 26021 7759 1 12 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.540 0.154 26021 7760 1 12 . 1 1 95 95 ASN C C 95 176.272 176.272 177.354 -1.082 26021 7761 1 12 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.700 -1.714 26021 7762 1 12 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.733 -0.003 26021 7763 1 12 . 1 1 95 95 ASN H H 95 8.474 8.474 8.595 -0.121 26021 7764 1 12 . 1 1 96 96 THR N N 96 113.868 113.868 115.493 -1.625 26021 7765 1 12 . 1 1 96 96 THR HA H 96 4.220 4.220 4.071 0.149 26021 7766 1 12 . 1 1 96 96 THR C C 96 175.107 175.107 176.059 -0.952 26021 7767 1 12 . 1 1 96 96 THR CA C 96 63.200 63.200 65.749 -2.549 26021 7768 1 12 . 1 1 96 96 THR CB C 96 69.475 69.475 68.273 1.202 26021 7769 1 12 . 1 1 96 96 THR H H 96 8.263 8.263 8.547 -0.284 26021 7770 1 12 . 1 1 97 97 ASN N N 97 119.954 119.954 118.616 1.338 26021 7771 1 12 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.526 0.090 26021 7772 1 12 . 1 1 97 97 ASN C C 97 176.275 176.275 176.385 -0.110 26021 7773 1 12 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.201 -0.245 26021 7774 1 12 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.441 0.251 26021 7775 1 12 . 1 1 97 97 ASN H H 97 8.431 8.431 7.434 0.998 26021 7776 1 12 . 1 1 98 98 GLY N N 98 108.847 108.847 107.066 1.781 26021 7777 1 12 . 1 1 98 98 GLY C C 98 175.533 175.533 175.126 0.407 26021 7778 1 12 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.037 -0.026 26021 7779 1 12 . 1 1 98 98 GLY H H 98 8.338 8.338 8.108 0.230 26021 7780 1 12 . 1 1 99 99 PHE N N 99 118.492 118.492 120.489 -1.997 26021 7781 1 12 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.024 0.224 26021 7782 1 12 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.929 0.030 26021 7783 1 12 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.146 -0.987 26021 7784 1 12 . 1 1 99 99 PHE H H 99 8.370 8.370 8.697 -0.327 26021 7785 1 12 . 1 1 100 100 LYS N N 100 120.987 120.987 119.491 1.496 26021 7786 1 12 . 1 1 100 100 LYS H H 100 8.256 8.256 8.526 -0.270 26021 7787 1 12 . 1 1 101 101 GLY N N 101 108.186 108.186 106.637 1.549 26021 7788 1 12 . 1 1 101 101 GLY C C 101 177.075 177.075 176.147 0.928 26021 7789 1 12 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.237 0.665 26021 7790 1 12 . 1 1 101 101 GLY H H 101 8.300 8.300 7.746 0.554 26021 7791 1 12 . 1 1 102 102 LEU N N 102 121.439 121.439 123.778 -2.339 26021 7792 1 12 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.044 0.053 26021 7793 1 12 . 1 1 102 102 LEU C C 102 179.836 179.836 178.191 1.645 26021 7794 1 12 . 1 1 102 102 LEU CA C 102 57.358 57.358 58.019 -0.661 26021 7795 1 12 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.674 0.096 26021 7796 1 12 . 1 1 102 102 LEU H H 102 7.777 7.777 8.147 -0.370 26021 7797 1 12 . 1 1 103 103 MET N N 103 122.290 122.290 117.301 4.989 26021 7798 1 12 . 1 1 103 103 MET HA H 103 4.220 4.220 3.848 0.372 26021 7799 1 12 . 1 1 103 103 MET C C 103 177.739 177.739 178.161 -0.422 26021 7800 1 12 . 1 1 103 103 MET CA C 103 58.739 58.739 58.840 -0.102 26021 7801 1 12 . 1 1 103 103 MET CB C 103 31.895 31.895 31.629 0.266 26021 7802 1 12 . 1 1 103 103 MET H H 103 8.409 8.409 8.053 0.356 26021 7803 1 12 . 1 1 104 104 LYS N N 104 119.750 119.750 118.644 1.106 26021 7804 1 12 . 1 1 104 104 LYS HA H 104 4.067 4.067 3.988 0.079 26021 7805 1 12 . 1 1 104 104 LYS C C 104 179.301 179.301 178.865 0.436 26021 7806 1 12 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.876 0.888 26021 7807 1 12 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.739 0.308 26021 7808 1 12 . 1 1 104 104 LYS H H 104 7.916 7.916 7.516 0.400 26021 7809 1 12 . 1 1 105 105 ARG N N 105 117.967 117.967 118.357 -0.390 26021 7810 1 12 . 1 1 105 105 ARG HA H 105 4.026 4.026 3.987 0.039 26021 7811 1 12 . 1 1 105 105 ARG C C 105 178.777 178.777 178.517 0.260 26021 7812 1 12 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.781 -0.417 26021 7813 1 12 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.228 0.769 26021 7814 1 12 . 1 1 105 105 ARG H H 105 7.719 7.719 8.041 -0.322 26021 7815 1 12 . 1 1 106 106 THR N N 106 117.211 117.211 111.046 6.165 26021 7816 1 12 . 1 1 106 106 THR HA H 106 4.301 4.301 4.162 0.139 26021 7817 1 12 . 1 1 106 106 THR C C 106 176.254 176.254 176.427 -0.173 26021 7818 1 12 . 1 1 106 106 THR CA C 106 67.860 67.860 65.608 2.252 26021 7819 1 12 . 1 1 106 106 THR CB C 106 67.860 67.860 68.710 -0.850 26021 7820 1 12 . 1 1 106 106 THR H H 106 8.152 8.152 7.454 0.698 26021 7821 1 12 . 1 1 107 107 THR N N 107 117.939 117.939 118.353 -0.414 26021 7822 1 12 . 1 1 107 107 THR HA H 107 3.971 3.971 3.916 0.056 26021 7823 1 12 . 1 1 107 107 THR C C 107 176.780 176.780 176.106 0.674 26021 7824 1 12 . 1 1 107 107 THR CA C 107 66.822 66.822 67.320 -0.498 26021 7825 1 12 . 1 1 107 107 THR CB C 107 68.818 68.818 68.475 0.343 26021 7826 1 12 . 1 1 107 107 THR H H 107 8.651 8.651 7.508 1.143 26021 7827 1 12 . 1 1 108 108 LYS N N 108 120.867 120.867 121.416 -0.549 26021 7828 1 12 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.054 -0.032 26021 7829 1 12 . 1 1 108 108 LYS C C 108 179.045 179.045 179.308 -0.263 26021 7830 1 12 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.130 0.704 26021 7831 1 12 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.113 0.360 26021 7832 1 12 . 1 1 108 108 LYS H H 108 7.694 7.694 8.057 -0.363 26021 7833 1 12 . 1 1 109 109 LEU N N 109 119.472 119.472 119.774 -0.302 26021 7834 1 12 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.345 -0.024 26021 7835 1 12 . 1 1 109 109 LEU C C 109 179.974 179.974 179.149 0.825 26021 7836 1 12 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.653 -0.060 26021 7837 1 12 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.100 -0.240 26021 7838 1 12 . 1 1 109 109 LEU H H 109 7.559 7.559 7.669 -0.110 26021 7839 1 12 . 1 1 110 110 LEU N N 110 121.832 121.832 119.718 2.114 26021 7840 1 12 . 1 1 110 110 LEU HA H 110 4.191 4.191 3.992 0.199 26021 7841 1 12 . 1 1 110 110 LEU C C 110 178.101 178.101 178.880 -0.779 26021 7842 1 12 . 1 1 110 110 LEU CA C 110 57.892 57.892 58.660 -0.768 26021 7843 1 12 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.604 0.280 26021 7844 1 12 . 1 1 110 110 LEU H H 110 8.567 8.567 7.720 0.847 26021 7845 1 12 . 1 1 111 111 LYS N N 111 117.972 117.972 116.882 1.090 26021 7846 1 12 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.138 -0.159 26021 7847 1 12 . 1 1 111 111 LYS C C 111 177.677 177.677 177.871 -0.194 26021 7848 1 12 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.853 -0.068 26021 7849 1 12 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.116 0.093 26021 7850 1 12 . 1 1 111 111 LYS H H 111 7.965 7.965 8.612 -0.647 26021 7851 1 12 . 1 1 112 112 LYS N N 112 115.433 115.433 118.652 -3.219 26021 7852 1 12 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.156 -0.046 26021 7853 1 12 . 1 1 112 112 LYS C C 112 178.270 178.270 178.079 0.191 26021 7854 1 12 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.409 0.542 26021 7855 1 12 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.776 0.015 26021 7856 1 12 . 1 1 112 112 LYS H H 112 7.334 7.334 7.444 -0.110 26021 7857 1 12 . 1 1 113 113 VAL N N 113 114.861 114.861 119.937 -5.076 26021 7858 1 12 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.665 0.166 26021 7859 1 12 . 1 1 113 113 VAL C C 113 176.999 176.999 176.654 0.345 26021 7860 1 12 . 1 1 113 113 VAL CA C 113 63.505 63.505 64.417 -0.912 26021 7861 1 12 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.021 0.266 26021 7862 1 12 . 1 1 113 113 VAL H H 113 7.298 7.298 7.725 -0.427 26021 7863 1 12 . 1 1 114 114 VAL N N 114 121.457 121.457 119.263 2.194 26021 7864 1 12 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.802 -0.080 26021 7865 1 12 . 1 1 114 114 VAL C C 114 177.737 177.737 177.213 0.524 26021 7866 1 12 . 1 1 114 114 VAL CA C 114 65.224 65.224 64.621 0.603 26021 7867 1 12 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.190 0.563 26021 7868 1 12 . 1 1 114 114 VAL H H 114 7.855 7.855 7.523 0.332 26021 7869 1 12 . 1 1 115 115 ASP N N 115 120.804 120.804 120.399 0.405 26021 7870 1 12 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.434 0.021 26021 7871 1 12 . 1 1 115 115 ASP C C 115 177.380 177.380 177.170 0.210 26021 7872 1 12 . 1 1 115 115 ASP CA C 115 55.921 55.921 57.081 -1.160 26021 7873 1 12 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.919 -0.547 26021 7874 1 12 . 1 1 115 115 ASP H H 115 8.311 8.311 8.404 -0.093 26021 7875 1 12 . 1 1 116 116 LYS N N 116 119.582 119.582 117.270 2.312 26021 7876 1 12 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.250 -0.155 26021 7877 1 12 . 1 1 116 116 LYS C C 116 177.077 177.077 178.957 -1.880 26021 7878 1 12 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.849 -0.138 26021 7879 1 12 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.067 0.421 26021 7880 1 12 . 1 1 116 116 LYS H H 116 7.639 7.639 7.893 -0.254 26021 7881 1 12 . 1 1 117 117 HIS N N 117 115.246 115.246 116.123 -0.877 26021 7882 1 12 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.375 0.250 26021 7883 1 12 . 1 1 117 117 HIS C C 117 175.497 175.497 176.676 -1.179 26021 7884 1 12 . 1 1 117 117 HIS CA C 117 56.175 56.175 57.496 -1.321 26021 7885 1 12 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.260 0.215 26021 7886 1 12 . 1 1 117 117 HIS H H 117 8.108 8.108 7.873 0.235 26021 7887 1 12 . 1 1 118 118 GLY N N 118 109.944 109.944 107.357 2.587 26021 7888 1 12 . 1 1 118 118 GLY C C 118 174.093 174.093 174.707 -0.614 26021 7889 1 12 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.517 0.547 26021 7890 1 12 . 1 1 118 118 GLY H H 118 8.153 8.153 7.806 0.347 26021 7891 1 12 . 1 1 119 119 ILE N N 119 118.468 118.468 121.496 -3.028 26021 7892 1 12 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.842 0.280 26021 7893 1 12 . 1 1 119 119 ILE C C 119 174.777 174.777 174.895 -0.118 26021 7894 1 12 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.796 -0.695 26021 7895 1 12 . 1 1 119 119 ILE CB C 119 38.631 38.631 35.721 2.910 26021 7896 1 12 . 1 1 119 119 ILE H H 119 7.828 7.828 7.540 0.288 26021 7897 1 13 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.613 0.136 26021 7898 1 13 . 1 1 4 4 ASN C C 4 175.260 175.260 175.730 -0.470 26021 7899 1 13 . 1 1 4 4 ASN CA C 4 53.831 53.831 55.010 -1.179 26021 7900 1 13 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.458 0.223 26021 7901 1 13 . 1 1 5 5 ALA N N 5 123.648 123.648 119.611 4.037 26021 7902 1 13 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.604 -0.314 26021 7903 1 13 . 1 1 5 5 ALA C C 5 178.256 178.256 178.605 -0.349 26021 7904 1 13 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.395 1.686 26021 7905 1 13 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.722 0.303 26021 7906 1 13 . 1 1 5 5 ALA H H 5 8.520 8.520 8.125 0.395 26021 7907 1 13 . 1 1 6 6 GLY N N 6 107.044 107.044 107.946 -0.902 26021 7908 1 13 . 1 1 6 6 GLY C C 6 174.961 174.961 175.236 -0.275 26021 7909 1 13 . 1 1 6 6 GLY CA C 6 45.830 45.830 47.047 -1.217 26021 7910 1 13 . 1 1 6 6 GLY H H 6 8.350 8.350 7.801 0.549 26021 7911 1 13 . 1 1 7 7 ALA N N 7 123.366 123.366 123.489 -0.123 26021 7912 1 13 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.164 0.052 26021 7913 1 13 . 1 1 7 7 ALA C C 7 179.006 179.006 178.749 0.257 26021 7914 1 13 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.446 -0.743 26021 7915 1 13 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.443 0.401 26021 7916 1 13 . 1 1 7 7 ALA H H 7 8.078 8.078 8.119 -0.041 26021 7917 1 13 . 1 1 8 8 ILE N N 8 117.376 117.376 118.539 -1.163 26021 7918 1 13 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.744 0.036 26021 7919 1 13 . 1 1 8 8 ILE C C 8 177.032 177.032 178.219 -1.187 26021 7920 1 13 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.192 -1.034 26021 7921 1 13 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.156 -1.867 26021 7922 1 13 . 1 1 8 8 ILE H H 8 7.943 7.943 7.414 0.529 26021 7923 1 13 . 1 1 9 9 ALA N N 9 121.414 121.414 122.645 -1.231 26021 7924 1 13 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.031 -0.098 26021 7925 1 13 . 1 1 9 9 ALA C C 9 180.515 180.515 179.447 1.068 26021 7926 1 13 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.931 0.167 26021 7927 1 13 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.156 0.005 26021 7928 1 13 . 1 1 9 9 ALA H H 9 8.062 8.062 7.785 0.277 26021 7929 1 13 . 1 1 10 10 LYS N N 10 114.594 114.594 118.316 -3.722 26021 7930 1 13 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.129 0.035 26021 7931 1 13 . 1 1 10 10 LYS C C 10 178.099 178.099 178.199 -0.100 26021 7932 1 13 . 1 1 10 10 LYS CA C 10 57.840 57.840 57.883 -0.043 26021 7933 1 13 . 1 1 10 10 LYS CB C 10 32.469 32.469 31.995 0.474 26021 7934 1 13 . 1 1 10 10 LYS H H 10 7.554 7.554 7.995 -0.441 26021 7935 1 13 . 1 1 11 11 LEU N N 11 119.662 119.662 119.300 0.362 26021 7936 1 13 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.146 -0.068 26021 7937 1 13 . 1 1 11 11 LEU C C 11 177.930 177.930 178.354 -0.424 26021 7938 1 13 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.403 0.153 26021 7939 1 13 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.783 1.305 26021 7940 1 13 . 1 1 11 11 LEU H H 11 7.814 7.814 7.365 0.449 26021 7941 1 13 . 1 1 12 12 ILE N N 12 117.945 117.945 120.637 -2.692 26021 7942 1 13 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.875 -0.183 26021 7943 1 13 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.162 1.467 26021 7944 1 13 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.723 1.687 26021 7945 1 13 . 1 1 12 12 ILE H H 12 7.426 7.426 7.607 -0.181 26021 7946 1 13 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.297 0.106 26021 7947 1 13 . 1 1 13 13 PRO C C 13 179.030 179.030 178.733 0.297 26021 7948 1 13 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.167 0.077 26021 7949 1 13 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.046 -0.237 26021 7950 1 13 . 1 1 14 14 LYS N N 14 117.855 117.855 118.142 -0.287 26021 7951 1 13 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.073 0.072 26021 7952 1 13 . 1 1 14 14 LYS C C 14 178.565 178.565 178.412 0.153 26021 7953 1 13 . 1 1 14 14 LYS CA C 14 59.433 59.433 58.654 0.779 26021 7954 1 13 . 1 1 14 14 LYS CB C 14 32.925 32.925 31.715 1.210 26021 7955 1 13 . 1 1 14 14 LYS H H 14 6.685 6.685 7.398 -0.713 26021 7956 1 13 . 1 1 15 15 LEU N N 15 118.008 118.008 116.287 1.721 26021 7957 1 13 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.388 -0.385 26021 7958 1 13 . 1 1 15 15 LEU C C 15 178.662 178.662 178.987 -0.325 26021 7959 1 13 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.403 1.309 26021 7960 1 13 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.176 -0.177 26021 7961 1 13 . 1 1 15 15 LEU H H 15 8.148 8.148 7.611 0.537 26021 7962 1 13 . 1 1 16 16 GLY N N 16 103.895 103.895 108.546 -4.651 26021 7963 1 13 . 1 1 16 16 GLY C C 16 176.838 176.838 175.724 1.114 26021 7964 1 13 . 1 1 16 16 GLY CA C 16 47.365 47.365 46.994 0.371 26021 7965 1 13 . 1 1 16 16 GLY H H 16 8.104 8.104 7.729 0.375 26021 7966 1 13 . 1 1 17 17 GLU N N 17 121.655 121.655 121.722 -0.067 26021 7967 1 13 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.054 0.079 26021 7968 1 13 . 1 1 17 17 GLU C C 17 179.007 179.007 178.162 0.845 26021 7969 1 13 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.153 -0.342 26021 7970 1 13 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.439 -0.306 26021 7971 1 13 . 1 1 17 17 GLU H H 17 7.817 7.817 7.696 0.121 26021 7972 1 13 . 1 1 18 18 LEU N N 18 117.834 117.834 117.439 0.395 26021 7973 1 13 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.359 -0.241 26021 7974 1 13 . 1 1 18 18 LEU C C 18 177.658 177.658 177.762 -0.104 26021 7975 1 13 . 1 1 18 18 LEU CA C 18 57.029 57.029 56.224 0.805 26021 7976 1 13 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.838 -0.168 26021 7977 1 13 . 1 1 18 18 LEU H H 18 7.389 7.389 7.524 -0.135 26021 7978 1 13 . 1 1 19 19 LEU N N 19 113.694 113.694 118.288 -4.594 26021 7979 1 13 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.229 -0.067 26021 7980 1 13 . 1 1 19 19 LEU C C 19 178.123 178.123 178.586 -0.463 26021 7981 1 13 . 1 1 19 19 LEU CA C 19 55.852 55.852 56.742 -0.890 26021 7982 1 13 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.841 0.379 26021 7983 1 13 . 1 1 19 19 LEU H H 19 7.269 7.269 7.276 -0.007 26021 7984 1 13 . 1 1 20 20 VAL N N 20 112.778 112.778 114.701 -1.923 26021 7985 1 13 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.125 0.318 26021 7986 1 13 . 1 1 20 20 VAL C C 20 177.021 177.021 176.314 0.707 26021 7987 1 13 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.239 -1.384 26021 7988 1 13 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.193 0.585 26021 7989 1 13 . 1 1 20 20 VAL H H 20 7.356 7.356 7.954 -0.598 26021 7990 1 13 . 1 1 21 21 GLY N N 21 108.962 108.962 108.547 0.415 26021 7991 1 13 . 1 1 21 21 GLY C C 21 173.813 173.813 174.323 -0.510 26021 7992 1 13 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.766 0.280 26021 7993 1 13 . 1 1 21 21 GLY H H 21 7.925 7.925 8.227 -0.302 26021 7994 1 13 . 1 1 22 22 GLU N N 22 120.607 120.607 122.773 -2.166 26021 7995 1 13 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.579 -0.301 26021 7996 1 13 . 1 1 22 22 GLU C C 22 175.869 175.869 175.464 0.405 26021 7997 1 13 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.675 0.355 26021 7998 1 13 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.381 -0.700 26021 7999 1 13 . 1 1 22 22 GLU H H 22 8.300 8.300 8.034 0.266 26021 8000 1 13 . 1 1 23 23 TYR N N 23 120.738 120.738 118.796 1.942 26021 8001 1 13 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.046 -0.489 26021 8002 1 13 . 1 1 23 23 TYR C C 23 175.264 175.264 174.035 1.229 26021 8003 1 13 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.149 0.412 26021 8004 1 13 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.610 -0.364 26021 8005 1 13 . 1 1 23 23 TYR H H 23 7.756 7.756 7.567 0.189 26021 8006 1 13 . 1 1 24 24 LYS N N 24 122.095 122.095 122.904 -0.809 26021 8007 1 13 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.502 -0.319 26021 8008 1 13 . 1 1 24 24 LYS C C 24 175.742 175.742 174.624 1.118 26021 8009 1 13 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.903 0.215 26021 8010 1 13 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.068 -0.349 26021 8011 1 13 . 1 1 24 24 LYS H H 24 8.692 8.692 8.649 0.043 26021 8012 1 13 . 1 1 25 25 LEU N N 25 121.123 121.123 119.650 1.473 26021 8013 1 13 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.575 -0.083 26021 8014 1 13 . 1 1 25 25 LEU C C 25 177.487 177.487 175.877 1.610 26021 8015 1 13 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.193 1.141 26021 8016 1 13 . 1 1 25 25 LEU CB C 25 43.758 43.758 45.081 -1.323 26021 8017 1 13 . 1 1 25 25 LEU H H 25 8.088 8.088 7.556 0.532 26021 8018 1 13 . 1 1 26 26 HIS N N 26 122.993 122.993 119.733 3.260 26021 8019 1 13 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.538 -0.037 26021 8020 1 13 . 1 1 26 26 HIS C C 26 176.716 176.716 176.775 -0.059 26021 8021 1 13 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.851 0.346 26021 8022 1 13 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.709 0.648 26021 8023 1 13 . 1 1 26 26 HIS H H 26 8.882 8.882 8.389 0.493 26021 8024 1 13 . 1 1 27 27 LYS N N 27 124.894 124.894 120.311 4.583 26021 8025 1 13 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.361 -0.413 26021 8026 1 13 . 1 1 27 27 LYS C C 27 178.873 178.873 178.512 0.361 26021 8027 1 13 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.663 1.348 26021 8028 1 13 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.721 -0.279 26021 8029 1 13 . 1 1 27 27 LYS H H 27 8.699 8.699 8.541 0.158 26021 8030 1 13 . 1 1 28 28 GLY N N 28 111.258 111.258 106.198 5.060 26021 8031 1 13 . 1 1 28 28 GLY C C 28 176.131 176.131 176.142 -0.011 26021 8032 1 13 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.024 0.466 26021 8033 1 13 . 1 1 28 28 GLY H H 28 9.814 9.814 8.614 1.200 26021 8034 1 13 . 1 1 29 29 VAL N N 29 122.719 122.719 122.022 0.697 26021 8035 1 13 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.501 0.391 26021 8036 1 13 . 1 1 29 29 VAL C C 29 177.628 177.628 177.401 0.227 26021 8037 1 13 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.909 -0.389 26021 8038 1 13 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.655 0.087 26021 8039 1 13 . 1 1 29 29 VAL H H 29 7.431 7.431 7.314 0.117 26021 8040 1 13 . 1 1 30 30 LYS N N 30 119.791 119.791 118.367 1.424 26021 8041 1 13 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.721 -0.086 26021 8042 1 13 . 1 1 30 30 LYS C C 30 177.666 177.666 177.779 -0.113 26021 8043 1 13 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.210 1.814 26021 8044 1 13 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.008 1.397 26021 8045 1 13 . 1 1 30 30 LYS H H 30 8.255 8.255 8.381 -0.126 26021 8046 1 13 . 1 1 31 31 LYS N N 31 117.918 117.918 118.261 -0.343 26021 8047 1 13 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.157 -0.041 26021 8048 1 13 . 1 1 31 31 LYS C C 31 177.784 177.784 178.936 -1.152 26021 8049 1 13 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.156 -0.453 26021 8050 1 13 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.920 -0.075 26021 8051 1 13 . 1 1 31 31 LYS H H 31 7.689 7.689 7.809 -0.120 26021 8052 1 13 . 1 1 32 32 ASN N N 32 116.347 116.347 116.858 -0.511 26021 8053 1 13 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.201 0.319 26021 8054 1 13 . 1 1 32 32 ASN C C 32 177.764 177.764 176.803 0.961 26021 8055 1 13 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.543 0.772 26021 8056 1 13 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.477 0.155 26021 8057 1 13 . 1 1 32 32 ASN H H 32 7.556 7.556 7.837 -0.281 26021 8058 1 13 . 1 1 33 33 ILE N N 33 120.592 120.592 119.756 0.836 26021 8059 1 13 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.677 -0.395 26021 8060 1 13 . 1 1 33 33 ILE C C 33 177.074 177.074 177.364 -0.290 26021 8061 1 13 . 1 1 33 33 ILE CA C 33 65.888 65.888 62.938 2.950 26021 8062 1 13 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.881 0.297 26021 8063 1 13 . 1 1 33 33 ILE H H 33 8.236 8.236 7.132 1.104 26021 8064 1 13 . 1 1 34 34 GLU N N 34 120.595 120.595 119.853 0.742 26021 8065 1 13 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.863 -0.075 26021 8066 1 13 . 1 1 34 34 GLU C C 34 179.739 179.739 178.965 0.774 26021 8067 1 13 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.786 0.453 26021 8068 1 13 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.887 0.958 26021 8069 1 13 . 1 1 34 34 GLU H H 34 8.551 8.551 8.688 -0.137 26021 8070 1 13 . 1 1 35 35 ASP N N 35 120.600 120.600 120.234 0.366 26021 8071 1 13 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.529 -0.117 26021 8072 1 13 . 1 1 35 35 ASP C C 35 178.681 178.681 178.576 0.105 26021 8073 1 13 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.843 0.619 26021 8074 1 13 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.709 -0.959 26021 8075 1 13 . 1 1 35 35 ASP H H 35 8.670 8.670 7.701 0.969 26021 8076 1 13 . 1 1 36 36 LEU N N 36 123.004 123.004 120.915 2.089 26021 8077 1 13 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.420 -0.325 26021 8078 1 13 . 1 1 36 36 LEU C C 36 178.035 178.035 179.237 -1.202 26021 8079 1 13 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.742 0.286 26021 8080 1 13 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.167 -0.291 26021 8081 1 13 . 1 1 36 36 LEU H H 36 8.166 8.166 7.704 0.462 26021 8082 1 13 . 1 1 37 37 LEU N N 37 120.178 120.178 120.125 0.053 26021 8083 1 13 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.030 -0.174 26021 8084 1 13 . 1 1 37 37 LEU C C 37 178.128 178.128 178.280 -0.152 26021 8085 1 13 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.033 0.642 26021 8086 1 13 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.559 0.596 26021 8087 1 13 . 1 1 37 37 LEU H H 37 8.736 8.736 8.205 0.531 26021 8088 1 13 . 1 1 38 38 LYS N N 38 118.110 118.110 119.246 -1.136 26021 8089 1 13 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.919 0.014 26021 8090 1 13 . 1 1 38 38 LYS C C 38 179.533 179.533 179.060 0.473 26021 8091 1 13 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.173 0.100 26021 8092 1 13 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.272 0.005 26021 8093 1 13 . 1 1 38 38 LYS H H 38 7.770 7.770 7.762 0.008 26021 8094 1 13 . 1 1 39 39 GLU N N 39 119.265 119.265 119.586 -0.321 26021 8095 1 13 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.077 0.225 26021 8096 1 13 . 1 1 39 39 GLU C C 39 179.720 179.720 179.083 0.637 26021 8097 1 13 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.426 -0.668 26021 8098 1 13 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.608 -0.018 26021 8099 1 13 . 1 1 39 39 GLU H H 39 7.709 7.709 7.717 -0.008 26021 8100 1 13 . 1 1 40 40 LEU N N 40 119.007 119.007 119.299 -0.292 26021 8101 1 13 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.241 -0.191 26021 8102 1 13 . 1 1 40 40 LEU C C 40 179.690 179.690 178.729 0.961 26021 8103 1 13 . 1 1 40 40 LEU CA C 40 57.651 57.651 56.886 0.765 26021 8104 1 13 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.082 0.603 26021 8105 1 13 . 1 1 40 40 LEU H H 40 8.851 8.851 7.960 0.891 26021 8106 1 13 . 1 1 41 41 LYS N N 41 120.500 120.500 118.550 1.950 26021 8107 1 13 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.057 -0.105 26021 8108 1 13 . 1 1 41 41 LYS C C 41 180.223 180.223 178.814 1.409 26021 8109 1 13 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.586 1.305 26021 8110 1 13 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.070 -0.003 26021 8111 1 13 . 1 1 41 41 LYS H H 41 8.482 8.482 8.167 0.315 26021 8112 1 13 . 1 1 42 42 THR N N 42 119.555 119.555 111.639 7.916 26021 8113 1 13 . 1 1 42 42 THR HA H 42 4.000 4.000 4.206 -0.206 26021 8114 1 13 . 1 1 42 42 THR C C 42 176.633 176.633 176.334 0.299 26021 8115 1 13 . 1 1 42 42 THR CA C 42 66.574 66.574 65.249 1.325 26021 8116 1 13 . 1 1 42 42 THR CB C 42 67.924 67.924 68.884 -0.960 26021 8117 1 13 . 1 1 42 42 THR H H 42 7.863 7.863 7.400 0.463 26021 8118 1 13 . 1 1 43 43 MET N N 43 122.839 122.839 121.934 0.905 26021 8119 1 13 . 1 1 43 43 MET HA H 43 4.022 4.022 3.962 0.060 26021 8120 1 13 . 1 1 43 43 MET C C 43 177.290 177.290 177.980 -0.690 26021 8121 1 13 . 1 1 43 43 MET CA C 43 59.731 59.731 60.055 -0.324 26021 8122 1 13 . 1 1 43 43 MET CB C 43 33.610 33.610 32.251 1.359 26021 8123 1 13 . 1 1 43 43 MET H H 43 8.714 8.714 7.575 1.139 26021 8124 1 13 . 1 1 44 44 ASN N N 44 118.049 118.049 117.487 0.562 26021 8125 1 13 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.230 0.144 26021 8126 1 13 . 1 1 44 44 ASN C C 44 176.297 176.297 177.184 -0.887 26021 8127 1 13 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.392 0.502 26021 8128 1 13 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.877 0.529 26021 8129 1 13 . 1 1 44 44 ASN H H 44 8.988 8.988 8.419 0.569 26021 8130 1 13 . 1 1 45 45 ALA N N 45 119.260 119.260 121.495 -2.235 26021 8131 1 13 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.164 -0.098 26021 8132 1 13 . 1 1 45 45 ALA C C 45 180.476 180.476 179.074 1.402 26021 8133 1 13 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.330 0.938 26021 8134 1 13 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.287 -0.599 26021 8135 1 13 . 1 1 45 45 ALA H H 45 7.675 7.675 7.438 0.237 26021 8136 1 13 . 1 1 46 46 ALA N N 46 121.126 121.126 122.465 -1.339 26021 8137 1 13 . 1 1 46 46 ALA HA H 46 4.116 4.116 3.949 0.167 26021 8138 1 13 . 1 1 46 46 ALA C C 46 179.314 179.314 179.186 0.128 26021 8139 1 13 . 1 1 46 46 ALA CA C 46 54.986 54.986 54.992 -0.006 26021 8140 1 13 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.213 0.009 26021 8141 1 13 . 1 1 46 46 ALA H H 46 7.872 7.872 7.578 0.294 26021 8142 1 13 . 1 1 47 47 LEU N N 47 119.328 119.328 115.762 3.566 26021 8143 1 13 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.888 0.303 26021 8144 1 13 . 1 1 47 47 LEU C C 47 180.403 180.403 178.243 2.160 26021 8145 1 13 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.017 0.029 26021 8146 1 13 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.376 0.574 26021 8147 1 13 . 1 1 47 47 LEU H H 47 8.529 8.529 7.554 0.975 26021 8148 1 13 . 1 1 48 48 ILE N N 48 121.653 121.653 118.925 2.728 26021 8149 1 13 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.662 0.040 26021 8150 1 13 . 1 1 48 48 ILE C C 48 178.730 178.730 178.433 0.297 26021 8151 1 13 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.809 0.101 26021 8152 1 13 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.627 0.285 26021 8153 1 13 . 1 1 48 48 ILE H H 48 8.386 8.386 7.067 1.319 26021 8154 1 13 . 1 1 49 49 LYS N N 49 119.896 119.896 119.713 0.183 26021 8155 1 13 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.173 -0.130 26021 8156 1 13 . 1 1 49 49 LYS C C 49 179.999 179.999 179.271 0.728 26021 8157 1 13 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.372 -0.315 26021 8158 1 13 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.783 -0.822 26021 8159 1 13 . 1 1 49 49 LYS H H 49 7.456 7.456 7.591 -0.135 26021 8160 1 13 . 1 1 50 50 ILE N N 50 119.964 119.964 114.591 5.373 26021 8161 1 13 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.172 -0.436 26021 8162 1 13 . 1 1 50 50 ILE C C 50 177.960 177.960 177.651 0.309 26021 8163 1 13 . 1 1 50 50 ILE CA C 50 64.349 64.349 64.076 0.273 26021 8164 1 13 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.898 0.234 26021 8165 1 13 . 1 1 50 50 ILE H H 50 8.154 8.154 8.621 -0.467 26021 8166 1 13 . 1 1 51 51 GLY N N 51 106.709 106.709 106.980 -0.271 26021 8167 1 13 . 1 1 51 51 GLY C C 51 174.461 174.461 174.858 -0.397 26021 8168 1 13 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.515 0.394 26021 8169 1 13 . 1 1 51 51 GLY H H 51 7.932 7.932 7.728 0.204 26021 8170 1 13 . 1 1 52 52 GLU N N 52 118.736 118.736 119.518 -0.782 26021 8171 1 13 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.199 0.121 26021 8172 1 13 . 1 1 52 52 GLU C C 52 176.789 176.789 176.913 -0.124 26021 8173 1 13 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.237 -0.963 26021 8174 1 13 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.049 0.063 26021 8175 1 13 . 1 1 52 52 GLU H H 52 7.597 7.597 7.702 -0.105 26021 8176 1 13 . 1 1 53 53 VAL N N 53 122.982 122.982 115.951 7.031 26021 8177 1 13 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.400 -0.139 26021 8178 1 13 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.230 1.155 26021 8179 1 13 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.954 0.868 26021 8180 1 13 . 1 1 53 53 VAL H H 53 7.511 7.511 7.422 0.089 26021 8181 1 13 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.763 -0.118 26021 8182 1 13 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.508 0.070 26021 8183 1 13 . 1 1 54 54 PRO CB C 54 31.535 31.535 30.965 0.570 26021 8184 1 13 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.339 -0.148 26021 8185 1 13 . 1 1 55 55 PRO C C 55 178.258 178.258 178.084 0.174 26021 8186 1 13 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.926 0.502 26021 8187 1 13 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.704 0.142 26021 8188 1 13 . 1 1 56 56 ASP N N 56 114.117 114.117 119.244 -5.127 26021 8189 1 13 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.533 -0.042 26021 8190 1 13 . 1 1 56 56 ASP C C 56 176.696 176.696 176.959 -0.263 26021 8191 1 13 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.989 -0.851 26021 8192 1 13 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.920 -1.194 26021 8193 1 13 . 1 1 56 56 ASP H H 56 8.489 8.489 8.759 -0.270 26021 8194 1 13 . 1 1 57 57 GLN N N 57 117.641 117.641 116.865 0.776 26021 8195 1 13 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.472 -0.098 26021 8196 1 13 . 1 1 57 57 GLN C C 57 175.765 175.765 175.317 0.448 26021 8197 1 13 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.015 0.275 26021 8198 1 13 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.722 -0.076 26021 8199 1 13 . 1 1 57 57 GLN H H 57 8.206 8.206 7.714 0.492 26021 8200 1 13 . 1 1 58 58 LEU N N 58 122.141 122.141 121.282 0.859 26021 8201 1 13 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.403 0.047 26021 8202 1 13 . 1 1 58 58 LEU C C 58 176.849 176.849 176.049 0.800 26021 8203 1 13 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.303 0.692 26021 8204 1 13 . 1 1 58 58 LEU CB C 58 43.231 43.231 43.259 -0.028 26021 8205 1 13 . 1 1 58 58 LEU H H 58 7.152 7.152 7.253 -0.101 26021 8206 1 13 . 1 1 59 59 ASP N N 59 125.643 125.643 119.175 6.468 26021 8207 1 13 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.848 -0.129 26021 8208 1 13 . 1 1 59 59 ASP C C 59 177.249 177.249 176.959 0.290 26021 8209 1 13 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.994 0.409 26021 8210 1 13 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.770 -1.538 26021 8211 1 13 . 1 1 59 59 ASP H H 59 9.312 9.312 8.203 1.109 26021 8212 1 13 . 1 1 60 60 SER N N 60 116.550 116.550 115.749 0.801 26021 8213 1 13 . 1 1 60 60 SER HA H 60 4.124 4.124 4.218 -0.094 26021 8214 1 13 . 1 1 60 60 SER C C 60 176.840 176.840 176.419 0.421 26021 8215 1 13 . 1 1 60 60 SER CA C 60 61.722 61.722 60.802 0.920 26021 8216 1 13 . 1 1 60 60 SER CB C 60 62.815 62.815 63.471 -0.656 26021 8217 1 13 . 1 1 60 60 SER H H 60 8.647 8.647 8.623 0.024 26021 8218 1 13 . 1 1 61 61 GLN N N 61 121.394 121.394 121.255 0.139 26021 8219 1 13 . 1 1 61 61 GLN HA H 61 4.131 4.131 3.953 0.178 26021 8220 1 13 . 1 1 61 61 GLN C C 61 178.629 178.629 177.777 0.852 26021 8221 1 13 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.922 -0.169 26021 8222 1 13 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.601 -0.348 26021 8223 1 13 . 1 1 61 61 GLN H H 61 8.453 8.453 8.187 0.266 26021 8224 1 13 . 1 1 62 62 ASP N N 62 122.187 122.187 118.357 3.830 26021 8225 1 13 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.540 0.079 26021 8226 1 13 . 1 1 62 62 ASP C C 62 178.318 178.318 178.394 -0.076 26021 8227 1 13 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.559 -0.097 26021 8228 1 13 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.595 0.441 26021 8229 1 13 . 1 1 62 62 ASP H H 62 8.311 8.311 8.626 -0.315 26021 8230 1 13 . 1 1 63 63 LYS N N 63 120.325 120.325 118.841 1.484 26021 8231 1 13 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.144 -0.135 26021 8232 1 13 . 1 1 63 63 LYS C C 63 178.765 178.765 179.019 -0.254 26021 8233 1 13 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.835 0.918 26021 8234 1 13 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.133 0.320 26021 8235 1 13 . 1 1 63 63 LYS H H 63 7.923 7.923 7.890 0.033 26021 8236 1 13 . 1 1 64 64 LEU N N 64 119.491 119.491 119.800 -0.309 26021 8237 1 13 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.123 0.103 26021 8238 1 13 . 1 1 64 64 LEU C C 64 179.526 179.526 178.832 0.694 26021 8239 1 13 . 1 1 64 64 LEU CA C 64 57.798 57.798 58.156 -0.358 26021 8240 1 13 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.303 0.472 26021 8241 1 13 . 1 1 64 64 LEU H H 64 7.820 7.820 7.323 0.497 26021 8242 1 13 . 1 1 65 65 TRP N N 65 120.674 120.674 121.619 -0.945 26021 8243 1 13 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.188 0.120 26021 8244 1 13 . 1 1 65 65 TRP C C 65 177.379 177.379 177.374 0.005 26021 8245 1 13 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.935 0.866 26021 8246 1 13 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.626 -0.215 26021 8247 1 13 . 1 1 65 65 TRP H H 65 8.196 8.196 8.060 0.136 26021 8248 1 13 . 1 1 66 66 ALA N N 66 120.606 120.606 119.645 0.961 26021 8249 1 13 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.621 0.088 26021 8250 1 13 . 1 1 66 66 ALA C C 66 180.376 180.376 179.212 1.164 26021 8251 1 13 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.559 1.005 26021 8252 1 13 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.898 -0.244 26021 8253 1 13 . 1 1 66 66 ALA H H 66 8.305 8.305 7.644 0.661 26021 8254 1 13 . 1 1 67 67 ASP N N 67 119.175 119.175 119.536 -0.361 26021 8255 1 13 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.284 0.166 26021 8256 1 13 . 1 1 67 67 ASP C C 67 178.757 178.757 178.214 0.543 26021 8257 1 13 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.284 0.208 26021 8258 1 13 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.704 -0.550 26021 8259 1 13 . 1 1 67 67 ASP H H 67 7.945 7.945 7.698 0.247 26021 8260 1 13 . 1 1 68 68 GLU N N 68 122.322 122.322 119.419 2.903 26021 8261 1 13 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.273 -0.258 26021 8262 1 13 . 1 1 68 68 GLU C C 68 180.055 180.055 179.338 0.717 26021 8263 1 13 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.192 0.918 26021 8264 1 13 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.798 -0.151 26021 8265 1 13 . 1 1 68 68 GLU H H 68 8.168 8.168 8.002 0.166 26021 8266 1 13 . 1 1 69 69 VAL N N 69 122.135 122.135 117.902 4.233 26021 8267 1 13 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.765 -0.513 26021 8268 1 13 . 1 1 69 69 VAL C C 69 177.736 177.736 177.607 0.129 26021 8269 1 13 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.855 0.684 26021 8270 1 13 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.332 -0.090 26021 8271 1 13 . 1 1 69 69 VAL H H 69 8.424 8.424 7.281 1.143 26021 8272 1 13 . 1 1 70 70 ARG N N 70 121.373 121.373 120.236 1.137 26021 8273 1 13 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.060 -0.368 26021 8274 1 13 . 1 1 70 70 ARG C C 70 179.117 179.117 178.762 0.355 26021 8275 1 13 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.344 0.821 26021 8276 1 13 . 1 1 70 70 ARG CB C 70 29.654 29.654 30.406 -0.752 26021 8277 1 13 . 1 1 70 70 ARG H H 70 7.916 7.916 8.120 -0.204 26021 8278 1 13 . 1 1 71 71 GLU N N 71 119.075 119.075 120.243 -1.168 26021 8279 1 13 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.898 0.165 26021 8280 1 13 . 1 1 71 71 GLU C C 71 179.119 179.119 178.994 0.125 26021 8281 1 13 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.992 0.695 26021 8282 1 13 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.605 0.666 26021 8283 1 13 . 1 1 71 71 GLU H H 71 8.031 8.031 8.377 -0.346 26021 8284 1 13 . 1 1 72 72 LEU N N 72 120.503 120.503 120.289 0.214 26021 8285 1 13 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.025 0.032 26021 8286 1 13 . 1 1 72 72 LEU C C 72 178.734 178.734 179.090 -0.356 26021 8287 1 13 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.016 0.407 26021 8288 1 13 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.665 -0.257 26021 8289 1 13 . 1 1 72 72 LEU H H 72 8.175 8.175 7.671 0.504 26021 8290 1 13 . 1 1 73 73 SER N N 73 115.243 115.243 116.067 -0.824 26021 8291 1 13 . 1 1 73 73 SER HA H 73 3.824 3.824 4.108 -0.284 26021 8292 1 13 . 1 1 73 73 SER C C 73 175.697 175.697 176.420 -0.723 26021 8293 1 13 . 1 1 73 73 SER CA C 73 62.384 62.384 61.552 0.832 26021 8294 1 13 . 1 1 73 73 SER CB C 73 62.093 62.093 62.726 -0.633 26021 8295 1 13 . 1 1 73 73 SER H H 73 8.411 8.411 8.376 0.035 26021 8296 1 13 . 1 1 74 74 TYR N N 74 121.342 121.342 120.673 0.669 26021 8297 1 13 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.223 0.268 26021 8298 1 13 . 1 1 74 74 TYR C C 74 178.747 178.747 177.571 1.176 26021 8299 1 13 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.438 -0.003 26021 8300 1 13 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.203 -0.696 26021 8301 1 13 . 1 1 74 74 TYR H H 74 7.314 7.314 7.973 -0.659 26021 8302 1 13 . 1 1 75 75 VAL N N 75 120.779 120.779 117.124 3.655 26021 8303 1 13 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.718 0.143 26021 8304 1 13 . 1 1 75 75 VAL C C 75 179.788 179.788 177.868 1.920 26021 8305 1 13 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.106 0.942 26021 8306 1 13 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.841 -0.127 26021 8307 1 13 . 1 1 75 75 VAL H H 75 7.740 7.740 8.020 -0.280 26021 8308 1 13 . 1 1 76 76 ILE N N 76 120.598 120.598 121.098 -0.500 26021 8309 1 13 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.625 0.075 26021 8310 1 13 . 1 1 76 76 ILE C C 76 177.066 177.066 178.075 -1.009 26021 8311 1 13 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.731 1.188 26021 8312 1 13 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.290 0.095 26021 8313 1 13 . 1 1 76 76 ILE H H 76 8.584 8.584 7.789 0.795 26021 8314 1 13 . 1 1 77 77 GLU N N 77 120.468 120.468 119.740 0.728 26021 8315 1 13 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.890 -0.241 26021 8316 1 13 . 1 1 77 77 GLU C C 77 177.502 177.502 178.630 -1.128 26021 8317 1 13 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.705 1.157 26021 8318 1 13 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.720 0.632 26021 8319 1 13 . 1 1 77 77 GLU H H 77 8.445 8.445 7.896 0.549 26021 8320 1 13 . 1 1 78 78 ASP N N 78 117.382 117.382 119.448 -2.066 26021 8321 1 13 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.387 0.004 26021 8322 1 13 . 1 1 78 78 ASP C C 78 177.382 177.382 177.913 -0.531 26021 8323 1 13 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.813 0.682 26021 8324 1 13 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.805 1.130 26021 8325 1 13 . 1 1 78 78 ASP H H 78 7.885 7.885 7.842 0.043 26021 8326 1 13 . 1 1 79 79 ALA N N 79 120.171 120.171 121.317 -1.146 26021 8327 1 13 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.048 0.002 26021 8328 1 13 . 1 1 79 79 ALA C C 79 181.193 181.193 179.718 1.475 26021 8329 1 13 . 1 1 79 79 ALA CA C 79 55.055 55.055 54.980 0.075 26021 8330 1 13 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.348 0.072 26021 8331 1 13 . 1 1 79 79 ALA H H 79 7.754 7.754 8.047 -0.293 26021 8332 1 13 . 1 1 80 80 VAL N N 80 119.541 119.541 112.846 6.695 26021 8333 1 13 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.869 -0.192 26021 8334 1 13 . 1 1 80 80 VAL C C 80 177.096 177.096 177.777 -0.681 26021 8335 1 13 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.787 2.297 26021 8336 1 13 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.987 -0.544 26021 8337 1 13 . 1 1 80 80 VAL H H 80 8.635 8.635 7.407 1.228 26021 8338 1 13 . 1 1 81 81 ASP N N 81 121.140 121.140 121.448 -0.308 26021 8339 1 13 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.362 0.107 26021 8340 1 13 . 1 1 81 81 ASP C C 81 179.569 179.569 177.997 1.572 26021 8341 1 13 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.133 0.796 26021 8342 1 13 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.539 -0.604 26021 8343 1 13 . 1 1 81 81 ASP H H 81 8.575 8.575 8.079 0.496 26021 8344 1 13 . 1 1 82 82 LYS N N 82 118.159 118.159 117.876 0.283 26021 8345 1 13 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.102 -0.081 26021 8346 1 13 . 1 1 82 82 LYS C C 82 178.890 178.890 177.897 0.993 26021 8347 1 13 . 1 1 82 82 LYS CA C 82 59.067 59.067 57.922 1.145 26021 8348 1 13 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.816 0.771 26021 8349 1 13 . 1 1 82 82 LYS H H 82 8.079 8.079 7.701 0.378 26021 8350 1 13 . 1 1 83 83 PHE N N 83 120.900 120.900 118.902 1.998 26021 8351 1 13 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.403 -0.127 26021 8352 1 13 . 1 1 83 83 PHE C C 83 177.269 177.269 177.320 -0.051 26021 8353 1 13 . 1 1 83 83 PHE CA C 83 60.943 60.943 61.013 -0.070 26021 8354 1 13 . 1 1 83 83 PHE CB C 83 39.747 39.747 40.024 -0.277 26021 8355 1 13 . 1 1 83 83 PHE H H 83 8.015 8.015 7.843 0.172 26021 8356 1 13 . 1 1 84 84 LEU N N 84 118.209 118.209 117.844 0.365 26021 8357 1 13 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.437 -0.495 26021 8358 1 13 . 1 1 84 84 LEU C C 84 178.774 178.774 178.231 0.543 26021 8359 1 13 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.246 -0.076 26021 8360 1 13 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.008 1.185 26021 8361 1 13 . 1 1 84 84 LEU H H 84 8.338 8.338 7.729 0.609 26021 8362 1 13 . 1 1 85 85 VAL N N 85 116.078 116.078 120.854 -4.776 26021 8363 1 13 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.733 0.258 26021 8364 1 13 . 1 1 85 85 VAL C C 85 177.252 177.252 177.050 0.202 26021 8365 1 13 . 1 1 85 85 VAL CA C 85 64.180 64.180 66.222 -2.042 26021 8366 1 13 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.864 0.026 26021 8367 1 13 . 1 1 85 85 VAL H H 85 7.447 7.447 7.998 -0.551 26021 8368 1 13 . 1 1 86 86 ARG N N 86 120.842 120.842 117.429 3.413 26021 8369 1 13 . 1 1 86 86 ARG HA H 86 4.227 4.227 3.997 0.230 26021 8370 1 13 . 1 1 86 86 ARG C C 86 177.520 177.520 178.940 -1.420 26021 8371 1 13 . 1 1 86 86 ARG CA C 86 57.059 57.059 59.440 -2.381 26021 8372 1 13 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.220 0.043 26021 8373 1 13 . 1 1 86 86 ARG H H 86 7.598 7.598 7.351 0.247 26021 8374 1 13 . 1 1 87 87 VAL N N 87 119.293 119.293 117.051 2.242 26021 8375 1 13 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.778 0.047 26021 8376 1 13 . 1 1 87 87 VAL C C 87 176.121 176.121 176.884 -0.763 26021 8377 1 13 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.170 -1.732 26021 8378 1 13 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.863 0.909 26021 8379 1 13 . 1 1 87 87 VAL H H 87 7.994 7.994 7.840 0.154 26021 8380 1 13 . 1 1 88 88 HIS N N 88 120.016 120.016 118.269 1.747 26021 8381 1 13 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.495 0.142 26021 8382 1 13 . 1 1 88 88 HIS C C 88 175.639 175.639 175.849 -0.210 26021 8383 1 13 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.489 -0.138 26021 8384 1 13 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.773 -1.092 26021 8385 1 13 . 1 1 88 88 HIS H H 88 7.969 7.969 8.126 -0.157 26021 8386 1 13 . 1 1 89 89 GLY N N 89 109.587 109.587 107.372 2.215 26021 8387 1 13 . 1 1 89 89 GLY C C 89 173.730 173.730 174.240 -0.510 26021 8388 1 13 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.245 -0.076 26021 8389 1 13 . 1 1 89 89 GLY H H 89 8.083 8.083 8.171 -0.088 26021 8390 1 13 . 1 1 90 90 VAL N N 90 118.224 118.224 121.459 -3.235 26021 8391 1 13 . 1 1 90 90 VAL HA H 90 4.138 4.138 3.853 0.285 26021 8392 1 13 . 1 1 90 90 VAL C C 90 176.018 176.018 174.728 1.290 26021 8393 1 13 . 1 1 90 90 VAL CA C 90 62.425 62.425 62.453 -0.028 26021 8394 1 13 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.387 0.229 26021 8395 1 13 . 1 1 90 90 VAL H H 90 7.944 7.944 7.716 0.228 26021 8396 1 13 . 1 1 91 91 GLU N N 91 124.313 124.313 123.575 0.738 26021 8397 1 13 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.645 -0.039 26021 8398 1 13 . 1 1 91 91 GLU CA C 91 54.176 54.176 53.332 0.844 26021 8399 1 13 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.890 -0.130 26021 8400 1 13 . 1 1 91 91 GLU H H 91 8.423 8.423 8.343 0.080 26021 8401 1 13 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.545 -0.208 26021 8402 1 13 . 1 1 92 92 PRO C C 92 176.504 176.504 175.682 0.822 26021 8403 1 13 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.219 0.152 26021 8404 1 13 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.326 -0.159 26021 8405 1 13 . 1 1 93 93 ASP N N 93 120.275 120.275 123.310 -3.035 26021 8406 1 13 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.681 -0.109 26021 8407 1 13 . 1 1 93 93 ASP CA C 93 53.970 53.970 52.924 1.046 26021 8408 1 13 . 1 1 93 93 ASP CB C 93 41.515 41.515 42.943 -1.428 26021 8409 1 13 . 1 1 93 93 ASP H H 93 8.286 8.286 8.035 0.251 26021 8410 1 13 . 1 1 94 94 ASP N N 94 121.181 121.181 116.724 4.457 26021 8411 1 13 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.517 0.048 26021 8412 1 13 . 1 1 94 94 ASP C C 94 176.474 176.474 177.099 -0.625 26021 8413 1 13 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.535 -1.162 26021 8414 1 13 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.215 0.010 26021 8415 1 13 . 1 1 94 94 ASP H H 94 8.259 8.259 8.609 -0.350 26021 8416 1 13 . 1 1 95 95 ASN N N 95 118.728 118.728 118.764 -0.036 26021 8417 1 13 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.593 0.101 26021 8418 1 13 . 1 1 95 95 ASN C C 95 176.272 176.272 178.130 -1.858 26021 8419 1 13 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.527 -1.541 26021 8420 1 13 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.302 0.427 26021 8421 1 13 . 1 1 95 95 ASN H H 95 8.474 8.474 8.504 -0.030 26021 8422 1 13 . 1 1 96 96 THR N N 96 113.868 113.868 115.801 -1.933 26021 8423 1 13 . 1 1 96 96 THR HA H 96 4.220 4.220 4.156 0.064 26021 8424 1 13 . 1 1 96 96 THR C C 96 175.107 175.107 175.725 -0.618 26021 8425 1 13 . 1 1 96 96 THR CA C 96 63.200 63.200 65.462 -2.262 26021 8426 1 13 . 1 1 96 96 THR CB C 96 69.475 69.475 68.593 0.882 26021 8427 1 13 . 1 1 96 96 THR H H 96 8.263 8.263 8.964 -0.701 26021 8428 1 13 . 1 1 97 97 ASN N N 97 119.954 119.954 118.628 1.326 26021 8429 1 13 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.494 0.122 26021 8430 1 13 . 1 1 97 97 ASN C C 97 176.275 176.275 176.530 -0.255 26021 8431 1 13 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.563 -0.607 26021 8432 1 13 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.204 0.488 26021 8433 1 13 . 1 1 97 97 ASN H H 97 8.431 8.431 7.764 0.667 26021 8434 1 13 . 1 1 98 98 GLY N N 98 108.847 108.847 106.037 2.810 26021 8435 1 13 . 1 1 98 98 GLY C C 98 175.533 175.533 175.340 0.193 26021 8436 1 13 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.525 -0.513 26021 8437 1 13 . 1 1 98 98 GLY H H 98 8.338 8.338 7.800 0.538 26021 8438 1 13 . 1 1 99 99 PHE N N 99 118.492 118.492 120.514 -2.022 26021 8439 1 13 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.302 -0.054 26021 8440 1 13 . 1 1 99 99 PHE CA C 99 60.959 60.959 58.896 2.063 26021 8441 1 13 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.274 -1.115 26021 8442 1 13 . 1 1 99 99 PHE H H 99 8.370 8.370 8.015 0.355 26021 8443 1 13 . 1 1 100 100 LYS N N 100 120.987 120.987 121.243 -0.256 26021 8444 1 13 . 1 1 100 100 LYS H H 100 8.256 8.256 8.530 -0.274 26021 8445 1 13 . 1 1 101 101 GLY N N 101 108.186 108.186 106.367 1.819 26021 8446 1 13 . 1 1 101 101 GLY C C 101 177.075 177.075 175.770 1.305 26021 8447 1 13 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.013 0.889 26021 8448 1 13 . 1 1 101 101 GLY H H 101 8.300 8.300 7.991 0.309 26021 8449 1 13 . 1 1 102 102 LEU N N 102 121.439 121.439 123.550 -2.111 26021 8450 1 13 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.106 -0.010 26021 8451 1 13 . 1 1 102 102 LEU C C 102 179.836 179.836 178.316 1.520 26021 8452 1 13 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.645 -0.286 26021 8453 1 13 . 1 1 102 102 LEU CB C 102 41.770 41.770 42.097 -0.327 26021 8454 1 13 . 1 1 102 102 LEU H H 102 7.777 7.777 7.663 0.114 26021 8455 1 13 . 1 1 103 103 MET N N 103 122.290 122.290 117.274 5.016 26021 8456 1 13 . 1 1 103 103 MET HA H 103 4.220 4.220 3.967 0.253 26021 8457 1 13 . 1 1 103 103 MET C C 103 177.739 177.739 177.926 -0.187 26021 8458 1 13 . 1 1 103 103 MET CA C 103 58.739 58.739 57.991 0.748 26021 8459 1 13 . 1 1 103 103 MET CB C 103 31.895 31.895 31.587 0.308 26021 8460 1 13 . 1 1 103 103 MET H H 103 8.409 8.409 8.135 0.274 26021 8461 1 13 . 1 1 104 104 LYS N N 104 119.750 119.750 117.484 2.266 26021 8462 1 13 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.065 0.002 26021 8463 1 13 . 1 1 104 104 LYS C C 104 179.301 179.301 179.376 -0.075 26021 8464 1 13 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.202 1.562 26021 8465 1 13 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.879 0.168 26021 8466 1 13 . 1 1 104 104 LYS H H 104 7.916 7.916 7.369 0.547 26021 8467 1 13 . 1 1 105 105 ARG N N 105 117.967 117.967 119.640 -1.673 26021 8468 1 13 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.174 -0.148 26021 8469 1 13 . 1 1 105 105 ARG C C 105 178.777 178.777 178.877 -0.100 26021 8470 1 13 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.487 -0.123 26021 8471 1 13 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.328 0.669 26021 8472 1 13 . 1 1 105 105 ARG H H 105 7.719 7.719 8.300 -0.581 26021 8473 1 13 . 1 1 106 106 THR N N 106 117.211 117.211 112.819 4.392 26021 8474 1 13 . 1 1 106 106 THR HA H 106 4.301 4.301 4.203 0.098 26021 8475 1 13 . 1 1 106 106 THR C C 106 176.254 176.254 176.123 0.131 26021 8476 1 13 . 1 1 106 106 THR CA C 106 67.860 67.860 66.361 1.500 26021 8477 1 13 . 1 1 106 106 THR CB C 106 67.860 67.860 68.625 -0.765 26021 8478 1 13 . 1 1 106 106 THR H H 106 8.152 8.152 8.274 -0.122 26021 8479 1 13 . 1 1 107 107 THR N N 107 117.939 117.939 116.575 1.364 26021 8480 1 13 . 1 1 107 107 THR HA H 107 3.971 3.971 3.960 0.011 26021 8481 1 13 . 1 1 107 107 THR C C 107 176.780 176.780 176.596 0.184 26021 8482 1 13 . 1 1 107 107 THR CA C 107 66.822 66.822 66.247 0.575 26021 8483 1 13 . 1 1 107 107 THR CB C 107 68.818 68.818 68.830 -0.012 26021 8484 1 13 . 1 1 107 107 THR H H 107 8.651 8.651 7.658 0.993 26021 8485 1 13 . 1 1 108 108 LYS N N 108 120.867 120.867 119.551 1.316 26021 8486 1 13 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.107 -0.085 26021 8487 1 13 . 1 1 108 108 LYS C C 108 179.045 179.045 178.127 0.918 26021 8488 1 13 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.651 1.183 26021 8489 1 13 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.151 0.322 26021 8490 1 13 . 1 1 108 108 LYS H H 108 7.694 7.694 7.601 0.093 26021 8491 1 13 . 1 1 109 109 LEU N N 109 119.472 119.472 118.180 1.292 26021 8492 1 13 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.186 0.135 26021 8493 1 13 . 1 1 109 109 LEU C C 109 179.974 179.974 178.796 1.178 26021 8494 1 13 . 1 1 109 109 LEU CA C 109 57.593 57.593 56.866 0.727 26021 8495 1 13 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.368 -0.508 26021 8496 1 13 . 1 1 109 109 LEU H H 109 7.559 7.559 7.606 -0.047 26021 8497 1 13 . 1 1 110 110 LEU N N 110 121.832 121.832 119.877 1.955 26021 8498 1 13 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.114 0.077 26021 8499 1 13 . 1 1 110 110 LEU C C 110 178.101 178.101 177.765 0.336 26021 8500 1 13 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.526 0.366 26021 8501 1 13 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.128 0.756 26021 8502 1 13 . 1 1 110 110 LEU H H 110 8.567 8.567 8.301 0.266 26021 8503 1 13 . 1 1 111 111 LYS N N 111 117.972 117.972 118.279 -0.307 26021 8504 1 13 . 1 1 111 111 LYS HA H 111 3.979 3.979 3.989 -0.010 26021 8505 1 13 . 1 1 111 111 LYS C C 111 177.677 177.677 177.768 -0.091 26021 8506 1 13 . 1 1 111 111 LYS CA C 111 58.785 58.785 59.026 -0.241 26021 8507 1 13 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.755 0.455 26021 8508 1 13 . 1 1 111 111 LYS H H 111 7.965 7.965 7.739 0.226 26021 8509 1 13 . 1 1 112 112 LYS N N 112 115.433 115.433 117.618 -2.185 26021 8510 1 13 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.040 0.070 26021 8511 1 13 . 1 1 112 112 LYS C C 112 178.270 178.270 178.120 0.150 26021 8512 1 13 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.865 0.086 26021 8513 1 13 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.912 -0.121 26021 8514 1 13 . 1 1 112 112 LYS H H 112 7.334 7.334 7.536 -0.202 26021 8515 1 13 . 1 1 113 113 VAL N N 113 114.861 114.861 117.631 -2.770 26021 8516 1 13 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.989 -0.158 26021 8517 1 13 . 1 1 113 113 VAL C C 113 176.999 176.999 177.909 -0.910 26021 8518 1 13 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.215 -1.710 26021 8519 1 13 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.039 1.248 26021 8520 1 13 . 1 1 113 113 VAL H H 113 7.298 7.298 7.484 -0.186 26021 8521 1 13 . 1 1 114 114 VAL N N 114 121.457 121.457 114.252 7.205 26021 8522 1 13 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.832 -0.110 26021 8523 1 13 . 1 1 114 114 VAL C C 114 177.737 177.737 177.419 0.318 26021 8524 1 13 . 1 1 114 114 VAL CA C 114 65.224 65.224 65.254 -0.030 26021 8525 1 13 . 1 1 114 114 VAL CB C 114 31.753 31.753 30.686 1.067 26021 8526 1 13 . 1 1 114 114 VAL H H 114 7.855 7.855 8.318 -0.463 26021 8527 1 13 . 1 1 115 115 ASP N N 115 120.804 120.804 122.806 -2.002 26021 8528 1 13 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.495 -0.040 26021 8529 1 13 . 1 1 115 115 ASP C C 115 177.380 177.380 177.653 -0.273 26021 8530 1 13 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.798 -0.877 26021 8531 1 13 . 1 1 115 115 ASP CB C 115 40.372 40.372 41.077 -0.705 26021 8532 1 13 . 1 1 115 115 ASP H H 115 8.311 8.311 7.831 0.480 26021 8533 1 13 . 1 1 116 116 LYS N N 116 119.582 119.582 117.384 2.198 26021 8534 1 13 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.299 -0.204 26021 8535 1 13 . 1 1 116 116 LYS C C 116 177.077 177.077 179.107 -2.030 26021 8536 1 13 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.666 0.045 26021 8537 1 13 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.003 0.485 26021 8538 1 13 . 1 1 116 116 LYS H H 116 7.639 7.639 7.747 -0.108 26021 8539 1 13 . 1 1 117 117 HIS N N 117 115.246 115.246 116.567 -1.321 26021 8540 1 13 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.440 0.185 26021 8541 1 13 . 1 1 117 117 HIS C C 117 175.497 175.497 176.734 -1.237 26021 8542 1 13 . 1 1 117 117 HIS CA C 117 56.175 56.175 57.368 -1.193 26021 8543 1 13 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.354 0.121 26021 8544 1 13 . 1 1 117 117 HIS H H 117 8.108 8.108 8.031 0.077 26021 8545 1 13 . 1 1 118 118 GLY N N 118 109.944 109.944 108.008 1.936 26021 8546 1 13 . 1 1 118 118 GLY C C 118 174.093 174.093 174.642 -0.549 26021 8547 1 13 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.521 0.543 26021 8548 1 13 . 1 1 118 118 GLY H H 118 8.153 8.153 8.104 0.049 26021 8549 1 13 . 1 1 119 119 ILE N N 119 118.468 118.468 120.353 -1.885 26021 8550 1 13 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.962 0.160 26021 8551 1 13 . 1 1 119 119 ILE C C 119 174.777 174.777 176.905 -2.128 26021 8552 1 13 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.439 -0.338 26021 8553 1 13 . 1 1 119 119 ILE CB C 119 38.631 38.631 37.484 1.147 26021 8554 1 13 . 1 1 119 119 ILE H H 119 7.828 7.828 7.303 0.525 26021 8555 1 14 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.600 0.149 26021 8556 1 14 . 1 1 4 4 ASN C C 4 175.260 175.260 175.538 -0.278 26021 8557 1 14 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.361 -0.530 26021 8558 1 14 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.272 0.409 26021 8559 1 14 . 1 1 5 5 ALA N N 5 123.648 123.648 122.030 1.618 26021 8560 1 14 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.591 -0.301 26021 8561 1 14 . 1 1 5 5 ALA C C 5 178.256 178.256 178.379 -0.123 26021 8562 1 14 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.492 1.589 26021 8563 1 14 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.208 -0.183 26021 8564 1 14 . 1 1 5 5 ALA H H 5 8.520 8.520 7.662 0.858 26021 8565 1 14 . 1 1 6 6 GLY N N 6 107.044 107.044 107.761 -0.717 26021 8566 1 14 . 1 1 6 6 GLY C C 6 174.961 174.961 175.281 -0.320 26021 8567 1 14 . 1 1 6 6 GLY CA C 6 45.830 45.830 47.008 -1.178 26021 8568 1 14 . 1 1 6 6 GLY H H 6 8.350 8.350 7.773 0.577 26021 8569 1 14 . 1 1 7 7 ALA N N 7 123.366 123.366 123.742 -0.376 26021 8570 1 14 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.125 0.091 26021 8571 1 14 . 1 1 7 7 ALA C C 7 179.006 179.006 178.626 0.380 26021 8572 1 14 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.660 -0.957 26021 8573 1 14 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.291 0.553 26021 8574 1 14 . 1 1 7 7 ALA H H 7 8.078 8.078 7.939 0.139 26021 8575 1 14 . 1 1 8 8 ILE N N 8 117.376 117.376 118.424 -1.048 26021 8576 1 14 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.725 0.055 26021 8577 1 14 . 1 1 8 8 ILE C C 8 177.032 177.032 178.279 -1.247 26021 8578 1 14 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.314 -1.156 26021 8579 1 14 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.930 -1.641 26021 8580 1 14 . 1 1 8 8 ILE H H 8 7.943 7.943 7.738 0.205 26021 8581 1 14 . 1 1 9 9 ALA N N 9 121.414 121.414 122.608 -1.194 26021 8582 1 14 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.070 -0.137 26021 8583 1 14 . 1 1 9 9 ALA C C 9 180.515 180.515 179.361 1.154 26021 8584 1 14 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.988 0.110 26021 8585 1 14 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.002 0.159 26021 8586 1 14 . 1 1 9 9 ALA H H 9 8.062 8.062 8.612 -0.550 26021 8587 1 14 . 1 1 10 10 LYS N N 10 114.594 114.594 118.372 -3.778 26021 8588 1 14 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.113 0.051 26021 8589 1 14 . 1 1 10 10 LYS C C 10 178.099 178.099 178.126 -0.027 26021 8590 1 14 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.381 -0.541 26021 8591 1 14 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.222 0.247 26021 8592 1 14 . 1 1 10 10 LYS H H 10 7.554 7.554 7.657 -0.103 26021 8593 1 14 . 1 1 11 11 LEU N N 11 119.662 119.662 119.006 0.656 26021 8594 1 14 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.138 -0.060 26021 8595 1 14 . 1 1 11 11 LEU C C 11 177.930 177.930 177.917 0.013 26021 8596 1 14 . 1 1 11 11 LEU CA C 11 56.556 56.556 55.940 0.616 26021 8597 1 14 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.650 1.438 26021 8598 1 14 . 1 1 11 11 LEU H H 11 7.814 7.814 7.611 0.203 26021 8599 1 14 . 1 1 12 12 ILE N N 12 117.945 117.945 120.580 -2.635 26021 8600 1 14 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.922 -0.230 26021 8601 1 14 . 1 1 12 12 ILE CA C 12 67.629 67.629 65.905 1.724 26021 8602 1 14 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.779 1.631 26021 8603 1 14 . 1 1 12 12 ILE H H 12 7.426 7.426 7.484 -0.058 26021 8604 1 14 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.317 0.086 26021 8605 1 14 . 1 1 13 13 PRO C C 13 179.030 179.030 178.704 0.326 26021 8606 1 14 . 1 1 13 13 PRO CA C 13 65.244 65.244 64.978 0.266 26021 8607 1 14 . 1 1 13 13 PRO CB C 13 30.809 30.809 30.976 -0.167 26021 8608 1 14 . 1 1 14 14 LYS N N 14 117.855 117.855 118.125 -0.270 26021 8609 1 14 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.081 0.064 26021 8610 1 14 . 1 1 14 14 LYS C C 14 178.565 178.565 178.280 0.285 26021 8611 1 14 . 1 1 14 14 LYS CA C 14 59.433 59.433 58.776 0.657 26021 8612 1 14 . 1 1 14 14 LYS CB C 14 32.925 32.925 31.910 1.015 26021 8613 1 14 . 1 1 14 14 LYS H H 14 6.685 6.685 7.598 -0.913 26021 8614 1 14 . 1 1 15 15 LEU N N 15 118.008 118.008 116.765 1.243 26021 8615 1 14 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.420 -0.417 26021 8616 1 14 . 1 1 15 15 LEU C C 15 178.662 178.662 179.077 -0.415 26021 8617 1 14 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.302 1.410 26021 8618 1 14 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.116 -0.117 26021 8619 1 14 . 1 1 15 15 LEU H H 15 8.148 8.148 7.474 0.674 26021 8620 1 14 . 1 1 16 16 GLY N N 16 103.895 103.895 108.785 -4.890 26021 8621 1 14 . 1 1 16 16 GLY C C 16 176.838 176.838 176.479 0.359 26021 8622 1 14 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.058 0.307 26021 8623 1 14 . 1 1 16 16 GLY H H 16 8.104 8.104 7.739 0.365 26021 8624 1 14 . 1 1 17 17 GLU N N 17 121.655 121.655 122.209 -0.554 26021 8625 1 14 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.182 -0.049 26021 8626 1 14 . 1 1 17 17 GLU C C 17 179.007 179.007 177.926 1.081 26021 8627 1 14 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.018 -0.207 26021 8628 1 14 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.807 -0.674 26021 8629 1 14 . 1 1 17 17 GLU H H 17 7.817 7.817 7.708 0.109 26021 8630 1 14 . 1 1 18 18 LEU N N 18 117.834 117.834 118.497 -0.663 26021 8631 1 14 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.523 -0.405 26021 8632 1 14 . 1 1 18 18 LEU C C 18 177.658 177.658 177.569 0.089 26021 8633 1 14 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.385 1.644 26021 8634 1 14 . 1 1 18 18 LEU CB C 18 41.670 41.670 42.052 -0.382 26021 8635 1 14 . 1 1 18 18 LEU H H 18 7.389 7.389 7.862 -0.473 26021 8636 1 14 . 1 1 19 19 LEU N N 19 113.694 113.694 117.613 -3.919 26021 8637 1 14 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.481 -0.319 26021 8638 1 14 . 1 1 19 19 LEU C C 19 178.123 178.123 177.775 0.348 26021 8639 1 14 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.026 0.826 26021 8640 1 14 . 1 1 19 19 LEU CB C 19 42.220 42.220 41.616 0.604 26021 8641 1 14 . 1 1 19 19 LEU H H 19 7.269 7.269 7.719 -0.450 26021 8642 1 14 . 1 1 20 20 VAL N N 20 112.778 112.778 113.977 -1.199 26021 8643 1 14 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.063 0.380 26021 8644 1 14 . 1 1 20 20 VAL C C 20 177.021 177.021 177.295 -0.274 26021 8645 1 14 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.777 -1.922 26021 8646 1 14 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.220 0.558 26021 8647 1 14 . 1 1 20 20 VAL H H 20 7.356 7.356 7.232 0.124 26021 8648 1 14 . 1 1 21 21 GLY N N 21 108.962 108.962 108.273 0.689 26021 8649 1 14 . 1 1 21 21 GLY C C 21 173.813 173.813 174.299 -0.486 26021 8650 1 14 . 1 1 21 21 GLY CA C 21 45.046 45.046 45.505 -0.459 26021 8651 1 14 . 1 1 21 21 GLY H H 21 7.925 7.925 8.414 -0.489 26021 8652 1 14 . 1 1 22 22 GLU N N 22 120.607 120.607 119.972 0.635 26021 8653 1 14 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.492 -0.214 26021 8654 1 14 . 1 1 22 22 GLU C C 22 175.869 175.869 175.063 0.806 26021 8655 1 14 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.460 0.570 26021 8656 1 14 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.301 -0.620 26021 8657 1 14 . 1 1 22 22 GLU H H 22 8.300 8.300 8.570 -0.270 26021 8658 1 14 . 1 1 23 23 TYR N N 23 120.738 120.738 121.186 -0.448 26021 8659 1 14 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.711 -0.154 26021 8660 1 14 . 1 1 23 23 TYR C C 23 175.264 175.264 175.573 -0.309 26021 8661 1 14 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.083 0.478 26021 8662 1 14 . 1 1 23 23 TYR CB C 23 39.246 39.246 40.350 -1.105 26021 8663 1 14 . 1 1 23 23 TYR H H 23 7.756 7.756 7.867 -0.111 26021 8664 1 14 . 1 1 24 24 LYS N N 24 122.095 122.095 122.501 -0.406 26021 8665 1 14 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.735 -0.552 26021 8666 1 14 . 1 1 24 24 LYS C C 24 175.742 175.742 174.945 0.797 26021 8667 1 14 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.141 -0.023 26021 8668 1 14 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.420 -0.701 26021 8669 1 14 . 1 1 24 24 LYS H H 24 8.692 8.692 8.655 0.037 26021 8670 1 14 . 1 1 25 25 LEU N N 25 121.123 121.123 116.985 4.138 26021 8671 1 14 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.569 -0.077 26021 8672 1 14 . 1 1 25 25 LEU C C 25 177.487 177.487 175.897 1.590 26021 8673 1 14 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.583 0.751 26021 8674 1 14 . 1 1 25 25 LEU CB C 25 43.758 43.758 42.526 1.232 26021 8675 1 14 . 1 1 25 25 LEU H H 25 8.088 8.088 7.387 0.701 26021 8676 1 14 . 1 1 26 26 HIS N N 26 122.993 122.993 118.527 4.466 26021 8677 1 14 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.552 -0.051 26021 8678 1 14 . 1 1 26 26 HIS C C 26 176.716 176.716 176.766 -0.050 26021 8679 1 14 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.014 1.183 26021 8680 1 14 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.501 0.856 26021 8681 1 14 . 1 1 26 26 HIS H H 26 8.882 8.882 8.145 0.737 26021 8682 1 14 . 1 1 27 27 LYS N N 27 124.894 124.894 124.515 0.379 26021 8683 1 14 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.253 -0.305 26021 8684 1 14 . 1 1 27 27 LYS C C 27 178.873 178.873 177.762 1.111 26021 8685 1 14 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.038 1.973 26021 8686 1 14 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.408 0.034 26021 8687 1 14 . 1 1 27 27 LYS H H 27 8.699 8.699 8.618 0.081 26021 8688 1 14 . 1 1 28 28 GLY N N 28 111.258 111.258 105.539 5.719 26021 8689 1 14 . 1 1 28 28 GLY C C 28 176.131 176.131 175.397 0.734 26021 8690 1 14 . 1 1 28 28 GLY CA C 28 46.490 46.490 45.873 0.617 26021 8691 1 14 . 1 1 28 28 GLY H H 28 9.814 9.814 8.321 1.493 26021 8692 1 14 . 1 1 29 29 VAL N N 29 122.719 122.719 122.226 0.493 26021 8693 1 14 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.506 0.386 26021 8694 1 14 . 1 1 29 29 VAL C C 29 177.628 177.628 177.269 0.359 26021 8695 1 14 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.869 -0.349 26021 8696 1 14 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.780 -0.038 26021 8697 1 14 . 1 1 29 29 VAL H H 29 7.431 7.431 7.410 0.021 26021 8698 1 14 . 1 1 30 30 LYS N N 30 119.791 119.791 117.605 2.186 26021 8699 1 14 . 1 1 30 30 LYS HA H 30 3.635 3.635 4.117 -0.482 26021 8700 1 14 . 1 1 30 30 LYS C C 30 177.666 177.666 178.001 -0.335 26021 8701 1 14 . 1 1 30 30 LYS CA C 30 61.024 61.024 58.975 2.049 26021 8702 1 14 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.471 0.934 26021 8703 1 14 . 1 1 30 30 LYS H H 30 8.255 8.255 8.316 -0.061 26021 8704 1 14 . 1 1 31 31 LYS N N 31 117.918 117.918 118.463 -0.545 26021 8705 1 14 . 1 1 31 31 LYS HA H 31 4.116 4.116 3.964 0.152 26021 8706 1 14 . 1 1 31 31 LYS C C 31 177.784 177.784 179.042 -1.258 26021 8707 1 14 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.146 -0.443 26021 8708 1 14 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.007 -0.162 26021 8709 1 14 . 1 1 31 31 LYS H H 31 7.689 7.689 7.670 0.019 26021 8710 1 14 . 1 1 32 32 ASN N N 32 116.347 116.347 117.352 -1.005 26021 8711 1 14 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.482 0.038 26021 8712 1 14 . 1 1 32 32 ASN C C 32 177.764 177.764 177.203 0.561 26021 8713 1 14 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.247 1.068 26021 8714 1 14 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.445 0.187 26021 8715 1 14 . 1 1 32 32 ASN H H 32 7.556 7.556 7.748 -0.192 26021 8716 1 14 . 1 1 33 33 ILE N N 33 120.592 120.592 119.344 1.248 26021 8717 1 14 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.785 -0.503 26021 8718 1 14 . 1 1 33 33 ILE C C 33 177.074 177.074 177.741 -0.667 26021 8719 1 14 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.207 2.681 26021 8720 1 14 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.029 0.149 26021 8721 1 14 . 1 1 33 33 ILE H H 33 8.236 8.236 7.478 0.758 26021 8722 1 14 . 1 1 34 34 GLU N N 34 120.595 120.595 120.038 0.557 26021 8723 1 14 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.903 -0.115 26021 8724 1 14 . 1 1 34 34 GLU C C 34 179.739 179.739 177.801 1.938 26021 8725 1 14 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.565 0.674 26021 8726 1 14 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.605 1.240 26021 8727 1 14 . 1 1 34 34 GLU H H 34 8.551 8.551 7.993 0.558 26021 8728 1 14 . 1 1 35 35 ASP N N 35 120.600 120.600 120.277 0.323 26021 8729 1 14 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.316 0.096 26021 8730 1 14 . 1 1 35 35 ASP C C 35 178.681 178.681 178.390 0.291 26021 8731 1 14 . 1 1 35 35 ASP CA C 35 57.462 57.462 57.176 0.286 26021 8732 1 14 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.321 -0.571 26021 8733 1 14 . 1 1 35 35 ASP H H 35 8.670 8.670 7.516 1.154 26021 8734 1 14 . 1 1 36 36 LEU N N 36 123.004 123.004 120.484 2.520 26021 8735 1 14 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.444 -0.349 26021 8736 1 14 . 1 1 36 36 LEU C C 36 178.035 178.035 179.476 -1.441 26021 8737 1 14 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.392 0.636 26021 8738 1 14 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.168 -0.292 26021 8739 1 14 . 1 1 36 36 LEU H H 36 8.166 8.166 7.452 0.714 26021 8740 1 14 . 1 1 37 37 LEU N N 37 120.178 120.178 119.623 0.555 26021 8741 1 14 . 1 1 37 37 LEU HA H 37 3.856 3.856 3.960 -0.104 26021 8742 1 14 . 1 1 37 37 LEU C C 37 178.128 178.128 178.432 -0.304 26021 8743 1 14 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.103 0.571 26021 8744 1 14 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.532 0.623 26021 8745 1 14 . 1 1 37 37 LEU H H 37 8.736 8.736 7.595 1.141 26021 8746 1 14 . 1 1 38 38 LYS N N 38 118.110 118.110 117.940 0.170 26021 8747 1 14 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.932 0.001 26021 8748 1 14 . 1 1 38 38 LYS C C 38 179.533 179.533 178.951 0.582 26021 8749 1 14 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.993 0.280 26021 8750 1 14 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.274 0.003 26021 8751 1 14 . 1 1 38 38 LYS H H 38 7.770 7.770 8.324 -0.554 26021 8752 1 14 . 1 1 39 39 GLU N N 39 119.265 119.265 119.581 -0.316 26021 8753 1 14 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.154 0.148 26021 8754 1 14 . 1 1 39 39 GLU C C 39 179.720 179.720 179.116 0.604 26021 8755 1 14 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.249 -0.491 26021 8756 1 14 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.877 -0.286 26021 8757 1 14 . 1 1 39 39 GLU H H 39 7.709 7.709 7.682 0.027 26021 8758 1 14 . 1 1 40 40 LEU N N 40 119.007 119.007 119.720 -0.713 26021 8759 1 14 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.130 -0.080 26021 8760 1 14 . 1 1 40 40 LEU C C 40 179.690 179.690 179.015 0.675 26021 8761 1 14 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.383 0.268 26021 8762 1 14 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.394 0.291 26021 8763 1 14 . 1 1 40 40 LEU H H 40 8.851 8.851 8.242 0.609 26021 8764 1 14 . 1 1 41 41 LYS N N 41 120.500 120.500 119.230 1.270 26021 8765 1 14 . 1 1 41 41 LYS HA H 41 3.952 3.952 3.992 -0.040 26021 8766 1 14 . 1 1 41 41 LYS C C 41 180.223 180.223 178.828 1.395 26021 8767 1 14 . 1 1 41 41 LYS CA C 41 60.891 60.891 60.228 0.663 26021 8768 1 14 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.254 -0.187 26021 8769 1 14 . 1 1 41 41 LYS H H 41 8.482 8.482 8.467 0.015 26021 8770 1 14 . 1 1 42 42 THR N N 42 119.555 119.555 111.258 8.297 26021 8771 1 14 . 1 1 42 42 THR HA H 42 4.000 4.000 4.224 -0.224 26021 8772 1 14 . 1 1 42 42 THR C C 42 176.633 176.633 176.411 0.222 26021 8773 1 14 . 1 1 42 42 THR CA C 42 66.574 66.574 64.917 1.657 26021 8774 1 14 . 1 1 42 42 THR CB C 42 67.924 67.924 68.538 -0.614 26021 8775 1 14 . 1 1 42 42 THR H H 42 7.863 7.863 7.544 0.319 26021 8776 1 14 . 1 1 43 43 MET N N 43 122.839 122.839 122.396 0.443 26021 8777 1 14 . 1 1 43 43 MET HA H 43 4.022 4.022 3.999 0.023 26021 8778 1 14 . 1 1 43 43 MET C C 43 177.290 177.290 178.122 -0.832 26021 8779 1 14 . 1 1 43 43 MET CA C 43 59.731 59.731 60.312 -0.581 26021 8780 1 14 . 1 1 43 43 MET CB C 43 33.610 33.610 32.324 1.286 26021 8781 1 14 . 1 1 43 43 MET H H 43 8.714 8.714 7.543 1.171 26021 8782 1 14 . 1 1 44 44 ASN N N 44 118.049 118.049 117.803 0.246 26021 8783 1 14 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.367 0.007 26021 8784 1 14 . 1 1 44 44 ASN C C 44 176.297 176.297 177.363 -1.066 26021 8785 1 14 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.470 0.424 26021 8786 1 14 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.586 0.820 26021 8787 1 14 . 1 1 44 44 ASN H H 44 8.988 8.988 8.462 0.526 26021 8788 1 14 . 1 1 45 45 ALA N N 45 119.260 119.260 121.028 -1.768 26021 8789 1 14 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.219 -0.153 26021 8790 1 14 . 1 1 45 45 ALA C C 45 180.476 180.476 179.152 1.324 26021 8791 1 14 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.384 0.884 26021 8792 1 14 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.216 -0.528 26021 8793 1 14 . 1 1 45 45 ALA H H 45 7.675 7.675 7.463 0.212 26021 8794 1 14 . 1 1 46 46 ALA N N 46 121.126 121.126 123.349 -2.223 26021 8795 1 14 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.075 0.041 26021 8796 1 14 . 1 1 46 46 ALA C C 46 179.314 179.314 179.127 0.187 26021 8797 1 14 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.284 -0.298 26021 8798 1 14 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.583 -0.361 26021 8799 1 14 . 1 1 46 46 ALA H H 46 7.872 7.872 7.657 0.215 26021 8800 1 14 . 1 1 47 47 LEU N N 47 119.328 119.328 116.199 3.129 26021 8801 1 14 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.987 0.204 26021 8802 1 14 . 1 1 47 47 LEU C C 47 180.403 180.403 178.510 1.893 26021 8803 1 14 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.999 0.047 26021 8804 1 14 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.344 0.606 26021 8805 1 14 . 1 1 47 47 LEU H H 47 8.529 8.529 7.650 0.879 26021 8806 1 14 . 1 1 48 48 ILE N N 48 121.653 121.653 118.558 3.095 26021 8807 1 14 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.696 0.006 26021 8808 1 14 . 1 1 48 48 ILE C C 48 178.730 178.730 178.123 0.607 26021 8809 1 14 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.619 0.291 26021 8810 1 14 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.673 0.239 26021 8811 1 14 . 1 1 48 48 ILE H H 48 8.386 8.386 7.120 1.266 26021 8812 1 14 . 1 1 49 49 LYS N N 49 119.896 119.896 119.047 0.849 26021 8813 1 14 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.160 -0.117 26021 8814 1 14 . 1 1 49 49 LYS C C 49 179.999 179.999 179.595 0.404 26021 8815 1 14 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.326 -0.269 26021 8816 1 14 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.811 -0.850 26021 8817 1 14 . 1 1 49 49 LYS H H 49 7.456 7.456 7.532 -0.076 26021 8818 1 14 . 1 1 50 50 ILE N N 50 119.964 119.964 116.203 3.761 26021 8819 1 14 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.097 -0.361 26021 8820 1 14 . 1 1 50 50 ILE C C 50 177.960 177.960 177.938 0.022 26021 8821 1 14 . 1 1 50 50 ILE CA C 50 64.349 64.349 64.149 0.200 26021 8822 1 14 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.681 0.451 26021 8823 1 14 . 1 1 50 50 ILE H H 50 8.154 8.154 8.763 -0.609 26021 8824 1 14 . 1 1 51 51 GLY N N 51 106.709 106.709 107.635 -0.926 26021 8825 1 14 . 1 1 51 51 GLY C C 51 174.461 174.461 175.099 -0.638 26021 8826 1 14 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.181 -0.272 26021 8827 1 14 . 1 1 51 51 GLY H H 51 7.932 7.932 7.867 0.065 26021 8828 1 14 . 1 1 52 52 GLU N N 52 118.736 118.736 119.531 -0.795 26021 8829 1 14 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.191 0.129 26021 8830 1 14 . 1 1 52 52 GLU C C 52 176.789 176.789 177.330 -0.541 26021 8831 1 14 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.492 -1.218 26021 8832 1 14 . 1 1 52 52 GLU CB C 52 30.112 30.112 29.997 0.115 26021 8833 1 14 . 1 1 52 52 GLU H H 52 7.597 7.597 7.611 -0.014 26021 8834 1 14 . 1 1 53 53 VAL N N 53 122.982 122.982 118.089 4.893 26021 8835 1 14 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.123 0.138 26021 8836 1 14 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.913 0.472 26021 8837 1 14 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.916 1.906 26021 8838 1 14 . 1 1 53 53 VAL H H 53 7.511 7.511 7.468 0.043 26021 8839 1 14 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.792 -0.147 26021 8840 1 14 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.516 0.062 26021 8841 1 14 . 1 1 54 54 PRO CB C 54 31.535 31.535 30.965 0.570 26021 8842 1 14 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.324 -0.133 26021 8843 1 14 . 1 1 55 55 PRO C C 55 178.258 178.258 176.629 1.629 26021 8844 1 14 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.128 1.300 26021 8845 1 14 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.908 -0.062 26021 8846 1 14 . 1 1 56 56 ASP N N 56 114.117 114.117 116.880 -2.763 26021 8847 1 14 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.467 0.024 26021 8848 1 14 . 1 1 56 56 ASP C C 56 176.696 176.696 177.633 -0.937 26021 8849 1 14 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.545 -0.407 26021 8850 1 14 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.723 -0.997 26021 8851 1 14 . 1 1 56 56 ASP H H 56 8.489 8.489 8.339 0.150 26021 8852 1 14 . 1 1 57 57 GLN N N 57 117.641 117.641 116.121 1.520 26021 8853 1 14 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.320 0.054 26021 8854 1 14 . 1 1 57 57 GLN C C 57 175.765 175.765 176.664 -0.899 26021 8855 1 14 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.569 -0.279 26021 8856 1 14 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.241 0.404 26021 8857 1 14 . 1 1 57 57 GLN H H 57 8.206 8.206 7.621 0.585 26021 8858 1 14 . 1 1 58 58 LEU N N 58 122.141 122.141 123.576 -1.435 26021 8859 1 14 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.176 0.274 26021 8860 1 14 . 1 1 58 58 LEU C C 58 176.849 176.849 176.199 0.650 26021 8861 1 14 . 1 1 58 58 LEU CA C 58 54.995 54.995 56.030 -1.035 26021 8862 1 14 . 1 1 58 58 LEU CB C 58 43.231 43.231 41.272 1.959 26021 8863 1 14 . 1 1 58 58 LEU H H 58 7.152 7.152 7.750 -0.598 26021 8864 1 14 . 1 1 59 59 ASP N N 59 125.643 125.643 125.675 -0.032 26021 8865 1 14 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.884 -0.165 26021 8866 1 14 . 1 1 59 59 ASP C C 59 177.249 177.249 176.989 0.260 26021 8867 1 14 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.970 0.433 26021 8868 1 14 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.830 -1.598 26021 8869 1 14 . 1 1 59 59 ASP H H 59 9.312 9.312 7.992 1.320 26021 8870 1 14 . 1 1 60 60 SER N N 60 116.550 116.550 115.081 1.469 26021 8871 1 14 . 1 1 60 60 SER HA H 60 4.124 4.124 4.272 -0.148 26021 8872 1 14 . 1 1 60 60 SER C C 60 176.840 176.840 176.145 0.695 26021 8873 1 14 . 1 1 60 60 SER CA C 60 61.722 61.722 61.229 0.493 26021 8874 1 14 . 1 1 60 60 SER CB C 60 62.815 62.815 63.431 -0.616 26021 8875 1 14 . 1 1 60 60 SER H H 60 8.647 8.647 8.640 0.007 26021 8876 1 14 . 1 1 61 61 GLN N N 61 121.394 121.394 121.186 0.208 26021 8877 1 14 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.179 -0.048 26021 8878 1 14 . 1 1 61 61 GLN C C 61 178.629 178.629 177.254 1.375 26021 8879 1 14 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.173 0.580 26021 8880 1 14 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.031 0.222 26021 8881 1 14 . 1 1 61 61 GLN H H 61 8.453 8.453 8.272 0.181 26021 8882 1 14 . 1 1 62 62 ASP N N 62 122.187 122.187 119.446 2.741 26021 8883 1 14 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.459 0.160 26021 8884 1 14 . 1 1 62 62 ASP C C 62 178.318 178.318 178.476 -0.158 26021 8885 1 14 . 1 1 62 62 ASP CA C 62 57.462 57.462 58.323 -0.861 26021 8886 1 14 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.675 0.361 26021 8887 1 14 . 1 1 62 62 ASP H H 62 8.311 8.311 8.794 -0.483 26021 8888 1 14 . 1 1 63 63 LYS N N 63 120.325 120.325 118.721 1.604 26021 8889 1 14 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.152 -0.143 26021 8890 1 14 . 1 1 63 63 LYS C C 63 178.765 178.765 178.794 -0.029 26021 8891 1 14 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.972 0.781 26021 8892 1 14 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.229 0.224 26021 8893 1 14 . 1 1 63 63 LYS H H 63 7.923 7.923 8.043 -0.120 26021 8894 1 14 . 1 1 64 64 LEU N N 64 119.491 119.491 120.019 -0.528 26021 8895 1 14 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.081 0.145 26021 8896 1 14 . 1 1 64 64 LEU C C 64 179.526 179.526 178.906 0.620 26021 8897 1 14 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.447 0.351 26021 8898 1 14 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.439 0.336 26021 8899 1 14 . 1 1 64 64 LEU H H 64 7.820 7.820 7.251 0.569 26021 8900 1 14 . 1 1 65 65 TRP N N 65 120.674 120.674 121.970 -1.296 26021 8901 1 14 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.488 -0.180 26021 8902 1 14 . 1 1 65 65 TRP C C 65 177.379 177.379 177.906 -0.527 26021 8903 1 14 . 1 1 65 65 TRP CA C 65 61.802 61.802 59.322 2.480 26021 8904 1 14 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.887 -0.476 26021 8905 1 14 . 1 1 65 65 TRP H H 65 8.196 8.196 8.144 0.052 26021 8906 1 14 . 1 1 66 66 ALA N N 66 120.606 120.606 120.685 -0.079 26021 8907 1 14 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.519 0.190 26021 8908 1 14 . 1 1 66 66 ALA C C 66 180.376 180.376 179.041 1.335 26021 8909 1 14 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.714 0.850 26021 8910 1 14 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.888 -0.234 26021 8911 1 14 . 1 1 66 66 ALA H H 66 8.305 8.305 7.531 0.774 26021 8912 1 14 . 1 1 67 67 ASP N N 67 119.175 119.175 118.994 0.181 26021 8913 1 14 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.234 0.216 26021 8914 1 14 . 1 1 67 67 ASP C C 67 178.757 178.757 178.129 0.628 26021 8915 1 14 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.691 -0.199 26021 8916 1 14 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.920 -0.766 26021 8917 1 14 . 1 1 67 67 ASP H H 67 7.945 7.945 8.038 -0.093 26021 8918 1 14 . 1 1 68 68 GLU N N 68 122.322 122.322 118.753 3.569 26021 8919 1 14 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.227 -0.212 26021 8920 1 14 . 1 1 68 68 GLU C C 68 180.055 180.055 179.179 0.876 26021 8921 1 14 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.264 0.846 26021 8922 1 14 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.783 -0.136 26021 8923 1 14 . 1 1 68 68 GLU H H 68 8.168 8.168 7.758 0.410 26021 8924 1 14 . 1 1 69 69 VAL N N 69 122.135 122.135 117.677 4.458 26021 8925 1 14 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.733 -0.481 26021 8926 1 14 . 1 1 69 69 VAL C C 69 177.736 177.736 177.796 -0.060 26021 8927 1 14 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.718 0.821 26021 8928 1 14 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.206 0.036 26021 8929 1 14 . 1 1 69 69 VAL H H 69 8.424 8.424 7.115 1.309 26021 8930 1 14 . 1 1 70 70 ARG N N 70 121.373 121.373 119.546 1.827 26021 8931 1 14 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.971 -0.279 26021 8932 1 14 . 1 1 70 70 ARG C C 70 179.117 179.117 178.815 0.302 26021 8933 1 14 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.994 1.171 26021 8934 1 14 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.911 -0.257 26021 8935 1 14 . 1 1 70 70 ARG H H 70 7.916 7.916 7.848 0.068 26021 8936 1 14 . 1 1 71 71 GLU N N 71 119.075 119.075 119.656 -0.581 26021 8937 1 14 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.859 0.204 26021 8938 1 14 . 1 1 71 71 GLU C C 71 179.119 179.119 178.977 0.142 26021 8939 1 14 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.080 0.607 26021 8940 1 14 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.718 0.552 26021 8941 1 14 . 1 1 71 71 GLU H H 71 8.031 8.031 8.423 -0.392 26021 8942 1 14 . 1 1 72 72 LEU N N 72 120.503 120.503 121.037 -0.534 26021 8943 1 14 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.059 -0.002 26021 8944 1 14 . 1 1 72 72 LEU C C 72 178.734 178.734 178.471 0.263 26021 8945 1 14 . 1 1 72 72 LEU CA C 72 57.422 57.422 57.069 0.353 26021 8946 1 14 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.621 -0.213 26021 8947 1 14 . 1 1 72 72 LEU H H 72 8.175 8.175 7.522 0.653 26021 8948 1 14 . 1 1 73 73 SER N N 73 115.243 115.243 114.832 0.411 26021 8949 1 14 . 1 1 73 73 SER HA H 73 3.824 3.824 4.023 -0.199 26021 8950 1 14 . 1 1 73 73 SER C C 73 175.697 175.697 176.378 -0.681 26021 8951 1 14 . 1 1 73 73 SER CA C 73 62.384 62.384 61.039 1.345 26021 8952 1 14 . 1 1 73 73 SER CB C 73 62.093 62.093 62.788 -0.695 26021 8953 1 14 . 1 1 73 73 SER H H 73 8.411 8.411 8.086 0.325 26021 8954 1 14 . 1 1 74 74 TYR N N 74 121.342 121.342 119.570 1.772 26021 8955 1 14 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.240 0.251 26021 8956 1 14 . 1 1 74 74 TYR C C 74 178.747 178.747 178.617 0.130 26021 8957 1 14 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.799 -0.364 26021 8958 1 14 . 1 1 74 74 TYR CB C 74 37.507 37.507 37.876 -0.369 26021 8959 1 14 . 1 1 74 74 TYR H H 74 7.314 7.314 7.764 -0.450 26021 8960 1 14 . 1 1 75 75 VAL N N 75 120.779 120.779 120.166 0.613 26021 8961 1 14 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.749 0.112 26021 8962 1 14 . 1 1 75 75 VAL C C 75 179.788 179.788 178.107 1.681 26021 8963 1 14 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.200 0.848 26021 8964 1 14 . 1 1 75 75 VAL CB C 75 31.714 31.714 30.959 0.756 26021 8965 1 14 . 1 1 75 75 VAL H H 75 7.740 7.740 7.723 0.017 26021 8966 1 14 . 1 1 76 76 ILE N N 76 120.598 120.598 119.386 1.212 26021 8967 1 14 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.625 0.075 26021 8968 1 14 . 1 1 76 76 ILE C C 76 177.066 177.066 177.843 -0.777 26021 8969 1 14 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.942 0.977 26021 8970 1 14 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.207 0.178 26021 8971 1 14 . 1 1 76 76 ILE H H 76 8.584 8.584 7.569 1.015 26021 8972 1 14 . 1 1 77 77 GLU N N 77 120.468 120.468 120.637 -0.169 26021 8973 1 14 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.895 -0.246 26021 8974 1 14 . 1 1 77 77 GLU C C 77 177.502 177.502 178.321 -0.819 26021 8975 1 14 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.821 1.041 26021 8976 1 14 . 1 1 77 77 GLU CB C 77 29.352 29.352 29.228 0.124 26021 8977 1 14 . 1 1 77 77 GLU H H 77 8.445 8.445 7.868 0.577 26021 8978 1 14 . 1 1 78 78 ASP N N 78 117.382 117.382 119.599 -2.217 26021 8979 1 14 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.358 0.033 26021 8980 1 14 . 1 1 78 78 ASP C C 78 177.382 177.382 177.949 -0.567 26021 8981 1 14 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.764 0.731 26021 8982 1 14 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.588 1.347 26021 8983 1 14 . 1 1 78 78 ASP H H 78 7.885 7.885 7.881 0.004 26021 8984 1 14 . 1 1 79 79 ALA N N 79 120.171 120.171 121.837 -1.666 26021 8985 1 14 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.030 0.020 26021 8986 1 14 . 1 1 79 79 ALA C C 79 181.193 181.193 179.787 1.406 26021 8987 1 14 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.039 0.016 26021 8988 1 14 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.510 -0.090 26021 8989 1 14 . 1 1 79 79 ALA H H 79 7.754 7.754 7.914 -0.160 26021 8990 1 14 . 1 1 80 80 VAL N N 80 119.541 119.541 118.756 0.785 26021 8991 1 14 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.646 0.031 26021 8992 1 14 . 1 1 80 80 VAL C C 80 177.096 177.096 177.954 -0.858 26021 8993 1 14 . 1 1 80 80 VAL CA C 80 67.084 67.084 66.061 1.023 26021 8994 1 14 . 1 1 80 80 VAL CB C 80 31.443 31.443 30.687 0.756 26021 8995 1 14 . 1 1 80 80 VAL H H 80 8.635 8.635 7.617 1.018 26021 8996 1 14 . 1 1 81 81 ASP N N 81 121.140 121.140 119.667 1.473 26021 8997 1 14 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.376 0.093 26021 8998 1 14 . 1 1 81 81 ASP C C 81 179.569 179.569 177.746 1.823 26021 8999 1 14 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.250 0.679 26021 9000 1 14 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.770 -0.835 26021 9001 1 14 . 1 1 81 81 ASP H H 81 8.575 8.575 7.788 0.787 26021 9002 1 14 . 1 1 82 82 LYS N N 82 118.159 118.159 118.321 -0.162 26021 9003 1 14 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.037 -0.016 26021 9004 1 14 . 1 1 82 82 LYS C C 82 178.890 178.890 177.920 0.970 26021 9005 1 14 . 1 1 82 82 LYS CA C 82 59.067 59.067 57.973 1.094 26021 9006 1 14 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.622 0.965 26021 9007 1 14 . 1 1 82 82 LYS H H 82 8.079 8.079 7.818 0.261 26021 9008 1 14 . 1 1 83 83 PHE N N 83 120.900 120.900 118.477 2.423 26021 9009 1 14 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.278 -0.002 26021 9010 1 14 . 1 1 83 83 PHE C C 83 177.269 177.269 177.150 0.119 26021 9011 1 14 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.738 0.205 26021 9012 1 14 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.983 -0.236 26021 9013 1 14 . 1 1 83 83 PHE H H 83 8.015 8.015 7.515 0.500 26021 9014 1 14 . 1 1 84 84 LEU N N 84 118.209 118.209 118.279 -0.070 26021 9015 1 14 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.321 -0.379 26021 9016 1 14 . 1 1 84 84 LEU C C 84 178.774 178.774 178.066 0.708 26021 9017 1 14 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.102 0.068 26021 9018 1 14 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.291 0.902 26021 9019 1 14 . 1 1 84 84 LEU H H 84 8.338 8.338 7.732 0.606 26021 9020 1 14 . 1 1 85 85 VAL N N 85 116.078 116.078 120.953 -4.875 26021 9021 1 14 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.671 0.320 26021 9022 1 14 . 1 1 85 85 VAL C C 85 177.252 177.252 177.303 -0.051 26021 9023 1 14 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.637 -1.457 26021 9024 1 14 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.473 0.417 26021 9025 1 14 . 1 1 85 85 VAL H H 85 7.447 7.447 8.021 -0.574 26021 9026 1 14 . 1 1 86 86 ARG N N 86 120.842 120.842 118.302 2.540 26021 9027 1 14 . 1 1 86 86 ARG HA H 86 4.227 4.227 3.983 0.244 26021 9028 1 14 . 1 1 86 86 ARG C C 86 177.520 177.520 179.050 -1.530 26021 9029 1 14 . 1 1 86 86 ARG CA C 86 57.059 57.059 59.446 -2.387 26021 9030 1 14 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.211 0.052 26021 9031 1 14 . 1 1 86 86 ARG H H 86 7.598 7.598 7.413 0.185 26021 9032 1 14 . 1 1 87 87 VAL N N 87 119.293 119.293 114.746 4.547 26021 9033 1 14 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.946 -0.121 26021 9034 1 14 . 1 1 87 87 VAL C C 87 176.121 176.121 176.922 -0.801 26021 9035 1 14 . 1 1 87 87 VAL CA C 87 63.438 63.438 64.824 -1.386 26021 9036 1 14 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.620 0.152 26021 9037 1 14 . 1 1 87 87 VAL H H 87 7.994 7.994 7.635 0.359 26021 9038 1 14 . 1 1 88 88 HIS N N 88 120.016 120.016 119.323 0.693 26021 9039 1 14 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.365 0.272 26021 9040 1 14 . 1 1 88 88 HIS C C 88 175.639 175.639 175.884 -0.245 26021 9041 1 14 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.661 -0.310 26021 9042 1 14 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.172 -0.491 26021 9043 1 14 . 1 1 88 88 HIS H H 88 7.969 7.969 8.192 -0.223 26021 9044 1 14 . 1 1 89 89 GLY N N 89 109.587 109.587 106.743 2.844 26021 9045 1 14 . 1 1 89 89 GLY C C 89 173.730 173.730 173.700 0.030 26021 9046 1 14 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.227 -0.059 26021 9047 1 14 . 1 1 89 89 GLY H H 89 8.083 8.083 7.818 0.265 26021 9048 1 14 . 1 1 90 90 VAL N N 90 118.224 118.224 122.156 -3.932 26021 9049 1 14 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.254 -0.116 26021 9050 1 14 . 1 1 90 90 VAL C C 90 176.018 176.018 173.905 2.113 26021 9051 1 14 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.917 1.508 26021 9052 1 14 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.001 -0.385 26021 9053 1 14 . 1 1 90 90 VAL H H 90 7.944 7.944 7.868 0.076 26021 9054 1 14 . 1 1 91 91 GLU N N 91 124.313 124.313 124.805 -0.492 26021 9055 1 14 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.661 -0.055 26021 9056 1 14 . 1 1 91 91 GLU CA C 91 54.176 54.176 52.447 1.729 26021 9057 1 14 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.831 -0.071 26021 9058 1 14 . 1 1 91 91 GLU H H 91 8.423 8.423 8.258 0.165 26021 9059 1 14 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.515 -0.178 26021 9060 1 14 . 1 1 92 92 PRO C C 92 176.504 176.504 175.658 0.846 26021 9061 1 14 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.152 0.220 26021 9062 1 14 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.145 0.022 26021 9063 1 14 . 1 1 93 93 ASP N N 93 120.275 120.275 123.209 -2.934 26021 9064 1 14 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.809 -0.237 26021 9065 1 14 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.139 0.831 26021 9066 1 14 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.902 -3.387 26021 9067 1 14 . 1 1 93 93 ASP H H 93 8.286 8.286 7.887 0.399 26021 9068 1 14 . 1 1 94 94 ASP N N 94 121.181 121.181 119.937 1.244 26021 9069 1 14 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.522 0.043 26021 9070 1 14 . 1 1 94 94 ASP C C 94 176.474 176.474 177.691 -1.217 26021 9071 1 14 . 1 1 94 94 ASP CA C 94 54.373 54.373 56.552 -2.179 26021 9072 1 14 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.420 -0.195 26021 9073 1 14 . 1 1 94 94 ASP H H 94 8.259 8.259 8.735 -0.476 26021 9074 1 14 . 1 1 95 95 ASN N N 95 118.728 118.728 117.010 1.718 26021 9075 1 14 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.710 -0.016 26021 9076 1 14 . 1 1 95 95 ASN C C 95 176.272 176.272 177.431 -1.159 26021 9077 1 14 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.453 -1.467 26021 9078 1 14 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.475 0.254 26021 9079 1 14 . 1 1 95 95 ASN H H 95 8.474 8.474 8.298 0.176 26021 9080 1 14 . 1 1 96 96 THR N N 96 113.868 113.868 115.719 -1.851 26021 9081 1 14 . 1 1 96 96 THR HA H 96 4.220 4.220 3.991 0.229 26021 9082 1 14 . 1 1 96 96 THR C C 96 175.107 175.107 175.766 -0.659 26021 9083 1 14 . 1 1 96 96 THR CA C 96 63.200 63.200 65.478 -2.279 26021 9084 1 14 . 1 1 96 96 THR CB C 96 69.475 69.475 68.082 1.393 26021 9085 1 14 . 1 1 96 96 THR H H 96 8.263 8.263 8.435 -0.172 26021 9086 1 14 . 1 1 97 97 ASN N N 97 119.954 119.954 119.108 0.846 26021 9087 1 14 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.475 0.141 26021 9088 1 14 . 1 1 97 97 ASN C C 97 176.275 176.275 176.637 -0.362 26021 9089 1 14 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.876 -0.920 26021 9090 1 14 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.573 0.119 26021 9091 1 14 . 1 1 97 97 ASN H H 97 8.431 8.431 7.695 0.736 26021 9092 1 14 . 1 1 98 98 GLY N N 98 108.847 108.847 107.327 1.520 26021 9093 1 14 . 1 1 98 98 GLY C C 98 175.533 175.533 175.110 0.423 26021 9094 1 14 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.214 -0.202 26021 9095 1 14 . 1 1 98 98 GLY H H 98 8.338 8.338 8.260 0.078 26021 9096 1 14 . 1 1 99 99 PHE N N 99 118.492 118.492 120.388 -1.896 26021 9097 1 14 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.095 0.153 26021 9098 1 14 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.224 0.736 26021 9099 1 14 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.226 -1.067 26021 9100 1 14 . 1 1 99 99 PHE H H 99 8.370 8.370 8.151 0.219 26021 9101 1 14 . 1 1 100 100 LYS N N 100 120.987 120.987 118.857 2.130 26021 9102 1 14 . 1 1 100 100 LYS H H 100 8.256 8.256 8.302 -0.046 26021 9103 1 14 . 1 1 101 101 GLY N N 101 108.186 108.186 107.795 0.391 26021 9104 1 14 . 1 1 101 101 GLY C C 101 177.075 177.075 175.581 1.494 26021 9105 1 14 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.211 0.692 26021 9106 1 14 . 1 1 101 101 GLY H H 101 8.300 8.300 7.761 0.539 26021 9107 1 14 . 1 1 102 102 LEU N N 102 121.439 121.439 123.336 -1.897 26021 9108 1 14 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.048 0.049 26021 9109 1 14 . 1 1 102 102 LEU C C 102 179.836 179.836 178.403 1.433 26021 9110 1 14 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.483 -0.125 26021 9111 1 14 . 1 1 102 102 LEU CB C 102 41.770 41.770 42.149 -0.379 26021 9112 1 14 . 1 1 102 102 LEU H H 102 7.777 7.777 7.554 0.223 26021 9113 1 14 . 1 1 103 103 MET N N 103 122.290 122.290 118.901 3.389 26021 9114 1 14 . 1 1 103 103 MET HA H 103 4.220 4.220 3.917 0.303 26021 9115 1 14 . 1 1 103 103 MET C C 103 177.739 177.739 177.895 -0.156 26021 9116 1 14 . 1 1 103 103 MET CA C 103 58.739 58.739 58.210 0.529 26021 9117 1 14 . 1 1 103 103 MET CB C 103 31.895 31.895 31.472 0.423 26021 9118 1 14 . 1 1 103 103 MET H H 103 8.409 8.409 8.137 0.272 26021 9119 1 14 . 1 1 104 104 LYS N N 104 119.750 119.750 118.089 1.661 26021 9120 1 14 . 1 1 104 104 LYS HA H 104 4.067 4.067 3.945 0.122 26021 9121 1 14 . 1 1 104 104 LYS C C 104 179.301 179.301 179.846 -0.545 26021 9122 1 14 . 1 1 104 104 LYS CA C 104 59.764 59.764 59.181 0.583 26021 9123 1 14 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.572 0.475 26021 9124 1 14 . 1 1 104 104 LYS H H 104 7.916 7.916 7.600 0.316 26021 9125 1 14 . 1 1 105 105 ARG N N 105 117.967 117.967 117.959 0.008 26021 9126 1 14 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.106 -0.080 26021 9127 1 14 . 1 1 105 105 ARG C C 105 178.777 178.777 178.623 0.154 26021 9128 1 14 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.454 -0.090 26021 9129 1 14 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.407 0.590 26021 9130 1 14 . 1 1 105 105 ARG H H 105 7.719 7.719 8.005 -0.286 26021 9131 1 14 . 1 1 106 106 THR N N 106 117.211 117.211 112.755 4.456 26021 9132 1 14 . 1 1 106 106 THR HA H 106 4.301 4.301 4.265 0.036 26021 9133 1 14 . 1 1 106 106 THR C C 106 176.254 176.254 176.242 0.012 26021 9134 1 14 . 1 1 106 106 THR CA C 106 67.860 67.860 65.823 2.037 26021 9135 1 14 . 1 1 106 106 THR CB C 106 67.860 67.860 68.894 -1.034 26021 9136 1 14 . 1 1 106 106 THR H H 106 8.152 8.152 8.004 0.148 26021 9137 1 14 . 1 1 107 107 THR N N 107 117.939 117.939 116.921 1.018 26021 9138 1 14 . 1 1 107 107 THR HA H 107 3.971 3.971 3.944 0.027 26021 9139 1 14 . 1 1 107 107 THR C C 107 176.780 176.780 176.069 0.711 26021 9140 1 14 . 1 1 107 107 THR CA C 107 66.822 66.822 66.013 0.809 26021 9141 1 14 . 1 1 107 107 THR CB C 107 68.818 68.818 68.516 0.302 26021 9142 1 14 . 1 1 107 107 THR H H 107 8.651 8.651 8.494 0.157 26021 9143 1 14 . 1 1 108 108 LYS N N 108 120.867 120.867 121.175 -0.308 26021 9144 1 14 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.054 -0.032 26021 9145 1 14 . 1 1 108 108 LYS C C 108 179.045 179.045 179.225 -0.180 26021 9146 1 14 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.169 0.665 26021 9147 1 14 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.087 0.386 26021 9148 1 14 . 1 1 108 108 LYS H H 108 7.694 7.694 7.572 0.122 26021 9149 1 14 . 1 1 109 109 LEU N N 109 119.472 119.472 118.665 0.807 26021 9150 1 14 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.261 0.060 26021 9151 1 14 . 1 1 109 109 LEU C C 109 179.974 179.974 179.335 0.639 26021 9152 1 14 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.332 0.261 26021 9153 1 14 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.163 -0.303 26021 9154 1 14 . 1 1 109 109 LEU H H 109 7.559 7.559 7.728 -0.169 26021 9155 1 14 . 1 1 110 110 LEU N N 110 121.832 121.832 120.062 1.770 26021 9156 1 14 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.060 0.131 26021 9157 1 14 . 1 1 110 110 LEU C C 110 178.101 178.101 179.022 -0.921 26021 9158 1 14 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.680 0.212 26021 9159 1 14 . 1 1 110 110 LEU CB C 110 41.884 41.884 40.651 1.234 26021 9160 1 14 . 1 1 110 110 LEU H H 110 8.567 8.567 8.392 0.175 26021 9161 1 14 . 1 1 111 111 LYS N N 111 117.972 117.972 117.542 0.430 26021 9162 1 14 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.098 -0.119 26021 9163 1 14 . 1 1 111 111 LYS C C 111 177.677 177.677 178.740 -1.063 26021 9164 1 14 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.196 0.589 26021 9165 1 14 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.933 0.276 26021 9166 1 14 . 1 1 111 111 LYS H H 111 7.965 7.965 8.296 -0.331 26021 9167 1 14 . 1 1 112 112 LYS N N 112 115.433 115.433 118.624 -3.191 26021 9168 1 14 . 1 1 112 112 LYS HA H 112 4.110 4.110 3.898 0.212 26021 9169 1 14 . 1 1 112 112 LYS C C 112 178.270 178.270 177.969 0.301 26021 9170 1 14 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.170 0.781 26021 9171 1 14 . 1 1 112 112 LYS CB C 112 32.791 32.791 31.641 1.150 26021 9172 1 14 . 1 1 112 112 LYS H H 112 7.334 7.334 7.694 -0.360 26021 9173 1 14 . 1 1 113 113 VAL N N 113 114.861 114.861 117.253 -2.392 26021 9174 1 14 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.897 -0.066 26021 9175 1 14 . 1 1 113 113 VAL C C 113 176.999 176.999 177.516 -0.517 26021 9176 1 14 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.078 -1.573 26021 9177 1 14 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.861 0.426 26021 9178 1 14 . 1 1 113 113 VAL H H 113 7.298 7.298 7.214 0.084 26021 9179 1 14 . 1 1 114 114 VAL N N 114 121.457 121.457 120.670 0.787 26021 9180 1 14 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.678 0.044 26021 9181 1 14 . 1 1 114 114 VAL C C 114 177.737 177.737 178.307 -0.570 26021 9182 1 14 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.689 -1.465 26021 9183 1 14 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.427 0.326 26021 9184 1 14 . 1 1 114 114 VAL H H 114 7.855 7.855 7.258 0.597 26021 9185 1 14 . 1 1 115 115 ASP N N 115 120.804 120.804 118.017 2.787 26021 9186 1 14 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.450 0.005 26021 9187 1 14 . 1 1 115 115 ASP C C 115 177.380 177.380 177.007 0.373 26021 9188 1 14 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.051 -0.130 26021 9189 1 14 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.766 -0.394 26021 9190 1 14 . 1 1 115 115 ASP H H 115 8.311 8.311 7.849 0.462 26021 9191 1 14 . 1 1 116 116 LYS N N 116 119.582 119.582 118.265 1.317 26021 9192 1 14 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.140 -0.045 26021 9193 1 14 . 1 1 116 116 LYS C C 116 177.077 177.077 177.857 -0.780 26021 9194 1 14 . 1 1 116 116 LYS CA C 116 57.711 57.711 58.069 -0.358 26021 9195 1 14 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.803 -0.315 26021 9196 1 14 . 1 1 116 116 LYS H H 116 7.639 7.639 7.611 0.028 26021 9197 1 14 . 1 1 117 117 HIS N N 117 115.246 115.246 112.500 2.746 26021 9198 1 14 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.795 -0.170 26021 9199 1 14 . 1 1 117 117 HIS C C 117 175.497 175.497 175.680 -0.183 26021 9200 1 14 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.690 -0.515 26021 9201 1 14 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.495 -2.020 26021 9202 1 14 . 1 1 117 117 HIS H H 117 8.108 8.108 8.545 -0.437 26021 9203 1 14 . 1 1 118 118 GLY N N 118 109.944 109.944 109.298 0.646 26021 9204 1 14 . 1 1 118 118 GLY C C 118 174.093 174.093 173.948 0.145 26021 9205 1 14 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.026 1.038 26021 9206 1 14 . 1 1 118 118 GLY H H 118 8.153 8.153 7.831 0.322 26021 9207 1 14 . 1 1 119 119 ILE N N 119 118.468 118.468 122.302 -3.834 26021 9208 1 14 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.959 0.163 26021 9209 1 14 . 1 1 119 119 ILE C C 119 174.777 174.777 175.413 -0.636 26021 9210 1 14 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.468 -0.367 26021 9211 1 14 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.477 2.154 26021 9212 1 14 . 1 1 119 119 ILE H H 119 7.828 7.828 7.721 0.107 26021 9213 1 15 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.707 0.042 26021 9214 1 15 . 1 1 4 4 ASN C C 4 175.260 175.260 175.168 0.092 26021 9215 1 15 . 1 1 4 4 ASN CA C 4 53.831 53.831 53.264 0.567 26021 9216 1 15 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.836 -0.155 26021 9217 1 15 . 1 1 5 5 ALA N N 5 123.648 123.648 122.195 1.453 26021 9218 1 15 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.611 -0.321 26021 9219 1 15 . 1 1 5 5 ALA C C 5 178.256 178.256 178.263 -0.007 26021 9220 1 15 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.732 1.349 26021 9221 1 15 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.239 -0.214 26021 9222 1 15 . 1 1 5 5 ALA H H 5 8.520 8.520 8.190 0.330 26021 9223 1 15 . 1 1 6 6 GLY N N 6 107.044 107.044 108.404 -1.360 26021 9224 1 15 . 1 1 6 6 GLY C C 6 174.961 174.961 175.222 -0.261 26021 9225 1 15 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.709 -0.879 26021 9226 1 15 . 1 1 6 6 GLY H H 6 8.350 8.350 8.015 0.335 26021 9227 1 15 . 1 1 7 7 ALA N N 7 123.366 123.366 123.964 -0.598 26021 9228 1 15 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.117 0.099 26021 9229 1 15 . 1 1 7 7 ALA C C 7 179.006 179.006 178.699 0.307 26021 9230 1 15 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.700 -0.998 26021 9231 1 15 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.264 0.580 26021 9232 1 15 . 1 1 7 7 ALA H H 7 8.078 8.078 7.883 0.195 26021 9233 1 15 . 1 1 8 8 ILE N N 8 117.376 117.376 118.342 -0.966 26021 9234 1 15 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.727 0.053 26021 9235 1 15 . 1 1 8 8 ILE C C 8 177.032 177.032 178.143 -1.111 26021 9236 1 15 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.230 -1.072 26021 9237 1 15 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.893 -1.604 26021 9238 1 15 . 1 1 8 8 ILE H H 8 7.943 7.943 7.837 0.106 26021 9239 1 15 . 1 1 9 9 ALA N N 9 121.414 121.414 122.083 -0.669 26021 9240 1 15 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.053 -0.120 26021 9241 1 15 . 1 1 9 9 ALA C C 9 180.515 180.515 179.220 1.295 26021 9242 1 15 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.901 0.197 26021 9243 1 15 . 1 1 9 9 ALA CB C 9 18.161 18.161 17.942 0.219 26021 9244 1 15 . 1 1 9 9 ALA H H 9 8.062 8.062 8.313 -0.251 26021 9245 1 15 . 1 1 10 10 LYS N N 10 114.594 114.594 118.759 -4.165 26021 9246 1 15 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.108 0.056 26021 9247 1 15 . 1 1 10 10 LYS C C 10 178.099 178.099 177.828 0.271 26021 9248 1 15 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.327 -0.487 26021 9249 1 15 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.314 0.155 26021 9250 1 15 . 1 1 10 10 LYS H H 10 7.554 7.554 7.536 0.018 26021 9251 1 15 . 1 1 11 11 LEU N N 11 119.662 119.662 117.991 1.671 26021 9252 1 15 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.147 -0.069 26021 9253 1 15 . 1 1 11 11 LEU C C 11 177.930 177.930 178.113 -0.183 26021 9254 1 15 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.109 0.447 26021 9255 1 15 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.912 1.176 26021 9256 1 15 . 1 1 11 11 LEU H H 11 7.814 7.814 7.403 0.411 26021 9257 1 15 . 1 1 12 12 ILE N N 12 117.945 117.945 120.522 -2.577 26021 9258 1 15 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.937 -0.245 26021 9259 1 15 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.001 1.628 26021 9260 1 15 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.743 1.667 26021 9261 1 15 . 1 1 12 12 ILE H H 12 7.426 7.426 7.473 -0.047 26021 9262 1 15 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.311 0.092 26021 9263 1 15 . 1 1 13 13 PRO C C 13 179.030 179.030 178.836 0.194 26021 9264 1 15 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.164 0.080 26021 9265 1 15 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.029 -0.220 26021 9266 1 15 . 1 1 14 14 LYS N N 14 117.855 117.855 118.446 -0.591 26021 9267 1 15 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.133 0.012 26021 9268 1 15 . 1 1 14 14 LYS C C 14 178.565 178.565 178.068 0.497 26021 9269 1 15 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.089 0.344 26021 9270 1 15 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.139 0.786 26021 9271 1 15 . 1 1 14 14 LYS H H 14 6.685 6.685 7.477 -0.792 26021 9272 1 15 . 1 1 15 15 LEU N N 15 118.008 118.008 118.337 -0.329 26021 9273 1 15 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.342 -0.339 26021 9274 1 15 . 1 1 15 15 LEU C C 15 178.662 178.662 178.857 -0.195 26021 9275 1 15 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.892 0.820 26021 9276 1 15 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.476 -0.477 26021 9277 1 15 . 1 1 15 15 LEU H H 15 8.148 8.148 7.551 0.597 26021 9278 1 15 . 1 1 16 16 GLY N N 16 103.895 103.895 107.044 -3.149 26021 9279 1 15 . 1 1 16 16 GLY C C 16 176.838 176.838 176.295 0.543 26021 9280 1 15 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.104 0.261 26021 9281 1 15 . 1 1 16 16 GLY H H 16 8.104 8.104 8.059 0.045 26021 9282 1 15 . 1 1 17 17 GLU N N 17 121.655 121.655 122.276 -0.621 26021 9283 1 15 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.171 -0.038 26021 9284 1 15 . 1 1 17 17 GLU C C 17 179.007 179.007 178.871 0.136 26021 9285 1 15 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.895 -0.084 26021 9286 1 15 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.674 -0.541 26021 9287 1 15 . 1 1 17 17 GLU H H 17 7.817 7.817 7.700 0.117 26021 9288 1 15 . 1 1 18 18 LEU N N 18 117.834 117.834 118.719 -0.885 26021 9289 1 15 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.469 -0.351 26021 9290 1 15 . 1 1 18 18 LEU C C 18 177.658 177.658 177.372 0.286 26021 9291 1 15 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.651 1.379 26021 9292 1 15 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.462 0.208 26021 9293 1 15 . 1 1 18 18 LEU H H 18 7.389 7.389 8.205 -0.816 26021 9294 1 15 . 1 1 19 19 LEU N N 19 113.694 113.694 117.003 -3.309 26021 9295 1 15 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.530 -0.368 26021 9296 1 15 . 1 1 19 19 LEU C C 19 178.123 178.123 177.900 0.223 26021 9297 1 15 . 1 1 19 19 LEU CA C 19 55.852 55.852 54.765 1.087 26021 9298 1 15 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.232 -0.012 26021 9299 1 15 . 1 1 19 19 LEU H H 19 7.269 7.269 7.691 -0.422 26021 9300 1 15 . 1 1 20 20 VAL N N 20 112.778 112.778 114.311 -1.533 26021 9301 1 15 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.164 0.279 26021 9302 1 15 . 1 1 20 20 VAL C C 20 177.021 177.021 176.919 0.102 26021 9303 1 15 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.476 -1.621 26021 9304 1 15 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.327 0.451 26021 9305 1 15 . 1 1 20 20 VAL H H 20 7.356 7.356 7.436 -0.080 26021 9306 1 15 . 1 1 21 21 GLY N N 21 108.962 108.962 109.194 -0.232 26021 9307 1 15 . 1 1 21 21 GLY C C 21 173.813 173.813 173.358 0.455 26021 9308 1 15 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.584 0.462 26021 9309 1 15 . 1 1 21 21 GLY H H 21 7.925 7.925 8.391 -0.466 26021 9310 1 15 . 1 1 22 22 GLU N N 22 120.607 120.607 122.316 -1.709 26021 9311 1 15 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.481 -0.203 26021 9312 1 15 . 1 1 22 22 GLU C C 22 175.869 175.869 175.012 0.857 26021 9313 1 15 . 1 1 22 22 GLU CA C 22 56.030 56.030 54.732 1.298 26021 9314 1 15 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.122 -0.441 26021 9315 1 15 . 1 1 22 22 GLU H H 22 8.300 8.300 8.311 -0.011 26021 9316 1 15 . 1 1 23 23 TYR N N 23 120.738 120.738 121.584 -0.846 26021 9317 1 15 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.025 -0.468 26021 9318 1 15 . 1 1 23 23 TYR C C 23 175.264 175.264 174.064 1.200 26021 9319 1 15 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.184 0.376 26021 9320 1 15 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.678 -0.432 26021 9321 1 15 . 1 1 23 23 TYR H H 23 7.756 7.756 7.385 0.371 26021 9322 1 15 . 1 1 24 24 LYS N N 24 122.095 122.095 121.415 0.680 26021 9323 1 15 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.530 -0.347 26021 9324 1 15 . 1 1 24 24 LYS C C 24 175.742 175.742 174.737 1.005 26021 9325 1 15 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.898 0.220 26021 9326 1 15 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.767 -0.048 26021 9327 1 15 . 1 1 24 24 LYS H H 24 8.692 8.692 8.524 0.168 26021 9328 1 15 . 1 1 25 25 LEU N N 25 121.123 121.123 114.573 6.550 26021 9329 1 15 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.601 -0.109 26021 9330 1 15 . 1 1 25 25 LEU C C 25 177.487 177.487 176.046 1.441 26021 9331 1 15 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.202 1.133 26021 9332 1 15 . 1 1 25 25 LEU CB C 25 43.758 43.758 43.598 0.160 26021 9333 1 15 . 1 1 25 25 LEU H H 25 8.088 8.088 7.496 0.592 26021 9334 1 15 . 1 1 26 26 HIS N N 26 122.993 122.993 118.797 4.196 26021 9335 1 15 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.548 -0.047 26021 9336 1 15 . 1 1 26 26 HIS C C 26 176.716 176.716 176.803 -0.087 26021 9337 1 15 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.693 0.504 26021 9338 1 15 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.360 0.997 26021 9339 1 15 . 1 1 26 26 HIS H H 26 8.882 8.882 8.260 0.622 26021 9340 1 15 . 1 1 27 27 LYS N N 27 124.894 124.894 124.402 0.492 26021 9341 1 15 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.431 -0.483 26021 9342 1 15 . 1 1 27 27 LYS C C 27 178.873 178.873 178.901 -0.028 26021 9343 1 15 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.947 1.064 26021 9344 1 15 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.558 -0.116 26021 9345 1 15 . 1 1 27 27 LYS H H 27 8.699 8.699 8.613 0.086 26021 9346 1 15 . 1 1 28 28 GLY N N 28 111.258 111.258 107.272 3.986 26021 9347 1 15 . 1 1 28 28 GLY C C 28 176.131 176.131 176.132 -0.001 26021 9348 1 15 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.693 -0.203 26021 9349 1 15 . 1 1 28 28 GLY H H 28 9.814 9.814 8.760 1.054 26021 9350 1 15 . 1 1 29 29 VAL N N 29 122.719 122.719 122.356 0.363 26021 9351 1 15 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.404 0.488 26021 9352 1 15 . 1 1 29 29 VAL C C 29 177.628 177.628 177.166 0.462 26021 9353 1 15 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.886 -0.366 26021 9354 1 15 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.450 0.292 26021 9355 1 15 . 1 1 29 29 VAL H H 29 7.431 7.431 7.194 0.237 26021 9356 1 15 . 1 1 30 30 LYS N N 30 119.791 119.791 118.909 0.882 26021 9357 1 15 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.835 -0.200 26021 9358 1 15 . 1 1 30 30 LYS C C 30 177.666 177.666 178.266 -0.600 26021 9359 1 15 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.532 1.492 26021 9360 1 15 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.618 0.787 26021 9361 1 15 . 1 1 30 30 LYS H H 30 8.255 8.255 8.161 0.094 26021 9362 1 15 . 1 1 31 31 LYS N N 31 117.918 117.918 118.310 -0.392 26021 9363 1 15 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.116 0.000 26021 9364 1 15 . 1 1 31 31 LYS C C 31 177.784 177.784 178.840 -1.056 26021 9365 1 15 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.787 -1.084 26021 9366 1 15 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.076 -0.231 26021 9367 1 15 . 1 1 31 31 LYS H H 31 7.689 7.689 8.039 -0.350 26021 9368 1 15 . 1 1 32 32 ASN N N 32 116.347 116.347 117.528 -1.181 26021 9369 1 15 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.216 0.304 26021 9370 1 15 . 1 1 32 32 ASN C C 32 177.764 177.764 176.949 0.815 26021 9371 1 15 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.947 0.368 26021 9372 1 15 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.525 0.107 26021 9373 1 15 . 1 1 32 32 ASN H H 32 7.556 7.556 7.681 -0.125 26021 9374 1 15 . 1 1 33 33 ILE N N 33 120.592 120.592 120.912 -0.320 26021 9375 1 15 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.639 -0.357 26021 9376 1 15 . 1 1 33 33 ILE C C 33 177.074 177.074 177.531 -0.457 26021 9377 1 15 . 1 1 33 33 ILE CA C 33 65.888 65.888 64.981 0.908 26021 9378 1 15 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.797 -0.619 26021 9379 1 15 . 1 1 33 33 ILE H H 33 8.236 8.236 7.782 0.454 26021 9380 1 15 . 1 1 34 34 GLU N N 34 120.595 120.595 119.394 1.201 26021 9381 1 15 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.861 -0.073 26021 9382 1 15 . 1 1 34 34 GLU C C 34 179.739 179.739 179.068 0.671 26021 9383 1 15 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.831 0.408 26021 9384 1 15 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.828 1.017 26021 9385 1 15 . 1 1 34 34 GLU H H 34 8.551 8.551 8.737 -0.186 26021 9386 1 15 . 1 1 35 35 ASP N N 35 120.600 120.600 120.962 -0.362 26021 9387 1 15 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.521 -0.109 26021 9388 1 15 . 1 1 35 35 ASP C C 35 178.681 178.681 178.529 0.152 26021 9389 1 15 . 1 1 35 35 ASP CA C 35 57.462 57.462 57.221 0.241 26021 9390 1 15 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.811 -1.061 26021 9391 1 15 . 1 1 35 35 ASP H H 35 8.670 8.670 7.486 1.184 26021 9392 1 15 . 1 1 36 36 LEU N N 36 123.004 123.004 120.784 2.220 26021 9393 1 15 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.199 -0.104 26021 9394 1 15 . 1 1 36 36 LEU C C 36 178.035 178.035 178.891 -0.856 26021 9395 1 15 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.856 0.172 26021 9396 1 15 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.206 -0.331 26021 9397 1 15 . 1 1 36 36 LEU H H 36 8.166 8.166 7.740 0.426 26021 9398 1 15 . 1 1 37 37 LEU N N 37 120.178 120.178 119.986 0.192 26021 9399 1 15 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.063 -0.207 26021 9400 1 15 . 1 1 37 37 LEU C C 37 178.128 178.128 178.082 0.046 26021 9401 1 15 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.896 0.779 26021 9402 1 15 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.543 0.612 26021 9403 1 15 . 1 1 37 37 LEU H H 37 8.736 8.736 8.608 0.128 26021 9404 1 15 . 1 1 38 38 LYS N N 38 118.110 118.110 119.956 -1.846 26021 9405 1 15 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.926 0.007 26021 9406 1 15 . 1 1 38 38 LYS C C 38 179.533 179.533 178.905 0.628 26021 9407 1 15 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.040 0.233 26021 9408 1 15 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.202 0.076 26021 9409 1 15 . 1 1 38 38 LYS H H 38 7.770 7.770 7.847 -0.077 26021 9410 1 15 . 1 1 39 39 GLU N N 39 119.265 119.265 117.909 1.356 26021 9411 1 15 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.111 0.191 26021 9412 1 15 . 1 1 39 39 GLU C C 39 179.720 179.720 179.196 0.524 26021 9413 1 15 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.894 -0.136 26021 9414 1 15 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.374 0.216 26021 9415 1 15 . 1 1 39 39 GLU H H 39 7.709 7.709 7.734 -0.025 26021 9416 1 15 . 1 1 40 40 LEU N N 40 119.007 119.007 121.363 -2.356 26021 9417 1 15 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.118 -0.068 26021 9418 1 15 . 1 1 40 40 LEU C C 40 179.690 179.690 179.004 0.686 26021 9419 1 15 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.819 -0.168 26021 9420 1 15 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.791 -0.106 26021 9421 1 15 . 1 1 40 40 LEU H H 40 8.851 8.851 7.563 1.288 26021 9422 1 15 . 1 1 41 41 LYS N N 41 120.500 120.500 118.713 1.787 26021 9423 1 15 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.001 -0.049 26021 9424 1 15 . 1 1 41 41 LYS C C 41 180.223 180.223 179.254 0.969 26021 9425 1 15 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.384 1.507 26021 9426 1 15 . 1 1 41 41 LYS CB C 41 32.067 32.067 31.936 0.131 26021 9427 1 15 . 1 1 41 41 LYS H H 41 8.482 8.482 8.376 0.106 26021 9428 1 15 . 1 1 42 42 THR N N 42 119.555 119.555 111.744 7.811 26021 9429 1 15 . 1 1 42 42 THR HA H 42 4.000 4.000 4.222 -0.222 26021 9430 1 15 . 1 1 42 42 THR C C 42 176.633 176.633 176.589 0.044 26021 9431 1 15 . 1 1 42 42 THR CA C 42 66.574 66.574 65.431 1.143 26021 9432 1 15 . 1 1 42 42 THR CB C 42 67.924 67.924 69.000 -1.076 26021 9433 1 15 . 1 1 42 42 THR H H 42 7.863 7.863 7.477 0.386 26021 9434 1 15 . 1 1 43 43 MET N N 43 122.839 122.839 121.994 0.845 26021 9435 1 15 . 1 1 43 43 MET HA H 43 4.022 4.022 4.062 -0.040 26021 9436 1 15 . 1 1 43 43 MET C C 43 177.290 177.290 178.139 -0.849 26021 9437 1 15 . 1 1 43 43 MET CA C 43 59.731 59.731 59.660 0.071 26021 9438 1 15 . 1 1 43 43 MET CB C 43 33.610 33.610 32.435 1.175 26021 9439 1 15 . 1 1 43 43 MET H H 43 8.714 8.714 7.658 1.056 26021 9440 1 15 . 1 1 44 44 ASN N N 44 118.049 118.049 117.538 0.511 26021 9441 1 15 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.330 0.044 26021 9442 1 15 . 1 1 44 44 ASN C C 44 176.297 176.297 177.340 -1.043 26021 9443 1 15 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.169 0.725 26021 9444 1 15 . 1 1 44 44 ASN CB C 44 39.406 39.406 39.010 0.396 26021 9445 1 15 . 1 1 44 44 ASN H H 44 8.988 8.988 8.509 0.479 26021 9446 1 15 . 1 1 45 45 ALA N N 45 119.260 119.260 121.713 -2.453 26021 9447 1 15 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.199 -0.133 26021 9448 1 15 . 1 1 45 45 ALA C C 45 180.476 180.476 179.887 0.589 26021 9449 1 15 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.372 0.896 26021 9450 1 15 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.272 -0.584 26021 9451 1 15 . 1 1 45 45 ALA H H 45 7.675 7.675 7.548 0.127 26021 9452 1 15 . 1 1 46 46 ALA N N 46 121.126 121.126 124.352 -3.226 26021 9453 1 15 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.271 -0.155 26021 9454 1 15 . 1 1 46 46 ALA C C 46 179.314 179.314 179.041 0.273 26021 9455 1 15 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.145 -0.159 26021 9456 1 15 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.655 -0.433 26021 9457 1 15 . 1 1 46 46 ALA H H 46 7.872 7.872 7.857 0.015 26021 9458 1 15 . 1 1 47 47 LEU N N 47 119.328 119.328 115.054 4.274 26021 9459 1 15 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.918 0.273 26021 9460 1 15 . 1 1 47 47 LEU C C 47 180.403 180.403 177.901 2.502 26021 9461 1 15 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.869 0.177 26021 9462 1 15 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.544 0.406 26021 9463 1 15 . 1 1 47 47 LEU H H 47 8.529 8.529 7.489 1.040 26021 9464 1 15 . 1 1 48 48 ILE N N 48 121.653 121.653 118.616 3.037 26021 9465 1 15 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.792 -0.090 26021 9466 1 15 . 1 1 48 48 ILE C C 48 178.730 178.730 178.168 0.562 26021 9467 1 15 . 1 1 48 48 ILE CA C 48 64.910 64.910 63.022 1.888 26021 9468 1 15 . 1 1 48 48 ILE CB C 48 37.912 37.912 36.711 1.201 26021 9469 1 15 . 1 1 48 48 ILE H H 48 8.386 8.386 7.573 0.813 26021 9470 1 15 . 1 1 49 49 LYS N N 49 119.896 119.896 118.923 0.973 26021 9471 1 15 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.190 -0.147 26021 9472 1 15 . 1 1 49 49 LYS C C 49 179.999 179.999 179.701 0.298 26021 9473 1 15 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.255 -0.199 26021 9474 1 15 . 1 1 49 49 LYS CB C 49 31.961 31.961 33.035 -1.074 26021 9475 1 15 . 1 1 49 49 LYS H H 49 7.456 7.456 7.622 -0.166 26021 9476 1 15 . 1 1 50 50 ILE N N 50 119.964 119.964 115.556 4.408 26021 9477 1 15 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.216 -0.480 26021 9478 1 15 . 1 1 50 50 ILE C C 50 177.960 177.960 177.817 0.143 26021 9479 1 15 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.767 0.583 26021 9480 1 15 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.813 0.319 26021 9481 1 15 . 1 1 50 50 ILE H H 50 8.154 8.154 8.826 -0.672 26021 9482 1 15 . 1 1 51 51 GLY N N 51 106.709 106.709 107.710 -1.001 26021 9483 1 15 . 1 1 51 51 GLY C C 51 174.461 174.461 174.880 -0.419 26021 9484 1 15 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.222 -0.313 26021 9485 1 15 . 1 1 51 51 GLY H H 51 7.932 7.932 7.890 0.042 26021 9486 1 15 . 1 1 52 52 GLU N N 52 118.736 118.736 118.934 -0.198 26021 9487 1 15 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.176 0.144 26021 9488 1 15 . 1 1 52 52 GLU C C 52 176.789 176.789 177.125 -0.336 26021 9489 1 15 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.510 -1.236 26021 9490 1 15 . 1 1 52 52 GLU CB C 52 30.112 30.112 29.573 0.539 26021 9491 1 15 . 1 1 52 52 GLU H H 52 7.597 7.597 7.609 -0.012 26021 9492 1 15 . 1 1 53 53 VAL N N 53 122.982 122.982 119.065 3.917 26021 9493 1 15 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.462 -0.201 26021 9494 1 15 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.747 1.638 26021 9495 1 15 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.057 1.765 26021 9496 1 15 . 1 1 53 53 VAL H H 53 7.511 7.511 7.527 -0.016 26021 9497 1 15 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.802 -0.157 26021 9498 1 15 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.574 0.004 26021 9499 1 15 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.067 0.468 26021 9500 1 15 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.388 -0.197 26021 9501 1 15 . 1 1 55 55 PRO C C 55 178.258 178.258 176.911 1.347 26021 9502 1 15 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.637 0.791 26021 9503 1 15 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.774 0.072 26021 9504 1 15 . 1 1 56 56 ASP N N 56 114.117 114.117 117.403 -3.286 26021 9505 1 15 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.500 -0.009 26021 9506 1 15 . 1 1 56 56 ASP C C 56 176.696 176.696 177.030 -0.334 26021 9507 1 15 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.911 -0.773 26021 9508 1 15 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.854 -1.128 26021 9509 1 15 . 1 1 56 56 ASP H H 56 8.489 8.489 8.216 0.273 26021 9510 1 15 . 1 1 57 57 GLN N N 57 117.641 117.641 117.418 0.223 26021 9511 1 15 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.303 0.071 26021 9512 1 15 . 1 1 57 57 GLN C C 57 175.765 175.765 176.881 -1.116 26021 9513 1 15 . 1 1 57 57 GLN CA C 57 55.290 55.290 56.566 -1.276 26021 9514 1 15 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.548 0.098 26021 9515 1 15 . 1 1 57 57 GLN H H 57 8.206 8.206 7.538 0.668 26021 9516 1 15 . 1 1 58 58 LEU N N 58 122.141 122.141 121.615 0.526 26021 9517 1 15 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.140 0.310 26021 9518 1 15 . 1 1 58 58 LEU C C 58 176.849 176.849 176.987 -0.138 26021 9519 1 15 . 1 1 58 58 LEU CA C 58 54.995 54.995 56.329 -1.334 26021 9520 1 15 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.425 0.806 26021 9521 1 15 . 1 1 58 58 LEU H H 58 7.152 7.152 7.769 -0.617 26021 9522 1 15 . 1 1 59 59 ASP N N 59 125.643 125.643 120.262 5.381 26021 9523 1 15 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.837 -0.118 26021 9524 1 15 . 1 1 59 59 ASP C C 59 177.249 177.249 177.126 0.123 26021 9525 1 15 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.227 0.176 26021 9526 1 15 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.310 -1.078 26021 9527 1 15 . 1 1 59 59 ASP H H 59 9.312 9.312 8.388 0.924 26021 9528 1 15 . 1 1 60 60 SER N N 60 116.550 116.550 114.532 2.018 26021 9529 1 15 . 1 1 60 60 SER HA H 60 4.124 4.124 4.274 -0.150 26021 9530 1 15 . 1 1 60 60 SER C C 60 176.840 176.840 176.089 0.751 26021 9531 1 15 . 1 1 60 60 SER CA C 60 61.722 61.722 60.705 1.017 26021 9532 1 15 . 1 1 60 60 SER CB C 60 62.815 62.815 63.202 -0.387 26021 9533 1 15 . 1 1 60 60 SER H H 60 8.647 8.647 8.595 0.052 26021 9534 1 15 . 1 1 61 61 GLN N N 61 121.394 121.394 120.025 1.369 26021 9535 1 15 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.252 -0.121 26021 9536 1 15 . 1 1 61 61 GLN C C 61 178.629 178.629 177.239 1.390 26021 9537 1 15 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.480 0.273 26021 9538 1 15 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.833 -0.580 26021 9539 1 15 . 1 1 61 61 GLN H H 61 8.453 8.453 8.086 0.367 26021 9540 1 15 . 1 1 62 62 ASP N N 62 122.187 122.187 120.845 1.342 26021 9541 1 15 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.500 0.119 26021 9542 1 15 . 1 1 62 62 ASP C C 62 178.318 178.318 178.579 -0.261 26021 9543 1 15 . 1 1 62 62 ASP CA C 62 57.462 57.462 58.007 -0.545 26021 9544 1 15 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.276 0.760 26021 9545 1 15 . 1 1 62 62 ASP H H 62 8.311 8.311 8.497 -0.186 26021 9546 1 15 . 1 1 63 63 LYS N N 63 120.325 120.325 118.150 2.175 26021 9547 1 15 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.132 -0.123 26021 9548 1 15 . 1 1 63 63 LYS C C 63 178.765 178.765 179.019 -0.254 26021 9549 1 15 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.521 1.232 26021 9550 1 15 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.192 0.261 26021 9551 1 15 . 1 1 63 63 LYS H H 63 7.923 7.923 7.626 0.297 26021 9552 1 15 . 1 1 64 64 LEU N N 64 119.491 119.491 119.384 0.107 26021 9553 1 15 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.193 0.033 26021 9554 1 15 . 1 1 64 64 LEU C C 64 179.526 179.526 178.680 0.846 26021 9555 1 15 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.795 0.003 26021 9556 1 15 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.771 0.004 26021 9557 1 15 . 1 1 64 64 LEU H H 64 7.820 7.820 7.442 0.378 26021 9558 1 15 . 1 1 65 65 TRP N N 65 120.674 120.674 122.316 -1.642 26021 9559 1 15 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.582 -0.274 26021 9560 1 15 . 1 1 65 65 TRP C C 65 177.379 177.379 177.819 -0.440 26021 9561 1 15 . 1 1 65 65 TRP CA C 65 61.802 61.802 59.605 2.196 26021 9562 1 15 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.623 -0.212 26021 9563 1 15 . 1 1 65 65 TRP H H 65 8.196 8.196 8.374 -0.178 26021 9564 1 15 . 1 1 66 66 ALA N N 66 120.606 120.606 119.558 1.048 26021 9565 1 15 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.665 0.044 26021 9566 1 15 . 1 1 66 66 ALA C C 66 180.376 180.376 178.843 1.533 26021 9567 1 15 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.687 0.877 26021 9568 1 15 . 1 1 66 66 ALA CB C 66 17.654 17.654 18.249 -0.595 26021 9569 1 15 . 1 1 66 66 ALA H H 66 8.305 8.305 7.408 0.897 26021 9570 1 15 . 1 1 67 67 ASP N N 67 119.175 119.175 118.632 0.543 26021 9571 1 15 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.336 0.114 26021 9572 1 15 . 1 1 67 67 ASP C C 67 178.757 178.757 177.924 0.833 26021 9573 1 15 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.542 0.950 26021 9574 1 15 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.638 -0.484 26021 9575 1 15 . 1 1 67 67 ASP H H 67 7.945 7.945 7.652 0.293 26021 9576 1 15 . 1 1 68 68 GLU N N 68 122.322 122.322 118.628 3.694 26021 9577 1 15 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.090 -0.075 26021 9578 1 15 . 1 1 68 68 GLU C C 68 180.055 180.055 178.473 1.582 26021 9579 1 15 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.018 1.092 26021 9580 1 15 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.819 -0.172 26021 9581 1 15 . 1 1 68 68 GLU H H 68 8.168 8.168 8.140 0.028 26021 9582 1 15 . 1 1 69 69 VAL N N 69 122.135 122.135 116.996 5.139 26021 9583 1 15 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.761 -0.509 26021 9584 1 15 . 1 1 69 69 VAL C C 69 177.736 177.736 177.858 -0.122 26021 9585 1 15 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.469 1.070 26021 9586 1 15 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.754 -0.512 26021 9587 1 15 . 1 1 69 69 VAL H H 69 8.424 8.424 7.252 1.172 26021 9588 1 15 . 1 1 70 70 ARG N N 70 121.373 121.373 120.070 1.303 26021 9589 1 15 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.822 -0.130 26021 9590 1 15 . 1 1 70 70 ARG C C 70 179.117 179.117 178.034 1.083 26021 9591 1 15 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.965 1.200 26021 9592 1 15 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.165 0.489 26021 9593 1 15 . 1 1 70 70 ARG H H 70 7.916 7.916 7.516 0.400 26021 9594 1 15 . 1 1 71 71 GLU N N 71 119.075 119.075 117.866 1.209 26021 9595 1 15 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.143 -0.080 26021 9596 1 15 . 1 1 71 71 GLU C C 71 179.119 179.119 178.731 0.388 26021 9597 1 15 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.047 0.640 26021 9598 1 15 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.959 0.311 26021 9599 1 15 . 1 1 71 71 GLU H H 71 8.031 8.031 7.662 0.369 26021 9600 1 15 . 1 1 72 72 LEU N N 72 120.503 120.503 119.673 0.830 26021 9601 1 15 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.269 -0.212 26021 9602 1 15 . 1 1 72 72 LEU C C 72 178.734 178.734 178.648 0.086 26021 9603 1 15 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.261 1.161 26021 9604 1 15 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.279 0.129 26021 9605 1 15 . 1 1 72 72 LEU H H 72 8.175 8.175 7.997 0.178 26021 9606 1 15 . 1 1 73 73 SER N N 73 115.243 115.243 116.581 -1.338 26021 9607 1 15 . 1 1 73 73 SER HA H 73 3.824 3.824 3.991 -0.167 26021 9608 1 15 . 1 1 73 73 SER C C 73 175.697 175.697 176.579 -0.882 26021 9609 1 15 . 1 1 73 73 SER CA C 73 62.384 62.384 61.466 0.918 26021 9610 1 15 . 1 1 73 73 SER CB C 73 62.093 62.093 62.674 -0.581 26021 9611 1 15 . 1 1 73 73 SER H H 73 8.411 8.411 7.891 0.520 26021 9612 1 15 . 1 1 74 74 TYR N N 74 121.342 121.342 119.722 1.620 26021 9613 1 15 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.273 0.218 26021 9614 1 15 . 1 1 74 74 TYR C C 74 178.747 178.747 177.980 0.767 26021 9615 1 15 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.572 -0.137 26021 9616 1 15 . 1 1 74 74 TYR CB C 74 37.507 37.507 37.993 -0.486 26021 9617 1 15 . 1 1 74 74 TYR H H 74 7.314 7.314 7.306 0.008 26021 9618 1 15 . 1 1 75 75 VAL N N 75 120.779 120.779 118.081 2.698 26021 9619 1 15 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.791 0.070 26021 9620 1 15 . 1 1 75 75 VAL C C 75 179.788 179.788 177.962 1.826 26021 9621 1 15 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.306 0.742 26021 9622 1 15 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.867 -0.153 26021 9623 1 15 . 1 1 75 75 VAL H H 75 7.740 7.740 7.685 0.055 26021 9624 1 15 . 1 1 76 76 ILE N N 76 120.598 120.598 120.923 -0.325 26021 9625 1 15 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.603 0.097 26021 9626 1 15 . 1 1 76 76 ILE C C 76 177.066 177.066 177.961 -0.895 26021 9627 1 15 . 1 1 76 76 ILE CA C 76 65.919 65.919 65.205 0.714 26021 9628 1 15 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.265 0.120 26021 9629 1 15 . 1 1 76 76 ILE H H 76 8.584 8.584 7.781 0.803 26021 9630 1 15 . 1 1 77 77 GLU N N 77 120.468 120.468 120.760 -0.292 26021 9631 1 15 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.908 -0.259 26021 9632 1 15 . 1 1 77 77 GLU C C 77 177.502 177.502 178.289 -0.787 26021 9633 1 15 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.987 0.875 26021 9634 1 15 . 1 1 77 77 GLU CB C 77 29.352 29.352 29.255 0.097 26021 9635 1 15 . 1 1 77 77 GLU H H 77 8.445 8.445 8.000 0.445 26021 9636 1 15 . 1 1 78 78 ASP N N 78 117.382 117.382 119.636 -2.254 26021 9637 1 15 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.395 -0.004 26021 9638 1 15 . 1 1 78 78 ASP C C 78 177.382 177.382 177.920 -0.538 26021 9639 1 15 . 1 1 78 78 ASP CA C 78 57.495 57.495 57.252 0.243 26021 9640 1 15 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.744 1.191 26021 9641 1 15 . 1 1 78 78 ASP H H 78 7.885 7.885 7.780 0.104 26021 9642 1 15 . 1 1 79 79 ALA N N 79 120.171 120.171 121.035 -0.864 26021 9643 1 15 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.042 0.008 26021 9644 1 15 . 1 1 79 79 ALA C C 79 181.193 181.193 179.068 2.125 26021 9645 1 15 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.177 -0.122 26021 9646 1 15 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.753 -0.333 26021 9647 1 15 . 1 1 79 79 ALA H H 79 7.754 7.754 7.938 -0.184 26021 9648 1 15 . 1 1 80 80 VAL N N 80 119.541 119.541 112.323 7.218 26021 9649 1 15 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.952 -0.275 26021 9650 1 15 . 1 1 80 80 VAL C C 80 177.096 177.096 177.628 -0.532 26021 9651 1 15 . 1 1 80 80 VAL CA C 80 67.084 67.084 63.802 3.282 26021 9652 1 15 . 1 1 80 80 VAL CB C 80 31.443 31.443 32.012 -0.569 26021 9653 1 15 . 1 1 80 80 VAL H H 80 8.635 8.635 7.414 1.221 26021 9654 1 15 . 1 1 81 81 ASP N N 81 121.140 121.140 121.247 -0.107 26021 9655 1 15 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.329 0.140 26021 9656 1 15 . 1 1 81 81 ASP C C 81 179.569 179.569 177.864 1.705 26021 9657 1 15 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.234 0.695 26021 9658 1 15 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.358 -0.423 26021 9659 1 15 . 1 1 81 81 ASP H H 81 8.575 8.575 8.241 0.334 26021 9660 1 15 . 1 1 82 82 LYS N N 82 118.159 118.159 118.898 -0.739 26021 9661 1 15 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.022 -0.001 26021 9662 1 15 . 1 1 82 82 LYS C C 82 178.890 178.890 179.092 -0.202 26021 9663 1 15 . 1 1 82 82 LYS CA C 82 59.067 59.067 59.186 -0.119 26021 9664 1 15 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.964 0.623 26021 9665 1 15 . 1 1 82 82 LYS H H 82 8.079 8.079 7.649 0.430 26021 9666 1 15 . 1 1 83 83 PHE N N 83 120.900 120.900 119.908 0.992 26021 9667 1 15 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.298 -0.022 26021 9668 1 15 . 1 1 83 83 PHE C C 83 177.269 177.269 177.290 -0.021 26021 9669 1 15 . 1 1 83 83 PHE CA C 83 60.943 60.943 61.717 -0.774 26021 9670 1 15 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.217 0.530 26021 9671 1 15 . 1 1 83 83 PHE H H 83 8.015 8.015 7.900 0.115 26021 9672 1 15 . 1 1 84 84 LEU N N 84 118.209 118.209 118.609 -0.400 26021 9673 1 15 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.183 -0.241 26021 9674 1 15 . 1 1 84 84 LEU C C 84 178.774 178.774 178.783 -0.009 26021 9675 1 15 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.655 -0.485 26021 9676 1 15 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.805 0.388 26021 9677 1 15 . 1 1 84 84 LEU H H 84 8.338 8.338 7.349 0.989 26021 9678 1 15 . 1 1 85 85 VAL N N 85 116.078 116.078 119.297 -3.219 26021 9679 1 15 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.726 0.265 26021 9680 1 15 . 1 1 85 85 VAL C C 85 177.252 177.252 177.721 -0.469 26021 9681 1 15 . 1 1 85 85 VAL CA C 85 64.180 64.180 66.504 -2.325 26021 9682 1 15 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.882 0.008 26021 9683 1 15 . 1 1 85 85 VAL H H 85 7.447 7.447 8.512 -1.065 26021 9684 1 15 . 1 1 86 86 ARG N N 86 120.842 120.842 118.887 1.955 26021 9685 1 15 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.190 0.037 26021 9686 1 15 . 1 1 86 86 ARG C C 86 177.520 177.520 179.403 -1.883 26021 9687 1 15 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.375 -1.316 26021 9688 1 15 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.668 0.595 26021 9689 1 15 . 1 1 86 86 ARG H H 86 7.598 7.598 8.013 -0.415 26021 9690 1 15 . 1 1 87 87 VAL N N 87 119.293 119.293 116.390 2.903 26021 9691 1 15 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.761 0.064 26021 9692 1 15 . 1 1 87 87 VAL C C 87 176.121 176.121 176.993 -0.872 26021 9693 1 15 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.651 -2.213 26021 9694 1 15 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.682 1.090 26021 9695 1 15 . 1 1 87 87 VAL H H 87 7.994 7.994 7.523 0.471 26021 9696 1 15 . 1 1 88 88 HIS N N 88 120.016 120.016 118.514 1.502 26021 9697 1 15 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.482 0.155 26021 9698 1 15 . 1 1 88 88 HIS C C 88 175.639 175.639 175.715 -0.076 26021 9699 1 15 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.054 0.297 26021 9700 1 15 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.673 -0.992 26021 9701 1 15 . 1 1 88 88 HIS H H 88 7.969 7.969 7.832 0.137 26021 9702 1 15 . 1 1 89 89 GLY N N 89 109.587 109.587 107.216 2.371 26021 9703 1 15 . 1 1 89 89 GLY C C 89 173.730 173.730 174.226 -0.496 26021 9704 1 15 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.075 0.094 26021 9705 1 15 . 1 1 89 89 GLY H H 89 8.083 8.083 8.122 -0.039 26021 9706 1 15 . 1 1 90 90 VAL N N 90 118.224 118.224 123.016 -4.792 26021 9707 1 15 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.156 -0.018 26021 9708 1 15 . 1 1 90 90 VAL C C 90 176.018 176.018 174.929 1.089 26021 9709 1 15 . 1 1 90 90 VAL CA C 90 62.425 62.425 61.702 0.723 26021 9710 1 15 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.775 -0.159 26021 9711 1 15 . 1 1 90 90 VAL H H 90 7.944 7.944 7.555 0.389 26021 9712 1 15 . 1 1 91 91 GLU N N 91 124.313 124.313 123.411 0.902 26021 9713 1 15 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.677 -0.071 26021 9714 1 15 . 1 1 91 91 GLU CA C 91 54.176 54.176 53.192 0.984 26021 9715 1 15 . 1 1 91 91 GLU CB C 91 29.760 29.760 30.043 -0.283 26021 9716 1 15 . 1 1 91 91 GLU H H 91 8.423 8.423 8.331 0.092 26021 9717 1 15 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.532 -0.195 26021 9718 1 15 . 1 1 92 92 PRO C C 92 176.504 176.504 175.630 0.874 26021 9719 1 15 . 1 1 92 92 PRO CA C 92 63.372 63.372 62.768 0.604 26021 9720 1 15 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.480 -0.313 26021 9721 1 15 . 1 1 93 93 ASP N N 93 120.275 120.275 119.076 1.199 26021 9722 1 15 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.822 -0.250 26021 9723 1 15 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.163 0.808 26021 9724 1 15 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.569 -2.054 26021 9725 1 15 . 1 1 93 93 ASP H H 93 8.286 8.286 8.423 -0.137 26021 9726 1 15 . 1 1 94 94 ASP N N 94 121.181 121.181 125.668 -4.487 26021 9727 1 15 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.284 0.281 26021 9728 1 15 . 1 1 94 94 ASP C C 94 176.474 176.474 177.241 -0.767 26021 9729 1 15 . 1 1 94 94 ASP CA C 94 54.373 54.373 57.321 -2.948 26021 9730 1 15 . 1 1 94 94 ASP CB C 94 41.225 41.225 40.937 0.288 26021 9731 1 15 . 1 1 94 94 ASP H H 94 8.259 8.259 8.883 -0.624 26021 9732 1 15 . 1 1 95 95 ASN N N 95 118.728 118.728 116.893 1.835 26021 9733 1 15 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.650 0.044 26021 9734 1 15 . 1 1 95 95 ASN C C 95 176.272 176.272 177.826 -1.554 26021 9735 1 15 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.899 -1.913 26021 9736 1 15 . 1 1 95 95 ASN CB C 95 38.729 38.729 39.160 -0.431 26021 9737 1 15 . 1 1 95 95 ASN H H 95 8.474 8.474 8.465 0.009 26021 9738 1 15 . 1 1 96 96 THR N N 96 113.868 113.868 116.586 -2.718 26021 9739 1 15 . 1 1 96 96 THR HA H 96 4.220 4.220 4.139 0.081 26021 9740 1 15 . 1 1 96 96 THR C C 96 175.107 175.107 176.213 -1.106 26021 9741 1 15 . 1 1 96 96 THR CA C 96 63.200 63.200 65.026 -1.826 26021 9742 1 15 . 1 1 96 96 THR CB C 96 69.475 69.475 68.456 1.019 26021 9743 1 15 . 1 1 96 96 THR H H 96 8.263 8.263 7.473 0.790 26021 9744 1 15 . 1 1 97 97 ASN N N 97 119.954 119.954 118.835 1.119 26021 9745 1 15 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.479 0.137 26021 9746 1 15 . 1 1 97 97 ASN C C 97 176.275 176.275 176.398 -0.123 26021 9747 1 15 . 1 1 97 97 ASN CA C 97 53.956 53.956 55.043 -1.087 26021 9748 1 15 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.405 0.287 26021 9749 1 15 . 1 1 97 97 ASN H H 97 8.431 8.431 8.154 0.277 26021 9750 1 15 . 1 1 98 98 GLY N N 98 108.847 108.847 106.358 2.489 26021 9751 1 15 . 1 1 98 98 GLY C C 98 175.533 175.533 175.426 0.107 26021 9752 1 15 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.296 -0.285 26021 9753 1 15 . 1 1 98 98 GLY H H 98 8.338 8.338 7.765 0.573 26021 9754 1 15 . 1 1 99 99 PHE N N 99 118.492 118.492 119.653 -1.161 26021 9755 1 15 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.089 0.159 26021 9756 1 15 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.421 0.538 26021 9757 1 15 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.123 -0.964 26021 9758 1 15 . 1 1 99 99 PHE H H 99 8.370 8.370 8.534 -0.164 26021 9759 1 15 . 1 1 100 100 LYS N N 100 120.987 120.987 119.030 1.957 26021 9760 1 15 . 1 1 100 100 LYS H H 100 8.256 8.256 8.444 -0.188 26021 9761 1 15 . 1 1 101 101 GLY N N 101 108.186 108.186 106.704 1.482 26021 9762 1 15 . 1 1 101 101 GLY C C 101 177.075 177.075 175.966 1.109 26021 9763 1 15 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.068 0.834 26021 9764 1 15 . 1 1 101 101 GLY H H 101 8.300 8.300 7.613 0.687 26021 9765 1 15 . 1 1 102 102 LEU N N 102 121.439 121.439 123.651 -2.212 26021 9766 1 15 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.885 0.212 26021 9767 1 15 . 1 1 102 102 LEU C C 102 179.836 179.836 178.046 1.790 26021 9768 1 15 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.583 -0.225 26021 9769 1 15 . 1 1 102 102 LEU CB C 102 41.770 41.770 42.187 -0.417 26021 9770 1 15 . 1 1 102 102 LEU H H 102 7.777 7.777 8.079 -0.302 26021 9771 1 15 . 1 1 103 103 MET N N 103 122.290 122.290 117.382 4.908 26021 9772 1 15 . 1 1 103 103 MET HA H 103 4.220 4.220 3.882 0.338 26021 9773 1 15 . 1 1 103 103 MET C C 103 177.739 177.739 177.754 -0.015 26021 9774 1 15 . 1 1 103 103 MET CA C 103 58.739 58.739 58.107 0.632 26021 9775 1 15 . 1 1 103 103 MET CB C 103 31.895 31.895 32.007 -0.112 26021 9776 1 15 . 1 1 103 103 MET H H 103 8.409 8.409 7.872 0.537 26021 9777 1 15 . 1 1 104 104 LYS N N 104 119.750 119.750 117.566 2.184 26021 9778 1 15 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.042 0.025 26021 9779 1 15 . 1 1 104 104 LYS C C 104 179.301 179.301 179.285 0.016 26021 9780 1 15 . 1 1 104 104 LYS CA C 104 59.764 59.764 59.129 0.635 26021 9781 1 15 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.746 0.301 26021 9782 1 15 . 1 1 104 104 LYS H H 104 7.916 7.916 7.340 0.576 26021 9783 1 15 . 1 1 105 105 ARG N N 105 117.967 117.967 118.860 -0.893 26021 9784 1 15 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.103 -0.077 26021 9785 1 15 . 1 1 105 105 ARG C C 105 178.777 178.777 178.345 0.432 26021 9786 1 15 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.638 -0.274 26021 9787 1 15 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.332 0.665 26021 9788 1 15 . 1 1 105 105 ARG H H 105 7.719 7.719 7.944 -0.225 26021 9789 1 15 . 1 1 106 106 THR N N 106 117.211 117.211 113.073 4.138 26021 9790 1 15 . 1 1 106 106 THR HA H 106 4.301 4.301 4.254 0.047 26021 9791 1 15 . 1 1 106 106 THR C C 106 176.254 176.254 176.046 0.208 26021 9792 1 15 . 1 1 106 106 THR CA C 106 67.860 67.860 66.040 1.821 26021 9793 1 15 . 1 1 106 106 THR CB C 106 67.860 67.860 68.531 -0.671 26021 9794 1 15 . 1 1 106 106 THR H H 106 8.152 8.152 7.821 0.331 26021 9795 1 15 . 1 1 107 107 THR N N 107 117.939 117.939 117.390 0.549 26021 9796 1 15 . 1 1 107 107 THR HA H 107 3.971 3.971 3.908 0.063 26021 9797 1 15 . 1 1 107 107 THR C C 107 176.780 176.780 176.214 0.566 26021 9798 1 15 . 1 1 107 107 THR CA C 107 66.822 66.822 66.242 0.580 26021 9799 1 15 . 1 1 107 107 THR CB C 107 68.818 68.818 68.610 0.208 26021 9800 1 15 . 1 1 107 107 THR H H 107 8.651 8.651 7.732 0.919 26021 9801 1 15 . 1 1 108 108 LYS N N 108 120.867 120.867 120.732 0.135 26021 9802 1 15 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.055 -0.033 26021 9803 1 15 . 1 1 108 108 LYS C C 108 179.045 179.045 178.420 0.625 26021 9804 1 15 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.129 0.705 26021 9805 1 15 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.163 0.310 26021 9806 1 15 . 1 1 108 108 LYS H H 108 7.694 7.694 7.651 0.043 26021 9807 1 15 . 1 1 109 109 LEU N N 109 119.472 119.472 116.971 2.501 26021 9808 1 15 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.251 0.070 26021 9809 1 15 . 1 1 109 109 LEU C C 109 179.974 179.974 179.583 0.391 26021 9810 1 15 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.070 0.523 26021 9811 1 15 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.057 -0.197 26021 9812 1 15 . 1 1 109 109 LEU H H 109 7.559 7.559 7.587 -0.028 26021 9813 1 15 . 1 1 110 110 LEU N N 110 121.832 121.832 120.437 1.395 26021 9814 1 15 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.084 0.107 26021 9815 1 15 . 1 1 110 110 LEU C C 110 178.101 178.101 178.696 -0.595 26021 9816 1 15 . 1 1 110 110 LEU CA C 110 57.892 57.892 58.409 -0.517 26021 9817 1 15 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.154 0.730 26021 9818 1 15 . 1 1 110 110 LEU H H 110 8.567 8.567 8.361 0.206 26021 9819 1 15 . 1 1 111 111 LYS N N 111 117.972 117.972 118.166 -0.194 26021 9820 1 15 . 1 1 111 111 LYS HA H 111 3.979 3.979 3.947 0.032 26021 9821 1 15 . 1 1 111 111 LYS C C 111 177.677 177.677 178.522 -0.845 26021 9822 1 15 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.899 -0.114 26021 9823 1 15 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.853 0.356 26021 9824 1 15 . 1 1 111 111 LYS H H 111 7.965 7.965 8.142 -0.177 26021 9825 1 15 . 1 1 112 112 LYS N N 112 115.433 115.433 117.446 -2.013 26021 9826 1 15 . 1 1 112 112 LYS HA H 112 4.110 4.110 3.985 0.125 26021 9827 1 15 . 1 1 112 112 LYS C C 112 178.270 178.270 178.376 -0.106 26021 9828 1 15 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.680 0.271 26021 9829 1 15 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.143 0.648 26021 9830 1 15 . 1 1 112 112 LYS H H 112 7.334 7.334 7.677 -0.343 26021 9831 1 15 . 1 1 113 113 VAL N N 113 114.861 114.861 119.653 -4.792 26021 9832 1 15 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.776 0.055 26021 9833 1 15 . 1 1 113 113 VAL C C 113 176.999 176.999 177.596 -0.597 26021 9834 1 15 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.745 -2.240 26021 9835 1 15 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.944 0.343 26021 9836 1 15 . 1 1 113 113 VAL H H 113 7.298 7.298 7.683 -0.385 26021 9837 1 15 . 1 1 114 114 VAL N N 114 121.457 121.457 119.031 2.426 26021 9838 1 15 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.785 -0.063 26021 9839 1 15 . 1 1 114 114 VAL C C 114 177.737 177.737 177.342 0.395 26021 9840 1 15 . 1 1 114 114 VAL CA C 114 65.224 65.224 65.655 -0.431 26021 9841 1 15 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.679 0.074 26021 9842 1 15 . 1 1 114 114 VAL H H 114 7.855 7.855 8.180 -0.325 26021 9843 1 15 . 1 1 115 115 ASP N N 115 120.804 120.804 120.148 0.656 26021 9844 1 15 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.440 0.015 26021 9845 1 15 . 1 1 115 115 ASP C C 115 177.380 177.380 177.322 0.058 26021 9846 1 15 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.870 -0.949 26021 9847 1 15 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.818 -0.445 26021 9848 1 15 . 1 1 115 115 ASP H H 115 8.311 8.311 8.009 0.302 26021 9849 1 15 . 1 1 116 116 LYS N N 116 119.582 119.582 117.518 2.064 26021 9850 1 15 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.322 -0.227 26021 9851 1 15 . 1 1 116 116 LYS C C 116 177.077 177.077 179.193 -2.116 26021 9852 1 15 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.853 -0.142 26021 9853 1 15 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.010 0.478 26021 9854 1 15 . 1 1 116 116 LYS H H 116 7.639 7.639 7.710 -0.071 26021 9855 1 15 . 1 1 117 117 HIS N N 117 115.246 115.246 116.820 -1.574 26021 9856 1 15 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.438 0.187 26021 9857 1 15 . 1 1 117 117 HIS C C 117 175.497 175.497 176.573 -1.076 26021 9858 1 15 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.622 -0.447 26021 9859 1 15 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.108 0.367 26021 9860 1 15 . 1 1 117 117 HIS H H 117 8.108 8.108 7.976 0.132 26021 9861 1 15 . 1 1 118 118 GLY N N 118 109.944 109.944 107.518 2.426 26021 9862 1 15 . 1 1 118 118 GLY C C 118 174.093 174.093 174.724 -0.631 26021 9863 1 15 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.566 0.498 26021 9864 1 15 . 1 1 118 118 GLY H H 118 8.153 8.153 8.107 0.046 26021 9865 1 15 . 1 1 119 119 ILE N N 119 118.468 118.468 122.879 -4.411 26021 9866 1 15 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.895 0.227 26021 9867 1 15 . 1 1 119 119 ILE C C 119 174.777 174.777 174.774 0.003 26021 9868 1 15 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.414 -0.313 26021 9869 1 15 . 1 1 119 119 ILE CB C 119 38.631 38.631 35.443 3.188 26021 9870 1 15 . 1 1 119 119 ILE H H 119 7.828 7.828 7.531 0.297 26021 9871 1 16 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.507 0.242 26021 9872 1 16 . 1 1 4 4 ASN C C 4 175.260 175.260 175.903 -0.643 26021 9873 1 16 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.472 -0.641 26021 9874 1 16 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.255 0.426 26021 9875 1 16 . 1 1 5 5 ALA N N 5 123.648 123.648 118.877 4.771 26021 9876 1 16 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.538 -0.248 26021 9877 1 16 . 1 1 5 5 ALA C C 5 178.256 178.256 179.133 -0.877 26021 9878 1 16 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.522 1.559 26021 9879 1 16 . 1 1 5 5 ALA CB C 5 19.025 19.025 17.967 1.058 26021 9880 1 16 . 1 1 5 5 ALA H H 5 8.520 8.520 8.111 0.409 26021 9881 1 16 . 1 1 6 6 GLY N N 6 107.044 107.044 108.188 -1.144 26021 9882 1 16 . 1 1 6 6 GLY C C 6 174.961 174.961 175.086 -0.125 26021 9883 1 16 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.999 -1.169 26021 9884 1 16 . 1 1 6 6 GLY H H 6 8.350 8.350 8.357 -0.007 26021 9885 1 16 . 1 1 7 7 ALA N N 7 123.366 123.366 123.638 -0.272 26021 9886 1 16 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.147 0.069 26021 9887 1 16 . 1 1 7 7 ALA C C 7 179.006 179.006 178.807 0.199 26021 9888 1 16 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.455 -0.752 26021 9889 1 16 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.415 0.429 26021 9890 1 16 . 1 1 7 7 ALA H H 7 8.078 8.078 8.036 0.042 26021 9891 1 16 . 1 1 8 8 ILE N N 8 117.376 117.376 118.198 -0.822 26021 9892 1 16 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.769 0.011 26021 9893 1 16 . 1 1 8 8 ILE C C 8 177.032 177.032 178.236 -1.204 26021 9894 1 16 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.300 -1.142 26021 9895 1 16 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.152 -1.863 26021 9896 1 16 . 1 1 8 8 ILE H H 8 7.943 7.943 7.462 0.481 26021 9897 1 16 . 1 1 9 9 ALA N N 9 121.414 121.414 122.551 -1.137 26021 9898 1 16 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.081 -0.148 26021 9899 1 16 . 1 1 9 9 ALA C C 9 180.515 180.515 179.086 1.429 26021 9900 1 16 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.815 0.283 26021 9901 1 16 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.021 0.140 26021 9902 1 16 . 1 1 9 9 ALA H H 9 8.062 8.062 7.650 0.412 26021 9903 1 16 . 1 1 10 10 LYS N N 10 114.594 114.594 118.977 -4.383 26021 9904 1 16 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.108 0.056 26021 9905 1 16 . 1 1 10 10 LYS C C 10 178.099 178.099 177.852 0.247 26021 9906 1 16 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.370 -0.530 26021 9907 1 16 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.317 0.152 26021 9908 1 16 . 1 1 10 10 LYS H H 10 7.554 7.554 8.090 -0.536 26021 9909 1 16 . 1 1 11 11 LEU N N 11 119.662 119.662 118.326 1.336 26021 9910 1 16 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.143 -0.065 26021 9911 1 16 . 1 1 11 11 LEU C C 11 177.930 177.930 177.996 -0.066 26021 9912 1 16 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.269 0.287 26021 9913 1 16 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.745 1.343 26021 9914 1 16 . 1 1 11 11 LEU H H 11 7.814 7.814 7.278 0.536 26021 9915 1 16 . 1 1 12 12 ILE N N 12 117.945 117.945 120.926 -2.981 26021 9916 1 16 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.880 -0.188 26021 9917 1 16 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.230 1.399 26021 9918 1 16 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.937 1.473 26021 9919 1 16 . 1 1 12 12 ILE H H 12 7.426 7.426 7.706 -0.280 26021 9920 1 16 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.276 0.127 26021 9921 1 16 . 1 1 13 13 PRO C C 13 179.030 179.030 178.757 0.273 26021 9922 1 16 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.147 0.097 26021 9923 1 16 . 1 1 13 13 PRO CB C 13 30.809 30.809 30.980 -0.171 26021 9924 1 16 . 1 1 14 14 LYS N N 14 117.855 117.855 119.017 -1.162 26021 9925 1 16 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.125 0.020 26021 9926 1 16 . 1 1 14 14 LYS C C 14 178.565 178.565 178.777 -0.212 26021 9927 1 16 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.233 0.200 26021 9928 1 16 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.162 0.763 26021 9929 1 16 . 1 1 14 14 LYS H H 14 6.685 6.685 7.435 -0.750 26021 9930 1 16 . 1 1 15 15 LEU N N 15 118.008 118.008 118.368 -0.360 26021 9931 1 16 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.271 -0.268 26021 9932 1 16 . 1 1 15 15 LEU C C 15 178.662 178.662 178.742 -0.080 26021 9933 1 16 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.630 1.082 26021 9934 1 16 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.211 -0.212 26021 9935 1 16 . 1 1 15 15 LEU H H 15 8.148 8.148 7.814 0.334 26021 9936 1 16 . 1 1 16 16 GLY N N 16 103.895 103.895 107.882 -3.987 26021 9937 1 16 . 1 1 16 16 GLY C C 16 176.838 176.838 175.468 1.370 26021 9938 1 16 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.417 -0.052 26021 9939 1 16 . 1 1 16 16 GLY H H 16 8.104 8.104 8.042 0.062 26021 9940 1 16 . 1 1 17 17 GLU N N 17 121.655 121.655 121.042 0.613 26021 9941 1 16 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.092 0.041 26021 9942 1 16 . 1 1 17 17 GLU C C 17 179.007 179.007 178.303 0.704 26021 9943 1 16 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.977 -0.167 26021 9944 1 16 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.260 -0.127 26021 9945 1 16 . 1 1 17 17 GLU H H 17 7.817 7.817 7.738 0.079 26021 9946 1 16 . 1 1 18 18 LEU N N 18 117.834 117.834 116.376 1.458 26021 9947 1 16 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.339 -0.221 26021 9948 1 16 . 1 1 18 18 LEU C C 18 177.658 177.658 177.418 0.240 26021 9949 1 16 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.435 1.594 26021 9950 1 16 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.524 0.146 26021 9951 1 16 . 1 1 18 18 LEU H H 18 7.389 7.389 7.887 -0.498 26021 9952 1 16 . 1 1 19 19 LEU N N 19 113.694 113.694 117.751 -4.057 26021 9953 1 16 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.377 -0.215 26021 9954 1 16 . 1 1 19 19 LEU C C 19 178.123 178.123 178.311 -0.188 26021 9955 1 16 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.396 0.456 26021 9956 1 16 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.083 0.138 26021 9957 1 16 . 1 1 19 19 LEU H H 19 7.269 7.269 7.763 -0.494 26021 9958 1 16 . 1 1 20 20 VAL N N 20 112.778 112.778 113.803 -1.025 26021 9959 1 16 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.116 0.327 26021 9960 1 16 . 1 1 20 20 VAL C C 20 177.021 177.021 176.710 0.311 26021 9961 1 16 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.892 -2.037 26021 9962 1 16 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.276 0.502 26021 9963 1 16 . 1 1 20 20 VAL H H 20 7.356 7.356 7.805 -0.449 26021 9964 1 16 . 1 1 21 21 GLY N N 21 108.962 108.962 107.186 1.776 26021 9965 1 16 . 1 1 21 21 GLY C C 21 173.813 173.813 174.397 -0.584 26021 9966 1 16 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.683 0.363 26021 9967 1 16 . 1 1 21 21 GLY H H 21 7.925 7.925 8.187 -0.262 26021 9968 1 16 . 1 1 22 22 GLU N N 22 120.607 120.607 122.514 -1.907 26021 9969 1 16 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.608 -0.330 26021 9970 1 16 . 1 1 22 22 GLU C C 22 175.869 175.869 175.466 0.403 26021 9971 1 16 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.364 0.666 26021 9972 1 16 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.977 -0.296 26021 9973 1 16 . 1 1 22 22 GLU H H 22 8.300 8.300 8.075 0.225 26021 9974 1 16 . 1 1 23 23 TYR N N 23 120.738 120.738 118.503 2.235 26021 9975 1 16 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.085 -0.528 26021 9976 1 16 . 1 1 23 23 TYR C C 23 175.264 175.264 174.509 0.755 26021 9977 1 16 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.256 0.305 26021 9978 1 16 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.275 -0.029 26021 9979 1 16 . 1 1 23 23 TYR H H 23 7.756 7.756 7.465 0.291 26021 9980 1 16 . 1 1 24 24 LYS N N 24 122.095 122.095 121.918 0.177 26021 9981 1 16 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.636 -0.453 26021 9982 1 16 . 1 1 24 24 LYS C C 24 175.742 175.742 174.596 1.146 26021 9983 1 16 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.811 0.307 26021 9984 1 16 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.901 -0.183 26021 9985 1 16 . 1 1 24 24 LYS H H 24 8.692 8.692 8.821 -0.129 26021 9986 1 16 . 1 1 25 25 LEU N N 25 121.123 121.123 118.979 2.144 26021 9987 1 16 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.771 -0.279 26021 9988 1 16 . 1 1 25 25 LEU C C 25 177.487 177.487 176.449 1.038 26021 9989 1 16 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.480 0.854 26021 9990 1 16 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.138 -0.380 26021 9991 1 16 . 1 1 25 25 LEU H H 25 8.088 8.088 7.544 0.544 26021 9992 1 16 . 1 1 26 26 HIS N N 26 122.993 122.993 118.841 4.152 26021 9993 1 16 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.630 -0.129 26021 9994 1 16 . 1 1 26 26 HIS C C 26 176.716 176.716 176.382 0.334 26021 9995 1 16 . 1 1 26 26 HIS CA C 26 57.197 57.197 56.404 0.792 26021 9996 1 16 . 1 1 26 26 HIS CB C 26 31.357 31.357 31.578 -0.221 26021 9997 1 16 . 1 1 26 26 HIS H H 26 8.882 8.882 8.591 0.291 26021 9998 1 16 . 1 1 27 27 LYS N N 27 124.894 124.894 119.995 4.899 26021 9999 1 16 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.245 -0.297 26021 10000 1 16 . 1 1 27 27 LYS C C 27 178.873 178.873 178.479 0.394 26021 10001 1 16 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.780 1.231 26021 10002 1 16 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.338 0.104 26021 10003 1 16 . 1 1 27 27 LYS H H 27 8.699 8.699 8.147 0.552 26021 10004 1 16 . 1 1 28 28 GLY N N 28 111.258 111.258 106.035 5.223 26021 10005 1 16 . 1 1 28 28 GLY C C 28 176.131 176.131 175.294 0.837 26021 10006 1 16 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.278 0.212 26021 10007 1 16 . 1 1 28 28 GLY H H 28 9.814 9.814 8.646 1.168 26021 10008 1 16 . 1 1 29 29 VAL N N 29 122.719 122.719 121.812 0.907 26021 10009 1 16 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.752 0.140 26021 10010 1 16 . 1 1 29 29 VAL C C 29 177.628 177.628 177.793 -0.165 26021 10011 1 16 . 1 1 29 29 VAL CA C 29 65.520 65.520 64.713 0.807 26021 10012 1 16 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.718 0.024 26021 10013 1 16 . 1 1 29 29 VAL H H 29 7.431 7.431 7.208 0.223 26021 10014 1 16 . 1 1 30 30 LYS N N 30 119.791 119.791 119.398 0.393 26021 10015 1 16 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.702 -0.067 26021 10016 1 16 . 1 1 30 30 LYS C C 30 177.666 177.666 178.051 -0.385 26021 10017 1 16 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.681 1.343 26021 10018 1 16 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.409 0.996 26021 10019 1 16 . 1 1 30 30 LYS H H 30 8.255 8.255 7.596 0.659 26021 10020 1 16 . 1 1 31 31 LYS N N 31 117.918 117.918 117.858 0.060 26021 10021 1 16 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.080 0.036 26021 10022 1 16 . 1 1 31 31 LYS C C 31 177.784 177.784 178.372 -0.588 26021 10023 1 16 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.288 -0.585 26021 10024 1 16 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.803 0.042 26021 10025 1 16 . 1 1 31 31 LYS H H 31 7.689 7.689 7.627 0.062 26021 10026 1 16 . 1 1 32 32 ASN N N 32 116.347 116.347 116.696 -0.349 26021 10027 1 16 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.167 0.353 26021 10028 1 16 . 1 1 32 32 ASN C C 32 177.764 177.764 176.761 1.003 26021 10029 1 16 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.457 0.858 26021 10030 1 16 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.590 0.042 26021 10031 1 16 . 1 1 32 32 ASN H H 32 7.556 7.556 7.948 -0.392 26021 10032 1 16 . 1 1 33 33 ILE N N 33 120.592 120.592 120.584 0.008 26021 10033 1 16 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.707 -0.425 26021 10034 1 16 . 1 1 33 33 ILE C C 33 177.074 177.074 177.557 -0.483 26021 10035 1 16 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.178 2.710 26021 10036 1 16 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.904 0.274 26021 10037 1 16 . 1 1 33 33 ILE H H 33 8.236 8.236 7.664 0.572 26021 10038 1 16 . 1 1 34 34 GLU N N 34 120.595 120.595 119.876 0.719 26021 10039 1 16 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.865 -0.077 26021 10040 1 16 . 1 1 34 34 GLU C C 34 179.739 179.739 178.998 0.741 26021 10041 1 16 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.781 0.458 26021 10042 1 16 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.911 0.934 26021 10043 1 16 . 1 1 34 34 GLU H H 34 8.551 8.551 8.301 0.250 26021 10044 1 16 . 1 1 35 35 ASP N N 35 120.600 120.600 121.007 -0.407 26021 10045 1 16 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.472 -0.060 26021 10046 1 16 . 1 1 35 35 ASP C C 35 178.681 178.681 178.554 0.127 26021 10047 1 16 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.753 0.709 26021 10048 1 16 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.584 -0.834 26021 10049 1 16 . 1 1 35 35 ASP H H 35 8.670 8.670 7.584 1.086 26021 10050 1 16 . 1 1 36 36 LEU N N 36 123.004 123.004 121.744 1.260 26021 10051 1 16 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.390 -0.295 26021 10052 1 16 . 1 1 36 36 LEU C C 36 178.035 178.035 179.009 -0.974 26021 10053 1 16 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.900 0.128 26021 10054 1 16 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.074 -0.198 26021 10055 1 16 . 1 1 36 36 LEU H H 36 8.166 8.166 7.659 0.507 26021 10056 1 16 . 1 1 37 37 LEU N N 37 120.178 120.178 119.635 0.543 26021 10057 1 16 . 1 1 37 37 LEU HA H 37 3.856 3.856 3.927 -0.071 26021 10058 1 16 . 1 1 37 37 LEU C C 37 178.128 178.128 178.033 0.095 26021 10059 1 16 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.607 0.068 26021 10060 1 16 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.416 0.739 26021 10061 1 16 . 1 1 37 37 LEU H H 37 8.736 8.736 8.368 0.368 26021 10062 1 16 . 1 1 38 38 LYS N N 38 118.110 118.110 118.124 -0.014 26021 10063 1 16 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.903 0.030 26021 10064 1 16 . 1 1 38 38 LYS C C 38 179.533 179.533 178.739 0.794 26021 10065 1 16 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.889 0.384 26021 10066 1 16 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.117 0.160 26021 10067 1 16 . 1 1 38 38 LYS H H 38 7.770 7.770 7.801 -0.031 26021 10068 1 16 . 1 1 39 39 GLU N N 39 119.265 119.265 120.078 -0.813 26021 10069 1 16 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.143 0.159 26021 10070 1 16 . 1 1 39 39 GLU C C 39 179.720 179.720 179.167 0.553 26021 10071 1 16 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.447 -0.689 26021 10072 1 16 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.676 -0.086 26021 10073 1 16 . 1 1 39 39 GLU H H 39 7.709 7.709 7.658 0.051 26021 10074 1 16 . 1 1 40 40 LEU N N 40 119.007 119.007 120.451 -1.444 26021 10075 1 16 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.034 0.016 26021 10076 1 16 . 1 1 40 40 LEU C C 40 179.690 179.690 179.089 0.601 26021 10077 1 16 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.779 -0.128 26021 10078 1 16 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.803 0.882 26021 10079 1 16 . 1 1 40 40 LEU H H 40 8.851 8.851 8.230 0.621 26021 10080 1 16 . 1 1 41 41 LYS N N 41 120.500 120.500 118.618 1.882 26021 10081 1 16 . 1 1 41 41 LYS HA H 41 3.952 3.952 3.918 0.034 26021 10082 1 16 . 1 1 41 41 LYS C C 41 180.223 180.223 179.189 1.034 26021 10083 1 16 . 1 1 41 41 LYS CA C 41 60.891 60.891 60.212 0.679 26021 10084 1 16 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.302 -0.235 26021 10085 1 16 . 1 1 41 41 LYS H H 41 8.482 8.482 8.558 -0.076 26021 10086 1 16 . 1 1 42 42 THR N N 42 119.555 119.555 112.019 7.536 26021 10087 1 16 . 1 1 42 42 THR HA H 42 4.000 4.000 4.052 -0.052 26021 10088 1 16 . 1 1 42 42 THR C C 42 176.633 176.633 176.941 -0.308 26021 10089 1 16 . 1 1 42 42 THR CA C 42 66.574 66.574 65.503 1.071 26021 10090 1 16 . 1 1 42 42 THR CB C 42 67.924 67.924 68.735 -0.811 26021 10091 1 16 . 1 1 42 42 THR H H 42 7.863 7.863 7.556 0.307 26021 10092 1 16 . 1 1 43 43 MET N N 43 122.839 122.839 120.603 2.236 26021 10093 1 16 . 1 1 43 43 MET HA H 43 4.022 4.022 4.009 0.013 26021 10094 1 16 . 1 1 43 43 MET C C 43 177.290 177.290 177.998 -0.708 26021 10095 1 16 . 1 1 43 43 MET CA C 43 59.731 59.731 59.873 -0.142 26021 10096 1 16 . 1 1 43 43 MET CB C 43 33.610 33.610 32.127 1.482 26021 10097 1 16 . 1 1 43 43 MET H H 43 8.714 8.714 8.503 0.211 26021 10098 1 16 . 1 1 44 44 ASN N N 44 118.049 118.049 118.156 -0.107 26021 10099 1 16 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.360 0.014 26021 10100 1 16 . 1 1 44 44 ASN C C 44 176.297 176.297 176.982 -0.685 26021 10101 1 16 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.500 0.394 26021 10102 1 16 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.807 0.599 26021 10103 1 16 . 1 1 44 44 ASN H H 44 8.988 8.988 7.988 1.000 26021 10104 1 16 . 1 1 45 45 ALA N N 45 119.260 119.260 121.849 -2.589 26021 10105 1 16 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.179 -0.113 26021 10106 1 16 . 1 1 45 45 ALA C C 45 180.476 180.476 179.107 1.369 26021 10107 1 16 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.246 1.022 26021 10108 1 16 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.185 -0.497 26021 10109 1 16 . 1 1 45 45 ALA H H 45 7.675 7.675 7.443 0.232 26021 10110 1 16 . 1 1 46 46 ALA N N 46 121.126 121.126 122.891 -1.765 26021 10111 1 16 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.084 0.032 26021 10112 1 16 . 1 1 46 46 ALA C C 46 179.314 179.314 178.899 0.415 26021 10113 1 16 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.262 -0.276 26021 10114 1 16 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.654 -0.432 26021 10115 1 16 . 1 1 46 46 ALA H H 46 7.872 7.872 8.073 -0.201 26021 10116 1 16 . 1 1 47 47 LEU N N 47 119.328 119.328 115.676 3.652 26021 10117 1 16 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.771 0.420 26021 10118 1 16 . 1 1 47 47 LEU C C 47 180.403 180.403 178.261 2.142 26021 10119 1 16 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.920 0.126 26021 10120 1 16 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.461 0.489 26021 10121 1 16 . 1 1 47 47 LEU H H 47 8.529 8.529 7.397 1.132 26021 10122 1 16 . 1 1 48 48 ILE N N 48 121.653 121.653 118.370 3.283 26021 10123 1 16 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.654 0.048 26021 10124 1 16 . 1 1 48 48 ILE C C 48 178.730 178.730 178.064 0.666 26021 10125 1 16 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.512 0.398 26021 10126 1 16 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.622 0.290 26021 10127 1 16 . 1 1 48 48 ILE H H 48 8.386 8.386 7.026 1.360 26021 10128 1 16 . 1 1 49 49 LYS N N 49 119.896 119.896 118.949 0.947 26021 10129 1 16 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.173 -0.130 26021 10130 1 16 . 1 1 49 49 LYS C C 49 179.999 179.999 179.462 0.537 26021 10131 1 16 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.199 -0.142 26021 10132 1 16 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.748 -0.787 26021 10133 1 16 . 1 1 49 49 LYS H H 49 7.456 7.456 7.590 -0.134 26021 10134 1 16 . 1 1 50 50 ILE N N 50 119.964 119.964 115.992 3.972 26021 10135 1 16 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.167 -0.431 26021 10136 1 16 . 1 1 50 50 ILE C C 50 177.960 177.960 177.941 0.019 26021 10137 1 16 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.887 0.462 26021 10138 1 16 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.569 0.562 26021 10139 1 16 . 1 1 50 50 ILE H H 50 8.154 8.154 8.735 -0.581 26021 10140 1 16 . 1 1 51 51 GLY N N 51 106.709 106.709 109.260 -2.551 26021 10141 1 16 . 1 1 51 51 GLY C C 51 174.461 174.461 175.288 -0.827 26021 10142 1 16 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.762 -0.853 26021 10143 1 16 . 1 1 51 51 GLY H H 51 7.932 7.932 7.797 0.135 26021 10144 1 16 . 1 1 52 52 GLU N N 52 118.736 118.736 118.716 0.020 26021 10145 1 16 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.604 -0.284 26021 10146 1 16 . 1 1 52 52 GLU C C 52 176.789 176.789 176.536 0.253 26021 10147 1 16 . 1 1 52 52 GLU CA C 52 56.274 56.274 54.986 1.288 26021 10148 1 16 . 1 1 52 52 GLU CB C 52 30.112 30.112 29.768 0.344 26021 10149 1 16 . 1 1 52 52 GLU H H 52 7.597 7.597 7.577 0.020 26021 10150 1 16 . 1 1 53 53 VAL N N 53 122.982 122.982 123.512 -0.530 26021 10151 1 16 . 1 1 53 53 VAL HA H 53 4.261 4.261 3.959 0.302 26021 10152 1 16 . 1 1 53 53 VAL CA C 53 60.385 60.385 61.455 -1.070 26021 10153 1 16 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.581 1.241 26021 10154 1 16 . 1 1 53 53 VAL H H 53 7.511 7.511 7.814 -0.303 26021 10155 1 16 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.777 -0.132 26021 10156 1 16 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.407 0.171 26021 10157 1 16 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.269 0.266 26021 10158 1 16 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.316 -0.125 26021 10159 1 16 . 1 1 55 55 PRO C C 55 178.258 178.258 176.785 1.473 26021 10160 1 16 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.078 1.350 26021 10161 1 16 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.932 -0.086 26021 10162 1 16 . 1 1 56 56 ASP N N 56 114.117 114.117 118.185 -4.068 26021 10163 1 16 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.507 -0.016 26021 10164 1 16 . 1 1 56 56 ASP C C 56 176.696 176.696 177.215 -0.519 26021 10165 1 16 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.918 -0.780 26021 10166 1 16 . 1 1 56 56 ASP CB C 56 39.726 39.726 41.106 -1.380 26021 10167 1 16 . 1 1 56 56 ASP H H 56 8.489 8.489 8.564 -0.075 26021 10168 1 16 . 1 1 57 57 GLN N N 57 117.641 117.641 114.614 3.027 26021 10169 1 16 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.301 0.073 26021 10170 1 16 . 1 1 57 57 GLN C C 57 175.765 175.765 175.236 0.529 26021 10171 1 16 . 1 1 57 57 GLN CA C 57 55.290 55.290 54.928 0.362 26021 10172 1 16 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.279 0.367 26021 10173 1 16 . 1 1 57 57 GLN H H 57 8.206 8.206 7.673 0.533 26021 10174 1 16 . 1 1 58 58 LEU N N 58 122.141 122.141 122.247 -0.106 26021 10175 1 16 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.492 -0.042 26021 10176 1 16 . 1 1 58 58 LEU C C 58 176.849 176.849 175.571 1.278 26021 10177 1 16 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.459 -0.464 26021 10178 1 16 . 1 1 58 58 LEU CB C 58 43.231 43.231 41.909 1.322 26021 10179 1 16 . 1 1 58 58 LEU H H 58 7.152 7.152 7.409 -0.257 26021 10180 1 16 . 1 1 59 59 ASP N N 59 125.643 125.643 126.155 -0.512 26021 10181 1 16 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.827 -0.108 26021 10182 1 16 . 1 1 59 59 ASP C C 59 177.249 177.249 176.843 0.406 26021 10183 1 16 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.072 0.331 26021 10184 1 16 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.557 -1.325 26021 10185 1 16 . 1 1 59 59 ASP H H 59 9.312 9.312 7.797 1.515 26021 10186 1 16 . 1 1 60 60 SER N N 60 116.550 116.550 115.926 0.624 26021 10187 1 16 . 1 1 60 60 SER HA H 60 4.124 4.124 4.233 -0.109 26021 10188 1 16 . 1 1 60 60 SER C C 60 176.840 176.840 176.457 0.383 26021 10189 1 16 . 1 1 60 60 SER CA C 60 61.722 61.722 61.266 0.456 26021 10190 1 16 . 1 1 60 60 SER CB C 60 62.815 62.815 63.538 -0.723 26021 10191 1 16 . 1 1 60 60 SER H H 60 8.647 8.647 8.523 0.124 26021 10192 1 16 . 1 1 61 61 GLN N N 61 121.394 121.394 120.806 0.588 26021 10193 1 16 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.376 -0.245 26021 10194 1 16 . 1 1 61 61 GLN C C 61 178.629 178.629 177.062 1.567 26021 10195 1 16 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.129 0.624 26021 10196 1 16 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.255 -0.002 26021 10197 1 16 . 1 1 61 61 GLN H H 61 8.453 8.453 8.420 0.033 26021 10198 1 16 . 1 1 62 62 ASP N N 62 122.187 122.187 118.468 3.719 26021 10199 1 16 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.436 0.183 26021 10200 1 16 . 1 1 62 62 ASP C C 62 178.318 178.318 178.152 0.166 26021 10201 1 16 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.638 -0.176 26021 10202 1 16 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.074 0.962 26021 10203 1 16 . 1 1 62 62 ASP H H 62 8.311 8.311 8.718 -0.407 26021 10204 1 16 . 1 1 63 63 LYS N N 63 120.325 120.325 118.340 1.985 26021 10205 1 16 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.206 -0.197 26021 10206 1 16 . 1 1 63 63 LYS C C 63 178.765 178.765 179.132 -0.367 26021 10207 1 16 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.473 1.280 26021 10208 1 16 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.034 0.419 26021 10209 1 16 . 1 1 63 63 LYS H H 63 7.923 7.923 7.845 0.078 26021 10210 1 16 . 1 1 64 64 LEU N N 64 119.491 119.491 120.366 -0.875 26021 10211 1 16 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.182 0.044 26021 10212 1 16 . 1 1 64 64 LEU C C 64 179.526 179.526 179.218 0.308 26021 10213 1 16 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.527 0.271 26021 10214 1 16 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.548 0.227 26021 10215 1 16 . 1 1 64 64 LEU H H 64 7.820 7.820 7.375 0.445 26021 10216 1 16 . 1 1 65 65 TRP N N 65 120.674 120.674 122.082 -1.408 26021 10217 1 16 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.470 -0.162 26021 10218 1 16 . 1 1 65 65 TRP C C 65 177.379 177.379 177.056 0.323 26021 10219 1 16 . 1 1 65 65 TRP CA C 65 61.802 61.802 59.696 2.106 26021 10220 1 16 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.472 -0.061 26021 10221 1 16 . 1 1 65 65 TRP H H 65 8.196 8.196 8.298 -0.102 26021 10222 1 16 . 1 1 66 66 ALA N N 66 120.606 120.606 119.292 1.314 26021 10223 1 16 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.518 0.191 26021 10224 1 16 . 1 1 66 66 ALA C C 66 180.376 180.376 178.877 1.499 26021 10225 1 16 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.698 0.866 26021 10226 1 16 . 1 1 66 66 ALA CB C 66 17.654 17.654 18.103 -0.449 26021 10227 1 16 . 1 1 66 66 ALA H H 66 8.305 8.305 7.601 0.704 26021 10228 1 16 . 1 1 67 67 ASP N N 67 119.175 119.175 117.524 1.651 26021 10229 1 16 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.426 0.024 26021 10230 1 16 . 1 1 67 67 ASP C C 67 178.757 178.757 177.898 0.859 26021 10231 1 16 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.688 0.804 26021 10232 1 16 . 1 1 67 67 ASP CB C 67 40.154 40.154 41.000 -0.846 26021 10233 1 16 . 1 1 67 67 ASP H H 67 7.945 7.945 8.056 -0.111 26021 10234 1 16 . 1 1 68 68 GLU N N 68 122.322 122.322 119.195 3.127 26021 10235 1 16 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.096 -0.081 26021 10236 1 16 . 1 1 68 68 GLU C C 68 180.055 180.055 178.960 1.095 26021 10237 1 16 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.325 0.785 26021 10238 1 16 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.750 -0.103 26021 10239 1 16 . 1 1 68 68 GLU H H 68 8.168 8.168 7.876 0.292 26021 10240 1 16 . 1 1 69 69 VAL N N 69 122.135 122.135 117.355 4.780 26021 10241 1 16 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.836 -0.584 26021 10242 1 16 . 1 1 69 69 VAL C C 69 177.736 177.736 178.106 -0.370 26021 10243 1 16 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.619 0.920 26021 10244 1 16 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.313 -0.071 26021 10245 1 16 . 1 1 69 69 VAL H H 69 8.424 8.424 7.251 1.173 26021 10246 1 16 . 1 1 70 70 ARG N N 70 121.373 121.373 119.835 1.538 26021 10247 1 16 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.007 -0.315 26021 10248 1 16 . 1 1 70 70 ARG C C 70 179.117 179.117 178.996 0.121 26021 10249 1 16 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.282 0.883 26021 10250 1 16 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.910 -0.256 26021 10251 1 16 . 1 1 70 70 ARG H H 70 7.916 7.916 7.367 0.549 26021 10252 1 16 . 1 1 71 71 GLU N N 71 119.075 119.075 119.626 -0.551 26021 10253 1 16 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.077 -0.014 26021 10254 1 16 . 1 1 71 71 GLU C C 71 179.119 179.119 179.166 -0.047 26021 10255 1 16 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.050 0.637 26021 10256 1 16 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.481 0.789 26021 10257 1 16 . 1 1 71 71 GLU H H 71 8.031 8.031 8.655 -0.624 26021 10258 1 16 . 1 1 72 72 LEU N N 72 120.503 120.503 120.154 0.349 26021 10259 1 16 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.239 -0.182 26021 10260 1 16 . 1 1 72 72 LEU C C 72 178.734 178.734 178.792 -0.058 26021 10261 1 16 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.589 0.833 26021 10262 1 16 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.099 0.309 26021 10263 1 16 . 1 1 72 72 LEU H H 72 8.175 8.175 7.655 0.520 26021 10264 1 16 . 1 1 73 73 SER N N 73 115.243 115.243 115.607 -0.364 26021 10265 1 16 . 1 1 73 73 SER HA H 73 3.824 3.824 4.164 -0.340 26021 10266 1 16 . 1 1 73 73 SER C C 73 175.697 175.697 176.751 -1.054 26021 10267 1 16 . 1 1 73 73 SER CA C 73 62.384 62.384 61.194 1.190 26021 10268 1 16 . 1 1 73 73 SER CB C 73 62.093 62.093 62.564 -0.471 26021 10269 1 16 . 1 1 73 73 SER H H 73 8.411 8.411 8.225 0.186 26021 10270 1 16 . 1 1 74 74 TYR N N 74 121.342 121.342 123.658 -2.316 26021 10271 1 16 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.231 0.260 26021 10272 1 16 . 1 1 74 74 TYR C C 74 178.747 178.747 177.502 1.245 26021 10273 1 16 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.734 -0.299 26021 10274 1 16 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.406 -0.899 26021 10275 1 16 . 1 1 74 74 TYR H H 74 7.314 7.314 7.671 -0.357 26021 10276 1 16 . 1 1 75 75 VAL N N 75 120.779 120.779 117.936 2.843 26021 10277 1 16 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.532 0.329 26021 10278 1 16 . 1 1 75 75 VAL C C 75 179.788 179.788 177.933 1.855 26021 10279 1 16 . 1 1 75 75 VAL CA C 75 66.048 66.048 66.077 -0.029 26021 10280 1 16 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.046 0.669 26021 10281 1 16 . 1 1 75 75 VAL H H 75 7.740 7.740 7.872 -0.132 26021 10282 1 16 . 1 1 76 76 ILE N N 76 120.598 120.598 119.626 0.972 26021 10283 1 16 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.673 0.027 26021 10284 1 16 . 1 1 76 76 ILE C C 76 177.066 177.066 178.040 -0.974 26021 10285 1 16 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.346 1.573 26021 10286 1 16 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.399 -0.014 26021 10287 1 16 . 1 1 76 76 ILE H H 76 8.584 8.584 7.571 1.013 26021 10288 1 16 . 1 1 77 77 GLU N N 77 120.468 120.468 119.226 1.242 26021 10289 1 16 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.882 -0.233 26021 10290 1 16 . 1 1 77 77 GLU C C 77 177.502 177.502 178.663 -1.161 26021 10291 1 16 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.239 1.623 26021 10292 1 16 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.430 0.922 26021 10293 1 16 . 1 1 77 77 GLU H H 77 8.445 8.445 8.043 0.402 26021 10294 1 16 . 1 1 78 78 ASP N N 78 117.382 117.382 119.107 -1.725 26021 10295 1 16 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.352 0.039 26021 10296 1 16 . 1 1 78 78 ASP C C 78 177.382 177.382 177.846 -0.464 26021 10297 1 16 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.967 0.528 26021 10298 1 16 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.620 1.315 26021 10299 1 16 . 1 1 78 78 ASP H H 78 7.885 7.885 7.613 0.272 26021 10300 1 16 . 1 1 79 79 ALA N N 79 120.171 120.171 121.990 -1.819 26021 10301 1 16 . 1 1 79 79 ALA HA H 79 4.050 4.050 3.946 0.104 26021 10302 1 16 . 1 1 79 79 ALA C C 79 181.193 181.193 179.622 1.571 26021 10303 1 16 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.094 -0.039 26021 10304 1 16 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.482 -0.062 26021 10305 1 16 . 1 1 79 79 ALA H H 79 7.754 7.754 7.681 0.073 26021 10306 1 16 . 1 1 80 80 VAL N N 80 119.541 119.541 112.300 7.241 26021 10307 1 16 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.662 0.015 26021 10308 1 16 . 1 1 80 80 VAL C C 80 177.096 177.096 177.316 -0.220 26021 10309 1 16 . 1 1 80 80 VAL CA C 80 67.084 67.084 65.145 1.939 26021 10310 1 16 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.707 -0.264 26021 10311 1 16 . 1 1 80 80 VAL H H 80 8.635 8.635 7.228 1.407 26021 10312 1 16 . 1 1 81 81 ASP N N 81 121.140 121.140 120.837 0.303 26021 10313 1 16 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.382 0.087 26021 10314 1 16 . 1 1 81 81 ASP C C 81 179.569 179.569 178.342 1.227 26021 10315 1 16 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.021 0.908 26021 10316 1 16 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.628 -0.693 26021 10317 1 16 . 1 1 81 81 ASP H H 81 8.575 8.575 8.002 0.573 26021 10318 1 16 . 1 1 82 82 LYS N N 82 118.159 118.159 118.707 -0.548 26021 10319 1 16 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.000 0.021 26021 10320 1 16 . 1 1 82 82 LYS C C 82 178.890 178.890 178.485 0.405 26021 10321 1 16 . 1 1 82 82 LYS CA C 82 59.067 59.067 59.012 0.055 26021 10322 1 16 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.844 0.743 26021 10323 1 16 . 1 1 82 82 LYS H H 82 8.079 8.079 7.810 0.269 26021 10324 1 16 . 1 1 83 83 PHE N N 83 120.900 120.900 119.398 1.502 26021 10325 1 16 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.264 0.012 26021 10326 1 16 . 1 1 83 83 PHE C C 83 177.269 177.269 177.284 -0.015 26021 10327 1 16 . 1 1 83 83 PHE CA C 83 60.943 60.943 61.198 -0.255 26021 10328 1 16 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.001 0.746 26021 10329 1 16 . 1 1 83 83 PHE H H 83 8.015 8.015 7.738 0.277 26021 10330 1 16 . 1 1 84 84 LEU N N 84 118.209 118.209 117.714 0.495 26021 10331 1 16 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.045 -0.103 26021 10332 1 16 . 1 1 84 84 LEU C C 84 178.774 178.774 178.474 0.300 26021 10333 1 16 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.445 -0.275 26021 10334 1 16 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.607 0.586 26021 10335 1 16 . 1 1 84 84 LEU H H 84 8.338 8.338 7.678 0.660 26021 10336 1 16 . 1 1 85 85 VAL N N 85 116.078 116.078 119.126 -3.048 26021 10337 1 16 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.736 0.256 26021 10338 1 16 . 1 1 85 85 VAL C C 85 177.252 177.252 177.702 -0.450 26021 10339 1 16 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.970 -1.790 26021 10340 1 16 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.502 0.388 26021 10341 1 16 . 1 1 85 85 VAL H H 85 7.447 7.447 7.250 0.197 26021 10342 1 16 . 1 1 86 86 ARG N N 86 120.842 120.842 118.953 1.889 26021 10343 1 16 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.102 0.125 26021 10344 1 16 . 1 1 86 86 ARG C C 86 177.520 177.520 179.347 -1.827 26021 10345 1 16 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.097 -1.038 26021 10346 1 16 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.841 0.422 26021 10347 1 16 . 1 1 86 86 ARG H H 86 7.598 7.598 7.899 -0.301 26021 10348 1 16 . 1 1 87 87 VAL N N 87 119.293 119.293 116.954 2.339 26021 10349 1 16 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.704 0.121 26021 10350 1 16 . 1 1 87 87 VAL C C 87 176.121 176.121 177.102 -0.981 26021 10351 1 16 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.424 -1.986 26021 10352 1 16 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.848 0.924 26021 10353 1 16 . 1 1 87 87 VAL H H 87 7.994 7.994 7.400 0.594 26021 10354 1 16 . 1 1 88 88 HIS N N 88 120.016 120.016 118.747 1.269 26021 10355 1 16 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.373 0.264 26021 10356 1 16 . 1 1 88 88 HIS C C 88 175.639 175.639 176.023 -0.384 26021 10357 1 16 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.161 0.190 26021 10358 1 16 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.296 -0.615 26021 10359 1 16 . 1 1 88 88 HIS H H 88 7.969 7.969 7.801 0.168 26021 10360 1 16 . 1 1 89 89 GLY N N 89 109.587 109.587 107.199 2.388 26021 10361 1 16 . 1 1 89 89 GLY C C 89 173.730 173.730 174.427 -0.697 26021 10362 1 16 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.303 -0.134 26021 10363 1 16 . 1 1 89 89 GLY H H 89 8.083 8.083 8.161 -0.078 26021 10364 1 16 . 1 1 90 90 VAL N N 90 118.224 118.224 123.315 -5.091 26021 10365 1 16 . 1 1 90 90 VAL HA H 90 4.138 4.138 3.973 0.165 26021 10366 1 16 . 1 1 90 90 VAL C C 90 176.018 176.018 176.074 -0.056 26021 10367 1 16 . 1 1 90 90 VAL CA C 90 62.425 62.425 62.557 -0.132 26021 10368 1 16 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.043 0.573 26021 10369 1 16 . 1 1 90 90 VAL H H 90 7.944 7.944 7.771 0.173 26021 10370 1 16 . 1 1 91 91 GLU N N 91 124.313 124.313 126.825 -2.512 26021 10371 1 16 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.272 0.334 26021 10372 1 16 . 1 1 91 91 GLU CA C 91 54.176 54.176 55.197 -1.020 26021 10373 1 16 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.910 0.850 26021 10374 1 16 . 1 1 91 91 GLU H H 91 8.423 8.423 8.374 0.049 26021 10375 1 16 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.454 -0.117 26021 10376 1 16 . 1 1 92 92 PRO C C 92 176.504 176.504 175.664 0.840 26021 10377 1 16 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.291 0.081 26021 10378 1 16 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.425 -0.258 26021 10379 1 16 . 1 1 93 93 ASP N N 93 120.275 120.275 120.124 0.151 26021 10380 1 16 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.776 -0.204 26021 10381 1 16 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.666 0.304 26021 10382 1 16 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.514 -1.999 26021 10383 1 16 . 1 1 93 93 ASP H H 93 8.286 8.286 8.341 -0.055 26021 10384 1 16 . 1 1 94 94 ASP N N 94 121.181 121.181 124.601 -3.420 26021 10385 1 16 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.650 -0.085 26021 10386 1 16 . 1 1 94 94 ASP C C 94 176.474 176.474 176.667 -0.193 26021 10387 1 16 . 1 1 94 94 ASP CA C 94 54.373 54.373 54.993 -0.620 26021 10388 1 16 . 1 1 94 94 ASP CB C 94 41.225 41.225 42.042 -0.817 26021 10389 1 16 . 1 1 94 94 ASP H H 94 8.259 8.259 8.676 -0.417 26021 10390 1 16 . 1 1 95 95 ASN N N 95 118.728 118.728 118.781 -0.053 26021 10391 1 16 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.525 0.169 26021 10392 1 16 . 1 1 95 95 ASN C C 95 176.272 176.272 177.825 -1.553 26021 10393 1 16 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.545 -1.559 26021 10394 1 16 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.295 0.434 26021 10395 1 16 . 1 1 95 95 ASN H H 95 8.474 8.474 8.493 -0.019 26021 10396 1 16 . 1 1 96 96 THR N N 96 113.868 113.868 114.748 -0.880 26021 10397 1 16 . 1 1 96 96 THR HA H 96 4.220 4.220 4.070 0.150 26021 10398 1 16 . 1 1 96 96 THR C C 96 175.107 175.107 176.239 -1.132 26021 10399 1 16 . 1 1 96 96 THR CA C 96 63.200 63.200 64.689 -1.489 26021 10400 1 16 . 1 1 96 96 THR CB C 96 69.475 69.475 68.879 0.596 26021 10401 1 16 . 1 1 96 96 THR H H 96 8.263 8.263 7.997 0.266 26021 10402 1 16 . 1 1 97 97 ASN N N 97 119.954 119.954 118.763 1.191 26021 10403 1 16 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.481 0.135 26021 10404 1 16 . 1 1 97 97 ASN C C 97 176.275 176.275 176.386 -0.111 26021 10405 1 16 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.432 -0.476 26021 10406 1 16 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.720 -0.028 26021 10407 1 16 . 1 1 97 97 ASN H H 97 8.431 8.431 7.576 0.855 26021 10408 1 16 . 1 1 98 98 GLY N N 98 108.847 108.847 107.182 1.665 26021 10409 1 16 . 1 1 98 98 GLY C C 98 175.533 175.533 175.212 0.321 26021 10410 1 16 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.072 -0.061 26021 10411 1 16 . 1 1 98 98 GLY H H 98 8.338 8.338 8.106 0.232 26021 10412 1 16 . 1 1 99 99 PHE N N 99 118.492 118.492 119.836 -1.344 26021 10413 1 16 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.086 0.162 26021 10414 1 16 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.527 1.432 26021 10415 1 16 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.122 -0.963 26021 10416 1 16 . 1 1 99 99 PHE H H 99 8.370 8.370 8.547 -0.177 26021 10417 1 16 . 1 1 100 100 LYS N N 100 120.987 120.987 119.251 1.736 26021 10418 1 16 . 1 1 100 100 LYS H H 100 8.256 8.256 8.344 -0.088 26021 10419 1 16 . 1 1 101 101 GLY N N 101 108.186 108.186 106.599 1.587 26021 10420 1 16 . 1 1 101 101 GLY C C 101 177.075 177.075 175.907 1.168 26021 10421 1 16 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.282 0.620 26021 10422 1 16 . 1 1 101 101 GLY H H 101 8.300 8.300 7.620 0.680 26021 10423 1 16 . 1 1 102 102 LEU N N 102 121.439 121.439 123.946 -2.507 26021 10424 1 16 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.079 0.018 26021 10425 1 16 . 1 1 102 102 LEU C C 102 179.836 179.836 178.231 1.605 26021 10426 1 16 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.507 -0.149 26021 10427 1 16 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.996 -0.226 26021 10428 1 16 . 1 1 102 102 LEU H H 102 7.777 7.777 7.866 -0.089 26021 10429 1 16 . 1 1 103 103 MET N N 103 122.290 122.290 118.213 4.077 26021 10430 1 16 . 1 1 103 103 MET HA H 103 4.220 4.220 4.045 0.175 26021 10431 1 16 . 1 1 103 103 MET C C 103 177.739 177.739 177.845 -0.106 26021 10432 1 16 . 1 1 103 103 MET CA C 103 58.739 58.739 58.659 0.080 26021 10433 1 16 . 1 1 103 103 MET CB C 103 31.895 31.895 31.792 0.103 26021 10434 1 16 . 1 1 103 103 MET H H 103 8.409 8.409 8.240 0.169 26021 10435 1 16 . 1 1 104 104 LYS N N 104 119.750 119.750 118.234 1.516 26021 10436 1 16 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.010 0.057 26021 10437 1 16 . 1 1 104 104 LYS C C 104 179.301 179.301 179.142 0.159 26021 10438 1 16 . 1 1 104 104 LYS CA C 104 59.764 59.764 59.540 0.224 26021 10439 1 16 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.724 0.323 26021 10440 1 16 . 1 1 104 104 LYS H H 104 7.916 7.916 7.440 0.476 26021 10441 1 16 . 1 1 105 105 ARG N N 105 117.967 117.967 119.739 -1.772 26021 10442 1 16 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.033 -0.007 26021 10443 1 16 . 1 1 105 105 ARG C C 105 178.777 178.777 178.735 0.042 26021 10444 1 16 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.716 -0.352 26021 10445 1 16 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.372 0.625 26021 10446 1 16 . 1 1 105 105 ARG H H 105 7.719 7.719 8.176 -0.457 26021 10447 1 16 . 1 1 106 106 THR N N 106 117.211 117.211 112.224 4.987 26021 10448 1 16 . 1 1 106 106 THR HA H 106 4.301 4.301 4.342 -0.041 26021 10449 1 16 . 1 1 106 106 THR C C 106 176.254 176.254 176.345 -0.091 26021 10450 1 16 . 1 1 106 106 THR CA C 106 67.860 67.860 65.361 2.499 26021 10451 1 16 . 1 1 106 106 THR CB C 106 67.860 67.860 68.402 -0.542 26021 10452 1 16 . 1 1 106 106 THR H H 106 8.152 8.152 8.028 0.124 26021 10453 1 16 . 1 1 107 107 THR N N 107 117.939 117.939 118.822 -0.883 26021 10454 1 16 . 1 1 107 107 THR HA H 107 3.971 3.971 3.846 0.125 26021 10455 1 16 . 1 1 107 107 THR C C 107 176.780 176.780 176.322 0.458 26021 10456 1 16 . 1 1 107 107 THR CA C 107 66.822 66.822 67.226 -0.404 26021 10457 1 16 . 1 1 107 107 THR CB C 107 68.818 68.818 68.622 0.196 26021 10458 1 16 . 1 1 107 107 THR H H 107 8.651 8.651 8.126 0.525 26021 10459 1 16 . 1 1 108 108 LYS N N 108 120.867 120.867 121.540 -0.673 26021 10460 1 16 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.027 -0.005 26021 10461 1 16 . 1 1 108 108 LYS C C 108 179.045 179.045 178.378 0.667 26021 10462 1 16 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.023 0.811 26021 10463 1 16 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.173 0.299 26021 10464 1 16 . 1 1 108 108 LYS H H 108 7.694 7.694 7.866 -0.172 26021 10465 1 16 . 1 1 109 109 LEU N N 109 119.472 119.472 117.773 1.699 26021 10466 1 16 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.184 0.137 26021 10467 1 16 . 1 1 109 109 LEU C C 109 179.974 179.974 178.676 1.298 26021 10468 1 16 . 1 1 109 109 LEU CA C 109 57.593 57.593 56.824 0.769 26021 10469 1 16 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.364 -0.504 26021 10470 1 16 . 1 1 109 109 LEU H H 109 7.559 7.559 7.634 -0.075 26021 10471 1 16 . 1 1 110 110 LEU N N 110 121.832 121.832 120.238 1.594 26021 10472 1 16 . 1 1 110 110 LEU HA H 110 4.191 4.191 3.972 0.219 26021 10473 1 16 . 1 1 110 110 LEU C C 110 178.101 178.101 178.769 -0.668 26021 10474 1 16 . 1 1 110 110 LEU CA C 110 57.892 57.892 58.150 -0.258 26021 10475 1 16 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.493 0.391 26021 10476 1 16 . 1 1 110 110 LEU H H 110 8.567 8.567 7.734 0.833 26021 10477 1 16 . 1 1 111 111 LYS N N 111 117.972 117.972 117.416 0.556 26021 10478 1 16 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.011 -0.032 26021 10479 1 16 . 1 1 111 111 LYS C C 111 177.677 177.677 178.480 -0.803 26021 10480 1 16 . 1 1 111 111 LYS CA C 111 58.785 58.785 59.065 -0.280 26021 10481 1 16 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.497 0.712 26021 10482 1 16 . 1 1 111 111 LYS H H 111 7.965 7.965 8.499 -0.534 26021 10483 1 16 . 1 1 112 112 LYS N N 112 115.433 115.433 118.930 -3.497 26021 10484 1 16 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.039 0.071 26021 10485 1 16 . 1 1 112 112 LYS C C 112 178.270 178.270 177.670 0.600 26021 10486 1 16 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.330 0.621 26021 10487 1 16 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.242 0.549 26021 10488 1 16 . 1 1 112 112 LYS H H 112 7.334 7.334 7.465 -0.131 26021 10489 1 16 . 1 1 113 113 VAL N N 113 114.861 114.861 119.781 -4.920 26021 10490 1 16 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.892 -0.061 26021 10491 1 16 . 1 1 113 113 VAL C C 113 176.999 176.999 177.145 -0.146 26021 10492 1 16 . 1 1 113 113 VAL CA C 113 63.505 63.505 66.497 -2.992 26021 10493 1 16 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.361 -0.074 26021 10494 1 16 . 1 1 113 113 VAL H H 113 7.298 7.298 7.579 -0.281 26021 10495 1 16 . 1 1 114 114 VAL N N 114 121.457 121.457 119.812 1.645 26021 10496 1 16 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.711 0.011 26021 10497 1 16 . 1 1 114 114 VAL C C 114 177.737 177.737 177.489 0.248 26021 10498 1 16 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.581 -1.357 26021 10499 1 16 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.930 -0.177 26021 10500 1 16 . 1 1 114 114 VAL H H 114 7.855 7.855 8.309 -0.454 26021 10501 1 16 . 1 1 115 115 ASP N N 115 120.804 120.804 118.591 2.213 26021 10502 1 16 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.452 0.003 26021 10503 1 16 . 1 1 115 115 ASP C C 115 177.380 177.380 177.123 0.257 26021 10504 1 16 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.162 -0.241 26021 10505 1 16 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.897 -0.525 26021 10506 1 16 . 1 1 115 115 ASP H H 115 8.311 8.311 7.881 0.430 26021 10507 1 16 . 1 1 116 116 LYS N N 116 119.582 119.582 117.970 1.612 26021 10508 1 16 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.123 -0.028 26021 10509 1 16 . 1 1 116 116 LYS C C 116 177.077 177.077 177.802 -0.725 26021 10510 1 16 . 1 1 116 116 LYS CA C 116 57.711 57.711 58.308 -0.597 26021 10511 1 16 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.794 -0.306 26021 10512 1 16 . 1 1 116 116 LYS H H 116 7.639 7.639 7.779 -0.140 26021 10513 1 16 . 1 1 117 117 HIS N N 117 115.246 115.246 112.268 2.978 26021 10514 1 16 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.814 -0.189 26021 10515 1 16 . 1 1 117 117 HIS C C 117 175.497 175.497 175.862 -0.365 26021 10516 1 16 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.517 -0.342 26021 10517 1 16 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.367 -1.892 26021 10518 1 16 . 1 1 117 117 HIS H H 117 8.108 8.108 8.051 0.057 26021 10519 1 16 . 1 1 118 118 GLY N N 118 109.944 109.944 107.632 2.312 26021 10520 1 16 . 1 1 118 118 GLY C C 118 174.093 174.093 174.463 -0.370 26021 10521 1 16 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.974 1.089 26021 10522 1 16 . 1 1 118 118 GLY H H 118 8.153 8.153 7.670 0.483 26021 10523 1 16 . 1 1 119 119 ILE N N 119 118.468 118.468 123.126 -4.658 26021 10524 1 16 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.958 0.164 26021 10525 1 16 . 1 1 119 119 ILE C C 119 174.777 174.777 175.607 -0.830 26021 10526 1 16 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.900 -0.799 26021 10527 1 16 . 1 1 119 119 ILE CB C 119 38.631 38.631 37.350 1.281 26021 10528 1 16 . 1 1 119 119 ILE H H 119 7.828 7.828 8.118 -0.290 26021 10529 1 17 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.569 0.180 26021 10530 1 17 . 1 1 4 4 ASN C C 4 175.260 175.260 175.615 -0.355 26021 10531 1 17 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.565 -0.734 26021 10532 1 17 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.244 0.437 26021 10533 1 17 . 1 1 5 5 ALA N N 5 123.648 123.648 121.883 1.765 26021 10534 1 17 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.569 -0.279 26021 10535 1 17 . 1 1 5 5 ALA C C 5 178.256 178.256 178.402 -0.146 26021 10536 1 17 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.427 1.654 26021 10537 1 17 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.047 -0.022 26021 10538 1 17 . 1 1 5 5 ALA H H 5 8.520 8.520 8.015 0.505 26021 10539 1 17 . 1 1 6 6 GLY N N 6 107.044 107.044 107.472 -0.428 26021 10540 1 17 . 1 1 6 6 GLY C C 6 174.961 174.961 175.183 -0.222 26021 10541 1 17 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.797 -0.967 26021 10542 1 17 . 1 1 6 6 GLY H H 6 8.350 8.350 7.863 0.487 26021 10543 1 17 . 1 1 7 7 ALA N N 7 123.366 123.366 124.058 -0.692 26021 10544 1 17 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.107 0.109 26021 10545 1 17 . 1 1 7 7 ALA C C 7 179.006 179.006 178.792 0.214 26021 10546 1 17 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.584 -0.881 26021 10547 1 17 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.363 0.481 26021 10548 1 17 . 1 1 7 7 ALA H H 7 8.078 8.078 7.967 0.111 26021 10549 1 17 . 1 1 8 8 ILE N N 8 117.376 117.376 118.446 -1.070 26021 10550 1 17 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.724 0.056 26021 10551 1 17 . 1 1 8 8 ILE C C 8 177.032 177.032 178.249 -1.217 26021 10552 1 17 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.027 -0.869 26021 10553 1 17 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.000 -1.711 26021 10554 1 17 . 1 1 8 8 ILE H H 8 7.943 7.943 7.335 0.608 26021 10555 1 17 . 1 1 9 9 ALA N N 9 121.414 121.414 122.648 -1.234 26021 10556 1 17 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.012 -0.079 26021 10557 1 17 . 1 1 9 9 ALA C C 9 180.515 180.515 179.097 1.418 26021 10558 1 17 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.794 0.304 26021 10559 1 17 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.059 0.102 26021 10560 1 17 . 1 1 9 9 ALA H H 9 8.062 8.062 7.875 0.187 26021 10561 1 17 . 1 1 10 10 LYS N N 10 114.594 114.594 118.868 -4.274 26021 10562 1 17 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.107 0.057 26021 10563 1 17 . 1 1 10 10 LYS C C 10 178.099 178.099 178.082 0.017 26021 10564 1 17 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.364 -0.523 26021 10565 1 17 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.318 0.151 26021 10566 1 17 . 1 1 10 10 LYS H H 10 7.554 7.554 7.833 -0.279 26021 10567 1 17 . 1 1 11 11 LEU N N 11 119.662 119.662 118.452 1.210 26021 10568 1 17 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.111 -0.033 26021 10569 1 17 . 1 1 11 11 LEU C C 11 177.930 177.930 177.854 0.076 26021 10570 1 17 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.146 0.410 26021 10571 1 17 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.793 1.295 26021 10572 1 17 . 1 1 11 11 LEU H H 11 7.814 7.814 7.378 0.436 26021 10573 1 17 . 1 1 12 12 ILE N N 12 117.945 117.945 120.578 -2.633 26021 10574 1 17 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.885 -0.193 26021 10575 1 17 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.115 1.514 26021 10576 1 17 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.706 1.704 26021 10577 1 17 . 1 1 12 12 ILE H H 12 7.426 7.426 7.511 -0.085 26021 10578 1 17 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.301 0.102 26021 10579 1 17 . 1 1 13 13 PRO C C 13 179.030 179.030 178.772 0.258 26021 10580 1 17 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.189 0.055 26021 10581 1 17 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.012 -0.202 26021 10582 1 17 . 1 1 14 14 LYS N N 14 117.855 117.855 118.745 -0.890 26021 10583 1 17 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.057 0.088 26021 10584 1 17 . 1 1 14 14 LYS C C 14 178.565 178.565 178.494 0.071 26021 10585 1 17 . 1 1 14 14 LYS CA C 14 59.433 59.433 58.868 0.565 26021 10586 1 17 . 1 1 14 14 LYS CB C 14 32.925 32.925 31.823 1.103 26021 10587 1 17 . 1 1 14 14 LYS H H 14 6.685 6.685 7.422 -0.737 26021 10588 1 17 . 1 1 15 15 LEU N N 15 118.008 118.008 116.863 1.145 26021 10589 1 17 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.384 -0.381 26021 10590 1 17 . 1 1 15 15 LEU C C 15 178.662 178.662 178.896 -0.234 26021 10591 1 17 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.578 1.134 26021 10592 1 17 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.319 -0.320 26021 10593 1 17 . 1 1 15 15 LEU H H 15 8.148 8.148 7.594 0.554 26021 10594 1 17 . 1 1 16 16 GLY N N 16 103.895 103.895 108.450 -4.555 26021 10595 1 17 . 1 1 16 16 GLY C C 16 176.838 176.838 175.483 1.355 26021 10596 1 17 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.094 0.271 26021 10597 1 17 . 1 1 16 16 GLY H H 16 8.104 8.104 7.796 0.308 26021 10598 1 17 . 1 1 17 17 GLU N N 17 121.655 121.655 121.442 0.213 26021 10599 1 17 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.071 0.062 26021 10600 1 17 . 1 1 17 17 GLU C C 17 179.007 179.007 178.423 0.584 26021 10601 1 17 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.187 -0.376 26021 10602 1 17 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.716 -0.583 26021 10603 1 17 . 1 1 17 17 GLU H H 17 7.817 7.817 7.598 0.219 26021 10604 1 17 . 1 1 18 18 LEU N N 18 117.834 117.834 116.432 1.402 26021 10605 1 17 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.432 -0.314 26021 10606 1 17 . 1 1 18 18 LEU C C 18 177.658 177.658 177.688 -0.030 26021 10607 1 17 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.413 1.616 26021 10608 1 17 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.645 0.025 26021 10609 1 17 . 1 1 18 18 LEU H H 18 7.389 7.389 7.892 -0.503 26021 10610 1 17 . 1 1 19 19 LEU N N 19 113.694 113.694 117.356 -3.662 26021 10611 1 17 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.386 -0.224 26021 10612 1 17 . 1 1 19 19 LEU C C 19 178.123 178.123 178.451 -0.328 26021 10613 1 17 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.501 0.351 26021 10614 1 17 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.055 0.165 26021 10615 1 17 . 1 1 19 19 LEU H H 19 7.269 7.269 7.720 -0.451 26021 10616 1 17 . 1 1 20 20 VAL N N 20 112.778 112.778 112.851 -0.073 26021 10617 1 17 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.140 0.303 26021 10618 1 17 . 1 1 20 20 VAL C C 20 177.021 177.021 176.867 0.154 26021 10619 1 17 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.553 -1.698 26021 10620 1 17 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.491 0.287 26021 10621 1 17 . 1 1 20 20 VAL H H 20 7.356 7.356 7.825 -0.469 26021 10622 1 17 . 1 1 21 21 GLY N N 21 108.962 108.962 107.110 1.852 26021 10623 1 17 . 1 1 21 21 GLY C C 21 173.813 173.813 174.477 -0.664 26021 10624 1 17 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.706 0.341 26021 10625 1 17 . 1 1 21 21 GLY H H 21 7.925 7.925 8.250 -0.325 26021 10626 1 17 . 1 1 22 22 GLU N N 22 120.607 120.607 122.495 -1.888 26021 10627 1 17 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.641 -0.363 26021 10628 1 17 . 1 1 22 22 GLU C C 22 175.869 175.869 175.701 0.168 26021 10629 1 17 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.371 0.659 26021 10630 1 17 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.825 -0.144 26021 10631 1 17 . 1 1 22 22 GLU H H 22 8.300 8.300 8.206 0.094 26021 10632 1 17 . 1 1 23 23 TYR N N 23 120.738 120.738 118.598 2.140 26021 10633 1 17 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.031 -0.474 26021 10634 1 17 . 1 1 23 23 TYR C C 23 175.264 175.264 174.328 0.936 26021 10635 1 17 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.231 0.330 26021 10636 1 17 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.274 -0.028 26021 10637 1 17 . 1 1 23 23 TYR H H 23 7.756 7.756 7.480 0.276 26021 10638 1 17 . 1 1 24 24 LYS N N 24 122.095 122.095 121.637 0.458 26021 10639 1 17 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.531 -0.348 26021 10640 1 17 . 1 1 24 24 LYS C C 24 175.742 175.742 174.469 1.273 26021 10641 1 17 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.911 0.207 26021 10642 1 17 . 1 1 24 24 LYS CB C 24 30.719 30.719 31.003 -0.284 26021 10643 1 17 . 1 1 24 24 LYS H H 24 8.692 8.692 8.487 0.205 26021 10644 1 17 . 1 1 25 25 LEU N N 25 121.123 121.123 119.333 1.790 26021 10645 1 17 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.633 -0.141 26021 10646 1 17 . 1 1 25 25 LEU C C 25 177.487 177.487 176.443 1.044 26021 10647 1 17 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.914 0.420 26021 10648 1 17 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.205 -0.447 26021 10649 1 17 . 1 1 25 25 LEU H H 25 8.088 8.088 7.613 0.475 26021 10650 1 17 . 1 1 26 26 HIS N N 26 122.993 122.993 118.440 4.553 26021 10651 1 17 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.781 -0.280 26021 10652 1 17 . 1 1 26 26 HIS C C 26 176.716 176.716 176.102 0.614 26021 10653 1 17 . 1 1 26 26 HIS CA C 26 57.197 57.197 54.600 2.597 26021 10654 1 17 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.730 0.627 26021 10655 1 17 . 1 1 26 26 HIS H H 26 8.882 8.882 8.469 0.413 26021 10656 1 17 . 1 1 27 27 LYS N N 27 124.894 124.894 120.108 4.786 26021 10657 1 17 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.285 -0.337 26021 10658 1 17 . 1 1 27 27 LYS C C 27 178.873 178.873 178.277 0.596 26021 10659 1 17 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.237 1.774 26021 10660 1 17 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.444 -0.002 26021 10661 1 17 . 1 1 27 27 LYS H H 27 8.699 8.699 8.477 0.222 26021 10662 1 17 . 1 1 28 28 GLY N N 28 111.258 111.258 105.020 6.238 26021 10663 1 17 . 1 1 28 28 GLY C C 28 176.131 176.131 175.345 0.786 26021 10664 1 17 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.095 0.395 26021 10665 1 17 . 1 1 28 28 GLY H H 28 9.814 9.814 8.508 1.306 26021 10666 1 17 . 1 1 29 29 VAL N N 29 122.719 122.719 120.678 2.041 26021 10667 1 17 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.879 0.013 26021 10668 1 17 . 1 1 29 29 VAL C C 29 177.628 177.628 177.735 -0.107 26021 10669 1 17 . 1 1 29 29 VAL CA C 29 65.520 65.520 64.929 0.591 26021 10670 1 17 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.778 -0.036 26021 10671 1 17 . 1 1 29 29 VAL H H 29 7.431 7.431 7.387 0.044 26021 10672 1 17 . 1 1 30 30 LYS N N 30 119.791 119.791 119.391 0.400 26021 10673 1 17 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.844 -0.209 26021 10674 1 17 . 1 1 30 30 LYS C C 30 177.666 177.666 177.576 0.090 26021 10675 1 17 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.374 1.650 26021 10676 1 17 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.624 0.781 26021 10677 1 17 . 1 1 30 30 LYS H H 30 8.255 8.255 7.550 0.705 26021 10678 1 17 . 1 1 31 31 LYS N N 31 117.918 117.918 118.504 -0.586 26021 10679 1 17 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.059 0.057 26021 10680 1 17 . 1 1 31 31 LYS C C 31 177.784 177.784 178.434 -0.650 26021 10681 1 17 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.018 -0.315 26021 10682 1 17 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.708 0.137 26021 10683 1 17 . 1 1 31 31 LYS H H 31 7.689 7.689 7.879 -0.190 26021 10684 1 17 . 1 1 32 32 ASN N N 32 116.347 116.347 116.859 -0.512 26021 10685 1 17 . 1 1 32 32 ASN HA H 32 4.520 4.520 3.978 0.542 26021 10686 1 17 . 1 1 32 32 ASN C C 32 177.764 177.764 176.945 0.819 26021 10687 1 17 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.650 0.665 26021 10688 1 17 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.474 0.158 26021 10689 1 17 . 1 1 32 32 ASN H H 32 7.556 7.556 7.376 0.180 26021 10690 1 17 . 1 1 33 33 ILE N N 33 120.592 120.592 119.876 0.716 26021 10691 1 17 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.708 -0.426 26021 10692 1 17 . 1 1 33 33 ILE C C 33 177.074 177.074 177.473 -0.399 26021 10693 1 17 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.274 2.614 26021 10694 1 17 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.025 0.153 26021 10695 1 17 . 1 1 33 33 ILE H H 33 8.236 8.236 7.570 0.666 26021 10696 1 17 . 1 1 34 34 GLU N N 34 120.595 120.595 119.517 1.078 26021 10697 1 17 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.877 -0.089 26021 10698 1 17 . 1 1 34 34 GLU C C 34 179.739 179.739 178.921 0.818 26021 10699 1 17 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.586 0.653 26021 10700 1 17 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.945 0.900 26021 10701 1 17 . 1 1 34 34 GLU H H 34 8.551 8.551 8.443 0.108 26021 10702 1 17 . 1 1 35 35 ASP N N 35 120.600 120.600 121.053 -0.453 26021 10703 1 17 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.516 -0.104 26021 10704 1 17 . 1 1 35 35 ASP C C 35 178.681 178.681 178.197 0.484 26021 10705 1 17 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.457 1.005 26021 10706 1 17 . 1 1 35 35 ASP CB C 35 39.750 39.750 41.227 -1.477 26021 10707 1 17 . 1 1 35 35 ASP H H 35 8.670 8.670 7.513 1.157 26021 10708 1 17 . 1 1 36 36 LEU N N 36 123.004 123.004 121.376 1.628 26021 10709 1 17 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.475 -0.380 26021 10710 1 17 . 1 1 36 36 LEU C C 36 178.035 178.035 179.255 -1.220 26021 10711 1 17 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.411 0.617 26021 10712 1 17 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.036 -0.160 26021 10713 1 17 . 1 1 36 36 LEU H H 36 8.166 8.166 7.652 0.514 26021 10714 1 17 . 1 1 37 37 LEU N N 37 120.178 120.178 119.228 0.950 26021 10715 1 17 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.046 -0.190 26021 10716 1 17 . 1 1 37 37 LEU C C 37 178.128 178.128 178.005 0.123 26021 10717 1 17 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.160 0.515 26021 10718 1 17 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.488 0.667 26021 10719 1 17 . 1 1 37 37 LEU H H 37 8.736 8.736 8.155 0.581 26021 10720 1 17 . 1 1 38 38 LYS N N 38 118.110 118.110 119.288 -1.178 26021 10721 1 17 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.939 -0.006 26021 10722 1 17 . 1 1 38 38 LYS C C 38 179.533 179.533 178.937 0.596 26021 10723 1 17 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.668 0.605 26021 10724 1 17 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.091 0.186 26021 10725 1 17 . 1 1 38 38 LYS H H 38 7.770 7.770 7.433 0.337 26021 10726 1 17 . 1 1 39 39 GLU N N 39 119.265 119.265 118.979 0.286 26021 10727 1 17 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.098 0.204 26021 10728 1 17 . 1 1 39 39 GLU C C 39 179.720 179.720 179.331 0.389 26021 10729 1 17 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.430 -0.672 26021 10730 1 17 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.540 0.050 26021 10731 1 17 . 1 1 39 39 GLU H H 39 7.709 7.709 7.798 -0.089 26021 10732 1 17 . 1 1 40 40 LEU N N 40 119.007 119.007 120.232 -1.225 26021 10733 1 17 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.157 -0.107 26021 10734 1 17 . 1 1 40 40 LEU C C 40 179.690 179.690 178.534 1.156 26021 10735 1 17 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.855 -0.204 26021 10736 1 17 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.698 -0.013 26021 10737 1 17 . 1 1 40 40 LEU H H 40 8.851 8.851 7.772 1.079 26021 10738 1 17 . 1 1 41 41 LYS N N 41 120.500 120.500 118.266 2.234 26021 10739 1 17 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.059 -0.107 26021 10740 1 17 . 1 1 41 41 LYS C C 41 180.223 180.223 178.710 1.513 26021 10741 1 17 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.591 1.300 26021 10742 1 17 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.117 -0.050 26021 10743 1 17 . 1 1 41 41 LYS H H 41 8.482 8.482 8.168 0.314 26021 10744 1 17 . 1 1 42 42 THR N N 42 119.555 119.555 112.517 7.038 26021 10745 1 17 . 1 1 42 42 THR HA H 42 4.000 4.000 4.227 -0.227 26021 10746 1 17 . 1 1 42 42 THR C C 42 176.633 176.633 176.263 0.370 26021 10747 1 17 . 1 1 42 42 THR CA C 42 66.574 66.574 64.790 1.784 26021 10748 1 17 . 1 1 42 42 THR CB C 42 67.924 67.924 68.591 -0.667 26021 10749 1 17 . 1 1 42 42 THR H H 42 7.863 7.863 7.297 0.566 26021 10750 1 17 . 1 1 43 43 MET N N 43 122.839 122.839 121.956 0.883 26021 10751 1 17 . 1 1 43 43 MET HA H 43 4.022 4.022 3.979 0.043 26021 10752 1 17 . 1 1 43 43 MET C C 43 177.290 177.290 177.983 -0.693 26021 10753 1 17 . 1 1 43 43 MET CA C 43 59.731 59.731 60.587 -0.856 26021 10754 1 17 . 1 1 43 43 MET CB C 43 33.610 33.610 32.418 1.192 26021 10755 1 17 . 1 1 43 43 MET H H 43 8.714 8.714 7.607 1.107 26021 10756 1 17 . 1 1 44 44 ASN N N 44 118.049 118.049 117.017 1.032 26021 10757 1 17 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.277 0.097 26021 10758 1 17 . 1 1 44 44 ASN C C 44 176.297 176.297 177.179 -0.882 26021 10759 1 17 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.274 0.620 26021 10760 1 17 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.905 0.501 26021 10761 1 17 . 1 1 44 44 ASN H H 44 8.988 8.988 8.368 0.620 26021 10762 1 17 . 1 1 45 45 ALA N N 45 119.260 119.260 121.849 -2.589 26021 10763 1 17 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.175 -0.109 26021 10764 1 17 . 1 1 45 45 ALA C C 45 180.476 180.476 179.169 1.307 26021 10765 1 17 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.357 0.911 26021 10766 1 17 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.299 -0.611 26021 10767 1 17 . 1 1 45 45 ALA H H 45 7.675 7.675 7.403 0.272 26021 10768 1 17 . 1 1 46 46 ALA N N 46 121.126 121.126 123.240 -2.114 26021 10769 1 17 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.123 -0.007 26021 10770 1 17 . 1 1 46 46 ALA C C 46 179.314 179.314 179.097 0.217 26021 10771 1 17 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.319 -0.333 26021 10772 1 17 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.719 -0.497 26021 10773 1 17 . 1 1 46 46 ALA H H 46 7.872 7.872 8.041 -0.169 26021 10774 1 17 . 1 1 47 47 LEU N N 47 119.328 119.328 115.793 3.535 26021 10775 1 17 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.990 0.201 26021 10776 1 17 . 1 1 47 47 LEU C C 47 180.403 180.403 178.256 2.147 26021 10777 1 17 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.058 -0.012 26021 10778 1 17 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.461 0.489 26021 10779 1 17 . 1 1 47 47 LEU H H 47 8.529 8.529 7.544 0.985 26021 10780 1 17 . 1 1 48 48 ILE N N 48 121.653 121.653 118.343 3.310 26021 10781 1 17 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.712 -0.010 26021 10782 1 17 . 1 1 48 48 ILE C C 48 178.730 178.730 177.891 0.839 26021 10783 1 17 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.457 0.453 26021 10784 1 17 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.683 0.229 26021 10785 1 17 . 1 1 48 48 ILE H H 48 8.386 8.386 7.154 1.232 26021 10786 1 17 . 1 1 49 49 LYS N N 49 119.896 119.896 118.684 1.212 26021 10787 1 17 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.171 -0.128 26021 10788 1 17 . 1 1 49 49 LYS C C 49 179.999 179.999 179.488 0.511 26021 10789 1 17 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.035 0.022 26021 10790 1 17 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.835 -0.874 26021 10791 1 17 . 1 1 49 49 LYS H H 49 7.456 7.456 7.507 -0.051 26021 10792 1 17 . 1 1 50 50 ILE N N 50 119.964 119.964 116.245 3.719 26021 10793 1 17 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.105 -0.369 26021 10794 1 17 . 1 1 50 50 ILE C C 50 177.960 177.960 177.874 0.086 26021 10795 1 17 . 1 1 50 50 ILE CA C 50 64.349 64.349 64.079 0.270 26021 10796 1 17 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.602 0.530 26021 10797 1 17 . 1 1 50 50 ILE H H 50 8.154 8.154 8.766 -0.612 26021 10798 1 17 . 1 1 51 51 GLY N N 51 106.709 106.709 107.886 -1.177 26021 10799 1 17 . 1 1 51 51 GLY C C 51 174.461 174.461 175.266 -0.805 26021 10800 1 17 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.438 -0.528 26021 10801 1 17 . 1 1 51 51 GLY H H 51 7.932 7.932 7.907 0.025 26021 10802 1 17 . 1 1 52 52 GLU N N 52 118.736 118.736 119.408 -0.672 26021 10803 1 17 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.209 0.111 26021 10804 1 17 . 1 1 52 52 GLU C C 52 176.789 176.789 177.012 -0.223 26021 10805 1 17 . 1 1 52 52 GLU CA C 52 56.274 56.274 57.494 -1.220 26021 10806 1 17 . 1 1 52 52 GLU CB C 52 30.112 30.112 29.980 0.132 26021 10807 1 17 . 1 1 52 52 GLU H H 52 7.597 7.597 7.528 0.069 26021 10808 1 17 . 1 1 53 53 VAL N N 53 122.982 122.982 118.050 4.932 26021 10809 1 17 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.486 -0.225 26021 10810 1 17 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.154 1.231 26021 10811 1 17 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.464 1.358 26021 10812 1 17 . 1 1 53 53 VAL H H 53 7.511 7.511 7.605 -0.094 26021 10813 1 17 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.807 -0.162 26021 10814 1 17 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.593 -0.015 26021 10815 1 17 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.025 0.510 26021 10816 1 17 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.323 -0.132 26021 10817 1 17 . 1 1 55 55 PRO C C 55 178.258 178.258 177.784 0.474 26021 10818 1 17 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.846 0.582 26021 10819 1 17 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.788 0.058 26021 10820 1 17 . 1 1 56 56 ASP N N 56 114.117 114.117 118.819 -4.702 26021 10821 1 17 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.459 0.032 26021 10822 1 17 . 1 1 56 56 ASP C C 56 176.696 176.696 176.793 -0.097 26021 10823 1 17 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.831 -0.693 26021 10824 1 17 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.740 -1.014 26021 10825 1 17 . 1 1 56 56 ASP H H 56 8.489 8.489 8.440 0.049 26021 10826 1 17 . 1 1 57 57 GLN N N 57 117.641 117.641 117.257 0.384 26021 10827 1 17 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.377 -0.003 26021 10828 1 17 . 1 1 57 57 GLN C C 57 175.765 175.765 175.574 0.191 26021 10829 1 17 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.509 -0.219 26021 10830 1 17 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.354 0.292 26021 10831 1 17 . 1 1 57 57 GLN H H 57 8.206 8.206 7.633 0.573 26021 10832 1 17 . 1 1 58 58 LEU N N 58 122.141 122.141 120.826 1.315 26021 10833 1 17 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.431 0.019 26021 10834 1 17 . 1 1 58 58 LEU C C 58 176.849 176.849 175.899 0.950 26021 10835 1 17 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.065 0.930 26021 10836 1 17 . 1 1 58 58 LEU CB C 58 43.231 43.231 43.291 -0.060 26021 10837 1 17 . 1 1 58 58 LEU H H 58 7.152 7.152 7.267 -0.115 26021 10838 1 17 . 1 1 59 59 ASP N N 59 125.643 125.643 121.753 3.890 26021 10839 1 17 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.805 -0.086 26021 10840 1 17 . 1 1 59 59 ASP C C 59 177.249 177.249 176.941 0.308 26021 10841 1 17 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.433 0.970 26021 10842 1 17 . 1 1 59 59 ASP CB C 59 42.232 42.232 42.110 0.122 26021 10843 1 17 . 1 1 59 59 ASP H H 59 9.312 9.312 8.348 0.964 26021 10844 1 17 . 1 1 60 60 SER N N 60 116.550 116.550 114.444 2.106 26021 10845 1 17 . 1 1 60 60 SER HA H 60 4.124 4.124 4.168 -0.044 26021 10846 1 17 . 1 1 60 60 SER C C 60 176.840 176.840 175.833 1.007 26021 10847 1 17 . 1 1 60 60 SER CA C 60 61.722 61.722 61.632 0.090 26021 10848 1 17 . 1 1 60 60 SER CB C 60 62.815 62.815 62.702 0.113 26021 10849 1 17 . 1 1 60 60 SER H H 60 8.647 8.647 8.614 0.033 26021 10850 1 17 . 1 1 61 61 GLN N N 61 121.394 121.394 120.757 0.637 26021 10851 1 17 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.091 0.040 26021 10852 1 17 . 1 1 61 61 GLN C C 61 178.629 178.629 177.700 0.929 26021 10853 1 17 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.364 0.390 26021 10854 1 17 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.407 -0.154 26021 10855 1 17 . 1 1 61 61 GLN H H 61 8.453 8.453 7.989 0.464 26021 10856 1 17 . 1 1 62 62 ASP N N 62 122.187 122.187 119.733 2.454 26021 10857 1 17 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.571 0.048 26021 10858 1 17 . 1 1 62 62 ASP C C 62 178.318 178.318 178.239 0.079 26021 10859 1 17 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.930 -0.468 26021 10860 1 17 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.897 0.139 26021 10861 1 17 . 1 1 62 62 ASP H H 62 8.311 8.311 8.275 0.036 26021 10862 1 17 . 1 1 63 63 LYS N N 63 120.325 120.325 118.524 1.801 26021 10863 1 17 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.159 -0.150 26021 10864 1 17 . 1 1 63 63 LYS C C 63 178.765 178.765 179.294 -0.529 26021 10865 1 17 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.477 1.276 26021 10866 1 17 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.101 0.352 26021 10867 1 17 . 1 1 63 63 LYS H H 63 7.923 7.923 7.645 0.278 26021 10868 1 17 . 1 1 64 64 LEU N N 64 119.491 119.491 119.776 -0.285 26021 10869 1 17 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.248 -0.022 26021 10870 1 17 . 1 1 64 64 LEU C C 64 179.526 179.526 178.643 0.883 26021 10871 1 17 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.403 0.395 26021 10872 1 17 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.435 0.340 26021 10873 1 17 . 1 1 64 64 LEU H H 64 7.820 7.820 7.442 0.378 26021 10874 1 17 . 1 1 65 65 TRP N N 65 120.674 120.674 122.526 -1.852 26021 10875 1 17 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.256 0.052 26021 10876 1 17 . 1 1 65 65 TRP C C 65 177.379 177.379 177.789 -0.410 26021 10877 1 17 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.180 1.622 26021 10878 1 17 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.539 -0.128 26021 10879 1 17 . 1 1 65 65 TRP H H 65 8.196 8.196 8.365 -0.169 26021 10880 1 17 . 1 1 66 66 ALA N N 66 120.606 120.606 119.680 0.926 26021 10881 1 17 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.680 0.029 26021 10882 1 17 . 1 1 66 66 ALA C C 66 180.376 180.376 179.088 1.288 26021 10883 1 17 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.558 1.006 26021 10884 1 17 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.973 -0.319 26021 10885 1 17 . 1 1 66 66 ALA H H 66 8.305 8.305 7.553 0.752 26021 10886 1 17 . 1 1 67 67 ASP N N 67 119.175 119.175 119.384 -0.209 26021 10887 1 17 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.294 0.156 26021 10888 1 17 . 1 1 67 67 ASP C C 67 178.757 178.757 178.295 0.462 26021 10889 1 17 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.234 0.258 26021 10890 1 17 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.713 -0.559 26021 10891 1 17 . 1 1 67 67 ASP H H 67 7.945 7.945 7.633 0.312 26021 10892 1 17 . 1 1 68 68 GLU N N 68 122.322 122.322 118.739 3.583 26021 10893 1 17 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.396 -0.381 26021 10894 1 17 . 1 1 68 68 GLU C C 68 180.055 180.055 179.378 0.677 26021 10895 1 17 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.465 0.645 26021 10896 1 17 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.449 0.198 26021 10897 1 17 . 1 1 68 68 GLU H H 68 8.168 8.168 8.011 0.157 26021 10898 1 17 . 1 1 69 69 VAL N N 69 122.135 122.135 117.337 4.798 26021 10899 1 17 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.780 -0.528 26021 10900 1 17 . 1 1 69 69 VAL C C 69 177.736 177.736 177.890 -0.154 26021 10901 1 17 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.678 0.861 26021 10902 1 17 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.147 0.095 26021 10903 1 17 . 1 1 69 69 VAL H H 69 8.424 8.424 7.121 1.303 26021 10904 1 17 . 1 1 70 70 ARG N N 70 121.373 121.373 120.045 1.328 26021 10905 1 17 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.049 -0.357 26021 10906 1 17 . 1 1 70 70 ARG C C 70 179.117 179.117 179.069 0.048 26021 10907 1 17 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.793 1.372 26021 10908 1 17 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.859 -0.205 26021 10909 1 17 . 1 1 70 70 ARG H H 70 7.916 7.916 8.051 -0.135 26021 10910 1 17 . 1 1 71 71 GLU N N 71 119.075 119.075 119.926 -0.851 26021 10911 1 17 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.227 -0.164 26021 10912 1 17 . 1 1 71 71 GLU C C 71 179.119 179.119 179.339 -0.220 26021 10913 1 17 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.173 0.514 26021 10914 1 17 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.830 0.440 26021 10915 1 17 . 1 1 71 71 GLU H H 71 8.031 8.031 8.478 -0.447 26021 10916 1 17 . 1 1 72 72 LEU N N 72 120.503 120.503 119.957 0.546 26021 10917 1 17 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.225 -0.168 26021 10918 1 17 . 1 1 72 72 LEU C C 72 178.734 178.734 178.777 -0.043 26021 10919 1 17 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.659 0.763 26021 10920 1 17 . 1 1 72 72 LEU CB C 72 41.408 41.408 42.135 -0.727 26021 10921 1 17 . 1 1 72 72 LEU H H 72 8.175 8.175 7.651 0.524 26021 10922 1 17 . 1 1 73 73 SER N N 73 115.243 115.243 116.336 -1.093 26021 10923 1 17 . 1 1 73 73 SER HA H 73 3.824 3.824 4.049 -0.225 26021 10924 1 17 . 1 1 73 73 SER C C 73 175.697 175.697 176.479 -0.782 26021 10925 1 17 . 1 1 73 73 SER CA C 73 62.384 62.384 61.226 1.158 26021 10926 1 17 . 1 1 73 73 SER CB C 73 62.093 62.093 62.653 -0.560 26021 10927 1 17 . 1 1 73 73 SER H H 73 8.411 8.411 7.957 0.454 26021 10928 1 17 . 1 1 74 74 TYR N N 74 121.342 121.342 121.200 0.142 26021 10929 1 17 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.296 0.195 26021 10930 1 17 . 1 1 74 74 TYR C C 74 178.747 178.747 178.334 0.413 26021 10931 1 17 . 1 1 74 74 TYR CA C 74 60.435 60.435 61.145 -0.710 26021 10932 1 17 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.295 -0.788 26021 10933 1 17 . 1 1 74 74 TYR H H 74 7.314 7.314 7.501 -0.187 26021 10934 1 17 . 1 1 75 75 VAL N N 75 120.779 120.779 119.810 0.969 26021 10935 1 17 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.850 0.011 26021 10936 1 17 . 1 1 75 75 VAL C C 75 179.788 179.788 178.188 1.600 26021 10937 1 17 . 1 1 75 75 VAL CA C 75 66.048 66.048 64.584 1.464 26021 10938 1 17 . 1 1 75 75 VAL CB C 75 31.714 31.714 30.916 0.798 26021 10939 1 17 . 1 1 75 75 VAL H H 75 7.740 7.740 8.042 -0.302 26021 10940 1 17 . 1 1 76 76 ILE N N 76 120.598 120.598 119.965 0.633 26021 10941 1 17 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.673 0.027 26021 10942 1 17 . 1 1 76 76 ILE C C 76 177.066 177.066 177.949 -0.883 26021 10943 1 17 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.728 1.191 26021 10944 1 17 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.279 0.106 26021 10945 1 17 . 1 1 76 76 ILE H H 76 8.584 8.584 7.278 1.306 26021 10946 1 17 . 1 1 77 77 GLU N N 77 120.468 120.468 119.822 0.646 26021 10947 1 17 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.958 -0.309 26021 10948 1 17 . 1 1 77 77 GLU C C 77 177.502 177.502 178.813 -1.311 26021 10949 1 17 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.468 1.394 26021 10950 1 17 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.663 0.689 26021 10951 1 17 . 1 1 77 77 GLU H H 77 8.445 8.445 7.744 0.701 26021 10952 1 17 . 1 1 78 78 ASP N N 78 117.382 117.382 119.792 -2.410 26021 10953 1 17 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.386 0.005 26021 10954 1 17 . 1 1 78 78 ASP C C 78 177.382 177.382 178.166 -0.784 26021 10955 1 17 . 1 1 78 78 ASP CA C 78 57.495 57.495 57.033 0.462 26021 10956 1 17 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.290 1.645 26021 10957 1 17 . 1 1 78 78 ASP H H 78 7.885 7.885 8.036 -0.151 26021 10958 1 17 . 1 1 79 79 ALA N N 79 120.171 120.171 122.076 -1.905 26021 10959 1 17 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.017 0.033 26021 10960 1 17 . 1 1 79 79 ALA C C 79 181.193 181.193 179.103 2.090 26021 10961 1 17 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.120 -0.065 26021 10962 1 17 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.401 0.018 26021 10963 1 17 . 1 1 79 79 ALA H H 79 7.754 7.754 7.978 -0.224 26021 10964 1 17 . 1 1 80 80 VAL N N 80 119.541 119.541 118.260 1.281 26021 10965 1 17 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.951 -0.274 26021 10966 1 17 . 1 1 80 80 VAL C C 80 177.096 177.096 177.502 -0.406 26021 10967 1 17 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.111 2.973 26021 10968 1 17 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.885 -0.442 26021 10969 1 17 . 1 1 80 80 VAL H H 80 8.635 8.635 7.653 0.982 26021 10970 1 17 . 1 1 81 81 ASP N N 81 121.140 121.140 121.693 -0.553 26021 10971 1 17 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.296 0.173 26021 10972 1 17 . 1 1 81 81 ASP C C 81 179.569 179.569 178.140 1.429 26021 10973 1 17 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.488 0.441 26021 10974 1 17 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.736 -0.801 26021 10975 1 17 . 1 1 81 81 ASP H H 81 8.575 8.575 8.606 -0.031 26021 10976 1 17 . 1 1 82 82 LYS N N 82 118.159 118.159 119.007 -0.848 26021 10977 1 17 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.032 -0.011 26021 10978 1 17 . 1 1 82 82 LYS C C 82 178.890 178.890 178.733 0.157 26021 10979 1 17 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.970 0.097 26021 10980 1 17 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.186 0.401 26021 10981 1 17 . 1 1 82 82 LYS H H 82 8.079 8.079 7.548 0.531 26021 10982 1 17 . 1 1 83 83 PHE N N 83 120.900 120.900 119.526 1.374 26021 10983 1 17 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.255 0.021 26021 10984 1 17 . 1 1 83 83 PHE C C 83 177.269 177.269 176.637 0.632 26021 10985 1 17 . 1 1 83 83 PHE CA C 83 60.943 60.943 61.507 -0.564 26021 10986 1 17 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.367 0.380 26021 10987 1 17 . 1 1 83 83 PHE H H 83 8.015 8.015 8.254 -0.239 26021 10988 1 17 . 1 1 84 84 LEU N N 84 118.209 118.209 117.582 0.627 26021 10989 1 17 . 1 1 84 84 LEU HA H 84 3.942 3.942 3.968 -0.026 26021 10990 1 17 . 1 1 84 84 LEU C C 84 178.774 178.774 178.104 0.670 26021 10991 1 17 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.990 0.180 26021 10992 1 17 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.272 0.921 26021 10993 1 17 . 1 1 84 84 LEU H H 84 8.338 8.338 7.444 0.894 26021 10994 1 17 . 1 1 85 85 VAL N N 85 116.078 116.078 116.836 -0.758 26021 10995 1 17 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.854 0.137 26021 10996 1 17 . 1 1 85 85 VAL C C 85 177.252 177.252 177.672 -0.420 26021 10997 1 17 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.734 -1.554 26021 10998 1 17 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.320 0.570 26021 10999 1 17 . 1 1 85 85 VAL H H 85 7.447 7.447 7.158 0.289 26021 11000 1 17 . 1 1 86 86 ARG N N 86 120.842 120.842 120.574 0.268 26021 11001 1 17 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.238 -0.011 26021 11002 1 17 . 1 1 86 86 ARG C C 86 177.520 177.520 179.123 -1.603 26021 11003 1 17 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.744 -1.685 26021 11004 1 17 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.438 -0.175 26021 11005 1 17 . 1 1 86 86 ARG H H 86 7.598 7.598 7.215 0.383 26021 11006 1 17 . 1 1 87 87 VAL N N 87 119.293 119.293 116.648 2.645 26021 11007 1 17 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.621 0.204 26021 11008 1 17 . 1 1 87 87 VAL C C 87 176.121 176.121 177.496 -1.375 26021 11009 1 17 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.759 -2.321 26021 11010 1 17 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.598 0.174 26021 11011 1 17 . 1 1 87 87 VAL H H 87 7.994 7.994 7.637 0.357 26021 11012 1 17 . 1 1 88 88 HIS N N 88 120.016 120.016 117.887 2.129 26021 11013 1 17 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.366 0.271 26021 11014 1 17 . 1 1 88 88 HIS C C 88 175.639 175.639 176.198 -0.559 26021 11015 1 17 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.166 0.185 26021 11016 1 17 . 1 1 88 88 HIS CB C 88 29.681 29.681 29.959 -0.278 26021 11017 1 17 . 1 1 88 88 HIS H H 88 7.969 7.969 7.642 0.327 26021 11018 1 17 . 1 1 89 89 GLY N N 89 109.587 109.587 106.799 2.788 26021 11019 1 17 . 1 1 89 89 GLY C C 89 173.730 173.730 174.259 -0.529 26021 11020 1 17 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.398 -0.229 26021 11021 1 17 . 1 1 89 89 GLY H H 89 8.083 8.083 8.091 -0.008 26021 11022 1 17 . 1 1 90 90 VAL N N 90 118.224 118.224 121.795 -3.571 26021 11023 1 17 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.264 -0.126 26021 11024 1 17 . 1 1 90 90 VAL C C 90 176.018 176.018 175.629 0.389 26021 11025 1 17 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.697 1.728 26021 11026 1 17 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.445 -0.829 26021 11027 1 17 . 1 1 90 90 VAL H H 90 7.944 7.944 7.366 0.578 26021 11028 1 17 . 1 1 91 91 GLU N N 91 124.313 124.313 126.307 -1.994 26021 11029 1 17 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.288 0.318 26021 11030 1 17 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.925 -0.749 26021 11031 1 17 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.921 0.839 26021 11032 1 17 . 1 1 91 91 GLU H H 91 8.423 8.423 8.470 -0.047 26021 11033 1 17 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.384 -0.047 26021 11034 1 17 . 1 1 92 92 PRO C C 92 176.504 176.504 175.657 0.847 26021 11035 1 17 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.090 0.282 26021 11036 1 17 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.441 -0.274 26021 11037 1 17 . 1 1 93 93 ASP N N 93 120.275 120.275 121.374 -1.099 26021 11038 1 17 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.849 -0.277 26021 11039 1 17 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.713 0.257 26021 11040 1 17 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.570 -2.055 26021 11041 1 17 . 1 1 93 93 ASP H H 93 8.286 8.286 8.338 -0.052 26021 11042 1 17 . 1 1 94 94 ASP N N 94 121.181 121.181 123.183 -2.002 26021 11043 1 17 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.623 -0.058 26021 11044 1 17 . 1 1 94 94 ASP C C 94 176.474 176.474 177.557 -1.083 26021 11045 1 17 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.615 -1.242 26021 11046 1 17 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.988 -0.763 26021 11047 1 17 . 1 1 94 94 ASP H H 94 8.259 8.259 8.774 -0.515 26021 11048 1 17 . 1 1 95 95 ASN N N 95 118.728 118.728 119.380 -0.652 26021 11049 1 17 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.533 0.161 26021 11050 1 17 . 1 1 95 95 ASN C C 95 176.272 176.272 177.533 -1.261 26021 11051 1 17 . 1 1 95 95 ASN CA C 95 53.986 53.986 56.309 -2.323 26021 11052 1 17 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.140 0.589 26021 11053 1 17 . 1 1 95 95 ASN H H 95 8.474 8.474 8.879 -0.405 26021 11054 1 17 . 1 1 96 96 THR N N 96 113.868 113.868 114.613 -0.745 26021 11055 1 17 . 1 1 96 96 THR HA H 96 4.220 4.220 3.996 0.224 26021 11056 1 17 . 1 1 96 96 THR C C 96 175.107 175.107 175.675 -0.568 26021 11057 1 17 . 1 1 96 96 THR CA C 96 63.200 63.200 64.833 -1.633 26021 11058 1 17 . 1 1 96 96 THR CB C 96 69.475 69.475 68.395 1.080 26021 11059 1 17 . 1 1 96 96 THR H H 96 8.263 8.263 8.253 0.010 26021 11060 1 17 . 1 1 97 97 ASN N N 97 119.954 119.954 118.658 1.296 26021 11061 1 17 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.531 0.085 26021 11062 1 17 . 1 1 97 97 ASN C C 97 176.275 176.275 176.647 -0.372 26021 11063 1 17 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.729 -0.773 26021 11064 1 17 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.913 -0.221 26021 11065 1 17 . 1 1 97 97 ASN H H 97 8.431 8.431 7.987 0.444 26021 11066 1 17 . 1 1 98 98 GLY N N 98 108.847 108.847 107.519 1.328 26021 11067 1 17 . 1 1 98 98 GLY C C 98 175.533 175.533 175.088 0.445 26021 11068 1 17 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.129 -0.118 26021 11069 1 17 . 1 1 98 98 GLY H H 98 8.338 8.338 8.064 0.274 26021 11070 1 17 . 1 1 99 99 PHE N N 99 118.492 118.492 119.152 -0.660 26021 11071 1 17 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.128 0.119 26021 11072 1 17 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.497 1.462 26021 11073 1 17 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.120 -0.961 26021 11074 1 17 . 1 1 99 99 PHE H H 99 8.370 8.370 8.735 -0.365 26021 11075 1 17 . 1 1 100 100 LYS N N 100 120.987 120.987 119.762 1.225 26021 11076 1 17 . 1 1 100 100 LYS H H 100 8.256 8.256 8.418 -0.162 26021 11077 1 17 . 1 1 101 101 GLY N N 101 108.186 108.186 106.934 1.252 26021 11078 1 17 . 1 1 101 101 GLY C C 101 177.075 177.075 176.144 0.931 26021 11079 1 17 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.066 0.836 26021 11080 1 17 . 1 1 101 101 GLY H H 101 8.300 8.300 7.689 0.611 26021 11081 1 17 . 1 1 102 102 LEU N N 102 121.439 121.439 123.841 -2.402 26021 11082 1 17 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.148 -0.051 26021 11083 1 17 . 1 1 102 102 LEU C C 102 179.836 179.836 178.184 1.652 26021 11084 1 17 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.890 -0.532 26021 11085 1 17 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.715 0.055 26021 11086 1 17 . 1 1 102 102 LEU H H 102 7.777 7.777 8.331 -0.554 26021 11087 1 17 . 1 1 103 103 MET N N 103 122.290 122.290 117.849 4.441 26021 11088 1 17 . 1 1 103 103 MET HA H 103 4.220 4.220 4.001 0.219 26021 11089 1 17 . 1 1 103 103 MET C C 103 177.739 177.739 178.110 -0.371 26021 11090 1 17 . 1 1 103 103 MET CA C 103 58.739 58.739 57.987 0.752 26021 11091 1 17 . 1 1 103 103 MET CB C 103 31.895 31.895 31.421 0.474 26021 11092 1 17 . 1 1 103 103 MET H H 103 8.409 8.409 8.150 0.259 26021 11093 1 17 . 1 1 104 104 LYS N N 104 119.750 119.750 117.955 1.795 26021 11094 1 17 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.078 -0.011 26021 11095 1 17 . 1 1 104 104 LYS C C 104 179.301 179.301 179.211 0.090 26021 11096 1 17 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.376 1.388 26021 11097 1 17 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.676 0.371 26021 11098 1 17 . 1 1 104 104 LYS H H 104 7.916 7.916 7.440 0.476 26021 11099 1 17 . 1 1 105 105 ARG N N 105 117.967 117.967 119.473 -1.506 26021 11100 1 17 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.038 -0.012 26021 11101 1 17 . 1 1 105 105 ARG C C 105 178.777 178.777 178.441 0.336 26021 11102 1 17 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.718 -0.354 26021 11103 1 17 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.110 0.887 26021 11104 1 17 . 1 1 105 105 ARG H H 105 7.719 7.719 7.963 -0.244 26021 11105 1 17 . 1 1 106 106 THR N N 106 117.211 117.211 111.713 5.498 26021 11106 1 17 . 1 1 106 106 THR HA H 106 4.301 4.301 4.307 -0.006 26021 11107 1 17 . 1 1 106 106 THR C C 106 176.254 176.254 175.843 0.411 26021 11108 1 17 . 1 1 106 106 THR CA C 106 67.860 67.860 64.949 2.911 26021 11109 1 17 . 1 1 106 106 THR CB C 106 67.860 67.860 68.901 -1.041 26021 11110 1 17 . 1 1 106 106 THR H H 106 8.152 8.152 7.506 0.646 26021 11111 1 17 . 1 1 107 107 THR N N 107 117.939 117.939 118.660 -0.721 26021 11112 1 17 . 1 1 107 107 THR HA H 107 3.971 3.971 3.887 0.084 26021 11113 1 17 . 1 1 107 107 THR C C 107 176.780 176.780 176.151 0.629 26021 11114 1 17 . 1 1 107 107 THR CA C 107 66.822 66.822 66.537 0.285 26021 11115 1 17 . 1 1 107 107 THR CB C 107 68.818 68.818 68.551 0.267 26021 11116 1 17 . 1 1 107 107 THR H H 107 8.651 8.651 7.609 1.042 26021 11117 1 17 . 1 1 108 108 LYS N N 108 120.867 120.867 120.051 0.816 26021 11118 1 17 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.133 -0.111 26021 11119 1 17 . 1 1 108 108 LYS C C 108 179.045 179.045 179.392 -0.347 26021 11120 1 17 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.565 1.269 26021 11121 1 17 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.181 0.292 26021 11122 1 17 . 1 1 108 108 LYS H H 108 7.694 7.694 7.551 0.143 26021 11123 1 17 . 1 1 109 109 LEU N N 109 119.472 119.472 120.890 -1.418 26021 11124 1 17 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.156 0.165 26021 11125 1 17 . 1 1 109 109 LEU C C 109 179.974 179.974 178.952 1.022 26021 11126 1 17 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.264 0.329 26021 11127 1 17 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.190 -0.330 26021 11128 1 17 . 1 1 109 109 LEU H H 109 7.559 7.559 7.951 -0.392 26021 11129 1 17 . 1 1 110 110 LEU N N 110 121.832 121.832 119.484 2.348 26021 11130 1 17 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.106 0.085 26021 11131 1 17 . 1 1 110 110 LEU C C 110 178.101 178.101 177.940 0.161 26021 11132 1 17 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.462 0.430 26021 11133 1 17 . 1 1 110 110 LEU CB C 110 41.884 41.884 40.992 0.891 26021 11134 1 17 . 1 1 110 110 LEU H H 110 8.567 8.567 7.927 0.640 26021 11135 1 17 . 1 1 111 111 LYS N N 111 117.972 117.972 118.310 -0.338 26021 11136 1 17 . 1 1 111 111 LYS HA H 111 3.979 3.979 3.917 0.062 26021 11137 1 17 . 1 1 111 111 LYS C C 111 177.677 177.677 178.774 -1.097 26021 11138 1 17 . 1 1 111 111 LYS CA C 111 58.785 58.785 59.493 -0.708 26021 11139 1 17 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.097 0.112 26021 11140 1 17 . 1 1 111 111 LYS H H 111 7.965 7.965 7.499 0.466 26021 11141 1 17 . 1 1 112 112 LYS N N 112 115.433 115.433 118.216 -2.783 26021 11142 1 17 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.019 0.091 26021 11143 1 17 . 1 1 112 112 LYS C C 112 178.270 178.270 177.565 0.705 26021 11144 1 17 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.054 0.897 26021 11145 1 17 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.051 0.740 26021 11146 1 17 . 1 1 112 112 LYS H H 112 7.334 7.334 7.773 -0.439 26021 11147 1 17 . 1 1 113 113 VAL N N 113 114.861 114.861 120.119 -5.258 26021 11148 1 17 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.888 -0.057 26021 11149 1 17 . 1 1 113 113 VAL C C 113 176.999 176.999 177.137 -0.138 26021 11150 1 17 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.386 -1.881 26021 11151 1 17 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.033 0.254 26021 11152 1 17 . 1 1 113 113 VAL H H 113 7.298 7.298 7.595 -0.297 26021 11153 1 17 . 1 1 114 114 VAL N N 114 121.457 121.457 120.465 0.992 26021 11154 1 17 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.803 -0.081 26021 11155 1 17 . 1 1 114 114 VAL C C 114 177.737 177.737 177.855 -0.118 26021 11156 1 17 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.111 -0.887 26021 11157 1 17 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.356 0.397 26021 11158 1 17 . 1 1 114 114 VAL H H 114 7.855 7.855 8.526 -0.671 26021 11159 1 17 . 1 1 115 115 ASP N N 115 120.804 120.804 118.691 2.113 26021 11160 1 17 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.460 -0.005 26021 11161 1 17 . 1 1 115 115 ASP C C 115 177.380 177.380 177.096 0.284 26021 11162 1 17 . 1 1 115 115 ASP CA C 115 55.921 55.921 55.966 -0.045 26021 11163 1 17 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.857 -0.485 26021 11164 1 17 . 1 1 115 115 ASP H H 115 8.311 8.311 7.999 0.312 26021 11165 1 17 . 1 1 116 116 LYS N N 116 119.582 119.582 118.433 1.149 26021 11166 1 17 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.139 -0.044 26021 11167 1 17 . 1 1 116 116 LYS C C 116 177.077 177.077 177.779 -0.702 26021 11168 1 17 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.798 -0.087 26021 11169 1 17 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.502 -0.014 26021 11170 1 17 . 1 1 116 116 LYS H H 116 7.639 7.639 7.793 -0.154 26021 11171 1 17 . 1 1 117 117 HIS N N 117 115.246 115.246 112.230 3.016 26021 11172 1 17 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.831 -0.206 26021 11173 1 17 . 1 1 117 117 HIS C C 117 175.497 175.497 175.910 -0.413 26021 11174 1 17 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.482 -0.307 26021 11175 1 17 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.492 -2.017 26021 11176 1 17 . 1 1 117 117 HIS H H 117 8.108 8.108 7.992 0.116 26021 11177 1 17 . 1 1 118 118 GLY N N 118 109.944 109.944 108.026 1.918 26021 11178 1 17 . 1 1 118 118 GLY C C 118 174.093 174.093 174.098 -0.005 26021 11179 1 17 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.899 1.165 26021 11180 1 17 . 1 1 118 118 GLY H H 118 8.153 8.153 7.732 0.421 26021 11181 1 17 . 1 1 119 119 ILE N N 119 118.468 118.468 123.411 -4.943 26021 11182 1 17 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.883 0.239 26021 11183 1 17 . 1 1 119 119 ILE C C 119 174.777 174.777 175.810 -1.033 26021 11184 1 17 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.272 -0.171 26021 11185 1 17 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.297 2.334 26021 11186 1 17 . 1 1 119 119 ILE H H 119 7.828 7.828 7.886 -0.058 26021 11187 1 18 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.570 0.179 26021 11188 1 18 . 1 1 4 4 ASN C C 4 175.260 175.260 175.434 -0.174 26021 11189 1 18 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.986 -1.155 26021 11190 1 18 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.459 0.222 26021 11191 1 18 . 1 1 5 5 ALA N N 5 123.648 123.648 121.070 2.578 26021 11192 1 18 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.628 -0.338 26021 11193 1 18 . 1 1 5 5 ALA C C 5 178.256 178.256 178.173 0.083 26021 11194 1 18 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.588 1.493 26021 11195 1 18 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.065 -0.040 26021 11196 1 18 . 1 1 5 5 ALA H H 5 8.520 8.520 8.166 0.354 26021 11197 1 18 . 1 1 6 6 GLY N N 6 107.044 107.044 108.002 -0.958 26021 11198 1 18 . 1 1 6 6 GLY C C 6 174.961 174.961 175.251 -0.290 26021 11199 1 18 . 1 1 6 6 GLY CA C 6 45.830 45.830 47.102 -1.272 26021 11200 1 18 . 1 1 6 6 GLY H H 6 8.350 8.350 7.902 0.448 26021 11201 1 18 . 1 1 7 7 ALA N N 7 123.366 123.366 123.366 0.000 26021 11202 1 18 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.168 0.048 26021 11203 1 18 . 1 1 7 7 ALA C C 7 179.006 179.006 178.892 0.114 26021 11204 1 18 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.430 -0.727 26021 11205 1 18 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.462 0.382 26021 11206 1 18 . 1 1 7 7 ALA H H 7 8.078 8.078 8.166 -0.088 26021 11207 1 18 . 1 1 8 8 ILE N N 8 117.376 117.376 118.732 -1.356 26021 11208 1 18 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.724 0.056 26021 11209 1 18 . 1 1 8 8 ILE C C 8 177.032 177.032 178.216 -1.184 26021 11210 1 18 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.236 -1.078 26021 11211 1 18 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.023 -1.734 26021 11212 1 18 . 1 1 8 8 ILE H H 8 7.943 7.943 7.411 0.532 26021 11213 1 18 . 1 1 9 9 ALA N N 9 121.414 121.414 122.782 -1.368 26021 11214 1 18 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.141 -0.208 26021 11215 1 18 . 1 1 9 9 ALA C C 9 180.515 180.515 179.325 1.190 26021 11216 1 18 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.818 0.280 26021 11217 1 18 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.147 0.014 26021 11218 1 18 . 1 1 9 9 ALA H H 9 8.062 8.062 7.805 0.257 26021 11219 1 18 . 1 1 10 10 LYS N N 10 114.594 114.594 118.464 -3.870 26021 11220 1 18 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.107 0.057 26021 11221 1 18 . 1 1 10 10 LYS C C 10 178.099 178.099 178.106 -0.007 26021 11222 1 18 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.510 -0.670 26021 11223 1 18 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.233 0.236 26021 11224 1 18 . 1 1 10 10 LYS H H 10 7.554 7.554 7.762 -0.208 26021 11225 1 18 . 1 1 11 11 LEU N N 11 119.662 119.662 119.141 0.521 26021 11226 1 18 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.140 -0.062 26021 11227 1 18 . 1 1 11 11 LEU C C 11 177.930 177.930 178.256 -0.326 26021 11228 1 18 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.336 0.220 26021 11229 1 18 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.763 1.325 26021 11230 1 18 . 1 1 11 11 LEU H H 11 7.814 7.814 7.329 0.485 26021 11231 1 18 . 1 1 12 12 ILE N N 12 117.945 117.945 120.837 -2.892 26021 11232 1 18 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.933 -0.241 26021 11233 1 18 . 1 1 12 12 ILE CA C 12 67.629 67.629 65.909 1.720 26021 11234 1 18 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.794 1.616 26021 11235 1 18 . 1 1 12 12 ILE H H 12 7.426 7.426 7.658 -0.232 26021 11236 1 18 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.281 0.122 26021 11237 1 18 . 1 1 13 13 PRO C C 13 179.030 179.030 178.581 0.449 26021 11238 1 18 . 1 1 13 13 PRO CA C 13 65.244 65.244 64.961 0.283 26021 11239 1 18 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.062 -0.253 26021 11240 1 18 . 1 1 14 14 LYS N N 14 117.855 117.855 119.405 -1.550 26021 11241 1 18 . 1 1 14 14 LYS HA H 14 4.145 4.145 3.999 0.146 26021 11242 1 18 . 1 1 14 14 LYS C C 14 178.565 178.565 179.268 -0.703 26021 11243 1 18 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.659 -0.226 26021 11244 1 18 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.166 0.759 26021 11245 1 18 . 1 1 14 14 LYS H H 14 6.685 6.685 7.397 -0.712 26021 11246 1 18 . 1 1 15 15 LEU N N 15 118.008 118.008 117.985 0.023 26021 11247 1 18 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.260 -0.257 26021 11248 1 18 . 1 1 15 15 LEU C C 15 178.662 178.662 178.921 -0.259 26021 11249 1 18 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.687 1.025 26021 11250 1 18 . 1 1 15 15 LEU CB C 15 41.999 41.999 41.981 0.018 26021 11251 1 18 . 1 1 15 15 LEU H H 15 8.148 8.148 7.548 0.600 26021 11252 1 18 . 1 1 16 16 GLY N N 16 103.895 103.895 107.862 -3.967 26021 11253 1 18 . 1 1 16 16 GLY C C 16 176.838 176.838 175.450 1.388 26021 11254 1 18 . 1 1 16 16 GLY CA C 16 47.365 47.365 46.987 0.378 26021 11255 1 18 . 1 1 16 16 GLY H H 16 8.104 8.104 7.756 0.348 26021 11256 1 18 . 1 1 17 17 GLU N N 17 121.655 121.655 120.923 0.732 26021 11257 1 18 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.073 0.060 26021 11258 1 18 . 1 1 17 17 GLU C C 17 179.007 179.007 177.676 1.331 26021 11259 1 18 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.831 -0.020 26021 11260 1 18 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.723 -0.590 26021 11261 1 18 . 1 1 17 17 GLU H H 17 7.817 7.817 7.548 0.269 26021 11262 1 18 . 1 1 18 18 LEU N N 18 117.834 117.834 117.555 0.279 26021 11263 1 18 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.316 -0.198 26021 11264 1 18 . 1 1 18 18 LEU C C 18 177.658 177.658 177.375 0.283 26021 11265 1 18 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.066 1.963 26021 11266 1 18 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.558 0.112 26021 11267 1 18 . 1 1 18 18 LEU H H 18 7.389 7.389 7.835 -0.446 26021 11268 1 18 . 1 1 19 19 LEU N N 19 113.694 113.694 117.114 -3.420 26021 11269 1 18 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.335 -0.173 26021 11270 1 18 . 1 1 19 19 LEU C C 19 178.123 178.123 178.042 0.081 26021 11271 1 18 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.861 -0.009 26021 11272 1 18 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.479 -0.259 26021 11273 1 18 . 1 1 19 19 LEU H H 19 7.269 7.269 7.125 0.144 26021 11274 1 18 . 1 1 20 20 VAL N N 20 112.778 112.778 114.207 -1.429 26021 11275 1 18 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.066 0.377 26021 11276 1 18 . 1 1 20 20 VAL C C 20 177.021 177.021 176.982 0.039 26021 11277 1 18 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.567 -1.712 26021 11278 1 18 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.094 0.684 26021 11279 1 18 . 1 1 20 20 VAL H H 20 7.356 7.356 7.426 -0.070 26021 11280 1 18 . 1 1 21 21 GLY N N 21 108.962 108.962 109.040 -0.078 26021 11281 1 18 . 1 1 21 21 GLY C C 21 173.813 173.813 174.202 -0.389 26021 11282 1 18 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.651 0.395 26021 11283 1 18 . 1 1 21 21 GLY H H 21 7.925 7.925 8.348 -0.423 26021 11284 1 18 . 1 1 22 22 GLU N N 22 120.607 120.607 122.554 -1.947 26021 11285 1 18 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.605 -0.327 26021 11286 1 18 . 1 1 22 22 GLU C C 22 175.869 175.869 175.237 0.632 26021 11287 1 18 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.377 0.653 26021 11288 1 18 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.485 -0.804 26021 11289 1 18 . 1 1 22 22 GLU H H 22 8.300 8.300 8.422 -0.122 26021 11290 1 18 . 1 1 23 23 TYR N N 23 120.738 120.738 117.753 2.985 26021 11291 1 18 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.951 -0.394 26021 11292 1 18 . 1 1 23 23 TYR C C 23 175.264 175.264 174.600 0.664 26021 11293 1 18 . 1 1 23 23 TYR CA C 23 57.561 57.561 56.967 0.594 26021 11294 1 18 . 1 1 23 23 TYR CB C 23 39.246 39.246 40.126 -0.880 26021 11295 1 18 . 1 1 23 23 TYR H H 23 7.756 7.756 7.557 0.199 26021 11296 1 18 . 1 1 24 24 LYS N N 24 122.095 122.095 123.324 -1.229 26021 11297 1 18 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.532 -0.349 26021 11298 1 18 . 1 1 24 24 LYS C C 24 175.742 175.742 174.466 1.276 26021 11299 1 18 . 1 1 24 24 LYS CA C 24 56.118 56.118 56.083 0.035 26021 11300 1 18 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.656 0.063 26021 11301 1 18 . 1 1 24 24 LYS H H 24 8.692 8.692 8.928 -0.236 26021 11302 1 18 . 1 1 25 25 LEU N N 25 121.123 121.123 119.168 1.955 26021 11303 1 18 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.710 -0.217 26021 11304 1 18 . 1 1 25 25 LEU C C 25 177.487 177.487 176.175 1.312 26021 11305 1 18 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.606 0.728 26021 11306 1 18 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.570 -0.812 26021 11307 1 18 . 1 1 25 25 LEU H H 25 8.088 8.088 7.527 0.561 26021 11308 1 18 . 1 1 26 26 HIS N N 26 122.993 122.993 119.408 3.585 26021 11309 1 18 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.482 0.019 26021 11310 1 18 . 1 1 26 26 HIS C C 26 176.716 176.716 176.489 0.227 26021 11311 1 18 . 1 1 26 26 HIS CA C 26 57.197 57.197 57.157 0.040 26021 11312 1 18 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.873 0.484 26021 11313 1 18 . 1 1 26 26 HIS H H 26 8.882 8.882 8.493 0.389 26021 11314 1 18 . 1 1 27 27 LYS N N 27 124.894 124.894 125.723 -0.829 26021 11315 1 18 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.283 -0.335 26021 11316 1 18 . 1 1 27 27 LYS C C 27 178.873 178.873 178.673 0.200 26021 11317 1 18 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.363 1.648 26021 11318 1 18 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.474 -0.032 26021 11319 1 18 . 1 1 27 27 LYS H H 27 8.699 8.699 8.080 0.619 26021 11320 1 18 . 1 1 28 28 GLY N N 28 111.258 111.258 106.405 4.853 26021 11321 1 18 . 1 1 28 28 GLY C C 28 176.131 176.131 175.908 0.223 26021 11322 1 18 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.867 -0.377 26021 11323 1 18 . 1 1 28 28 GLY H H 28 9.814 9.814 8.240 1.574 26021 11324 1 18 . 1 1 29 29 VAL N N 29 122.719 122.719 121.164 1.555 26021 11325 1 18 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.570 0.322 26021 11326 1 18 . 1 1 29 29 VAL C C 29 177.628 177.628 177.480 0.148 26021 11327 1 18 . 1 1 29 29 VAL CA C 29 65.520 65.520 66.040 -0.520 26021 11328 1 18 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.244 0.498 26021 11329 1 18 . 1 1 29 29 VAL H H 29 7.431 7.431 7.459 -0.028 26021 11330 1 18 . 1 1 30 30 LYS N N 30 119.791 119.791 119.150 0.641 26021 11331 1 18 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.952 -0.317 26021 11332 1 18 . 1 1 30 30 LYS C C 30 177.666 177.666 178.979 -1.313 26021 11333 1 18 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.436 1.588 26021 11334 1 18 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.782 0.623 26021 11335 1 18 . 1 1 30 30 LYS H H 30 8.255 8.255 7.881 0.374 26021 11336 1 18 . 1 1 31 31 LYS N N 31 117.918 117.918 118.134 -0.216 26021 11337 1 18 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.249 -0.133 26021 11338 1 18 . 1 1 31 31 LYS C C 31 177.784 177.784 179.181 -1.397 26021 11339 1 18 . 1 1 31 31 LYS CA C 31 58.703 58.703 58.979 -0.276 26021 11340 1 18 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.955 -0.110 26021 11341 1 18 . 1 1 31 31 LYS H H 31 7.689 7.689 7.657 0.032 26021 11342 1 18 . 1 1 32 32 ASN N N 32 116.347 116.347 118.749 -2.402 26021 11343 1 18 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.437 0.083 26021 11344 1 18 . 1 1 32 32 ASN C C 32 177.764 177.764 177.716 0.048 26021 11345 1 18 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.569 0.746 26021 11346 1 18 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.264 0.368 26021 11347 1 18 . 1 1 32 32 ASN H H 32 7.556 7.556 7.776 -0.220 26021 11348 1 18 . 1 1 33 33 ILE N N 33 120.592 120.592 120.302 0.290 26021 11349 1 18 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.790 -0.508 26021 11350 1 18 . 1 1 33 33 ILE C C 33 177.074 177.074 177.441 -0.367 26021 11351 1 18 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.177 2.711 26021 11352 1 18 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.540 0.638 26021 11353 1 18 . 1 1 33 33 ILE H H 33 8.236 8.236 8.299 -0.063 26021 11354 1 18 . 1 1 34 34 GLU N N 34 120.595 120.595 119.556 1.039 26021 11355 1 18 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.888 -0.100 26021 11356 1 18 . 1 1 34 34 GLU C C 34 179.739 179.739 178.718 1.021 26021 11357 1 18 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.712 0.527 26021 11358 1 18 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.938 0.907 26021 11359 1 18 . 1 1 34 34 GLU H H 34 8.551 8.551 8.744 -0.193 26021 11360 1 18 . 1 1 35 35 ASP N N 35 120.600 120.600 120.033 0.567 26021 11361 1 18 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.472 -0.060 26021 11362 1 18 . 1 1 35 35 ASP C C 35 178.681 178.681 178.178 0.503 26021 11363 1 18 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.551 0.911 26021 11364 1 18 . 1 1 35 35 ASP CB C 35 39.750 39.750 41.252 -1.502 26021 11365 1 18 . 1 1 35 35 ASP H H 35 8.670 8.670 7.803 0.867 26021 11366 1 18 . 1 1 36 36 LEU N N 36 123.004 123.004 120.740 2.264 26021 11367 1 18 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.192 -0.097 26021 11368 1 18 . 1 1 36 36 LEU C C 36 178.035 178.035 179.025 -0.990 26021 11369 1 18 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.246 0.782 26021 11370 1 18 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.227 -0.351 26021 11371 1 18 . 1 1 36 36 LEU H H 36 8.166 8.166 7.571 0.595 26021 11372 1 18 . 1 1 37 37 LEU N N 37 120.178 120.178 119.522 0.656 26021 11373 1 18 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.087 -0.231 26021 11374 1 18 . 1 1 37 37 LEU C C 37 178.128 178.128 177.915 0.213 26021 11375 1 18 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.200 1.475 26021 11376 1 18 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.540 0.615 26021 11377 1 18 . 1 1 37 37 LEU H H 37 8.736 8.736 8.366 0.370 26021 11378 1 18 . 1 1 38 38 LYS N N 38 118.110 118.110 119.307 -1.197 26021 11379 1 18 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.816 0.117 26021 11380 1 18 . 1 1 38 38 LYS C C 38 179.533 179.533 178.485 1.048 26021 11381 1 18 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.451 -0.178 26021 11382 1 18 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.071 0.206 26021 11383 1 18 . 1 1 38 38 LYS H H 38 7.770 7.770 7.955 -0.185 26021 11384 1 18 . 1 1 39 39 GLU N N 39 119.265 119.265 118.543 0.722 26021 11385 1 18 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.092 0.210 26021 11386 1 18 . 1 1 39 39 GLU C C 39 179.720 179.720 178.786 0.934 26021 11387 1 18 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.206 -0.448 26021 11388 1 18 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.100 0.490 26021 11389 1 18 . 1 1 39 39 GLU H H 39 7.709 7.709 7.772 -0.063 26021 11390 1 18 . 1 1 40 40 LEU N N 40 119.007 119.007 120.710 -1.703 26021 11391 1 18 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.106 -0.056 26021 11392 1 18 . 1 1 40 40 LEU C C 40 179.690 179.690 179.336 0.354 26021 11393 1 18 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.176 0.475 26021 11394 1 18 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.555 0.130 26021 11395 1 18 . 1 1 40 40 LEU H H 40 8.851 8.851 7.323 1.528 26021 11396 1 18 . 1 1 41 41 LYS N N 41 120.500 120.500 119.496 1.004 26021 11397 1 18 . 1 1 41 41 LYS HA H 41 3.952 3.952 3.988 -0.036 26021 11398 1 18 . 1 1 41 41 LYS C C 41 180.223 180.223 179.454 0.769 26021 11399 1 18 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.891 1.000 26021 11400 1 18 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.349 -0.282 26021 11401 1 18 . 1 1 41 41 LYS H H 41 8.482 8.482 8.519 -0.037 26021 11402 1 18 . 1 1 42 42 THR N N 42 119.555 119.555 111.876 7.679 26021 11403 1 18 . 1 1 42 42 THR HA H 42 4.000 4.000 4.165 -0.165 26021 11404 1 18 . 1 1 42 42 THR C C 42 176.633 176.633 176.364 0.269 26021 11405 1 18 . 1 1 42 42 THR CA C 42 66.574 66.574 65.540 1.034 26021 11406 1 18 . 1 1 42 42 THR CB C 42 67.924 67.924 68.888 -0.964 26021 11407 1 18 . 1 1 42 42 THR H H 42 7.863 7.863 7.613 0.250 26021 11408 1 18 . 1 1 43 43 MET N N 43 122.839 122.839 122.062 0.777 26021 11409 1 18 . 1 1 43 43 MET HA H 43 4.022 4.022 4.107 -0.085 26021 11410 1 18 . 1 1 43 43 MET C C 43 177.290 177.290 178.452 -1.162 26021 11411 1 18 . 1 1 43 43 MET CA C 43 59.731 59.731 60.325 -0.594 26021 11412 1 18 . 1 1 43 43 MET CB C 43 33.610 33.610 32.385 1.226 26021 11413 1 18 . 1 1 43 43 MET H H 43 8.714 8.714 8.269 0.445 26021 11414 1 18 . 1 1 44 44 ASN N N 44 118.049 118.049 117.333 0.716 26021 11415 1 18 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.367 0.007 26021 11416 1 18 . 1 1 44 44 ASN C C 44 176.297 176.297 177.301 -1.004 26021 11417 1 18 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.464 0.430 26021 11418 1 18 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.415 0.991 26021 11419 1 18 . 1 1 44 44 ASN H H 44 8.988 8.988 8.390 0.598 26021 11420 1 18 . 1 1 45 45 ALA N N 45 119.260 119.260 121.122 -1.862 26021 11421 1 18 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.271 -0.205 26021 11422 1 18 . 1 1 45 45 ALA C C 45 180.476 180.476 179.381 1.095 26021 11423 1 18 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.464 0.804 26021 11424 1 18 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.289 -0.601 26021 11425 1 18 . 1 1 45 45 ALA H H 45 7.675 7.675 7.394 0.281 26021 11426 1 18 . 1 1 46 46 ALA N N 46 121.126 121.126 123.317 -2.191 26021 11427 1 18 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.237 -0.121 26021 11428 1 18 . 1 1 46 46 ALA C C 46 179.314 179.314 179.259 0.055 26021 11429 1 18 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.241 -0.255 26021 11430 1 18 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.773 -0.551 26021 11431 1 18 . 1 1 46 46 ALA H H 46 7.872 7.872 8.062 -0.190 26021 11432 1 18 . 1 1 47 47 LEU N N 47 119.328 119.328 116.548 2.780 26021 11433 1 18 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.284 -0.093 26021 11434 1 18 . 1 1 47 47 LEU C C 47 180.403 180.403 178.603 1.800 26021 11435 1 18 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.237 -0.191 26021 11436 1 18 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.593 0.357 26021 11437 1 18 . 1 1 47 47 LEU H H 47 8.529 8.529 8.022 0.507 26021 11438 1 18 . 1 1 48 48 ILE N N 48 121.653 121.653 118.004 3.649 26021 11439 1 18 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.759 -0.057 26021 11440 1 18 . 1 1 48 48 ILE C C 48 178.730 178.730 177.913 0.817 26021 11441 1 18 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.576 0.334 26021 11442 1 18 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.587 0.325 26021 11443 1 18 . 1 1 48 48 ILE H H 48 8.386 8.386 7.278 1.108 26021 11444 1 18 . 1 1 49 49 LYS N N 49 119.896 119.896 118.590 1.306 26021 11445 1 18 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.157 -0.114 26021 11446 1 18 . 1 1 49 49 LYS C C 49 179.999 179.999 179.044 0.955 26021 11447 1 18 . 1 1 49 49 LYS CA C 49 59.057 59.057 58.895 0.162 26021 11448 1 18 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.415 -0.454 26021 11449 1 18 . 1 1 49 49 LYS H H 49 7.456 7.456 7.459 -0.003 26021 11450 1 18 . 1 1 50 50 ILE N N 50 119.964 119.964 116.042 3.922 26021 11451 1 18 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.036 -0.300 26021 11452 1 18 . 1 1 50 50 ILE C C 50 177.960 177.960 177.878 0.082 26021 11453 1 18 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.690 0.659 26021 11454 1 18 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.279 0.853 26021 11455 1 18 . 1 1 50 50 ILE H H 50 8.154 8.154 8.673 -0.519 26021 11456 1 18 . 1 1 51 51 GLY N N 51 106.709 106.709 109.668 -2.959 26021 11457 1 18 . 1 1 51 51 GLY C C 51 174.461 174.461 175.184 -0.723 26021 11458 1 18 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.889 -0.980 26021 11459 1 18 . 1 1 51 51 GLY H H 51 7.932 7.932 7.894 0.038 26021 11460 1 18 . 1 1 52 52 GLU N N 52 118.736 118.736 119.973 -1.237 26021 11461 1 18 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.506 -0.186 26021 11462 1 18 . 1 1 52 52 GLU C C 52 176.789 176.789 176.271 0.518 26021 11463 1 18 . 1 1 52 52 GLU CA C 52 56.274 56.274 54.981 1.293 26021 11464 1 18 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.076 0.036 26021 11465 1 18 . 1 1 52 52 GLU H H 52 7.597 7.597 7.583 0.014 26021 11466 1 18 . 1 1 53 53 VAL N N 53 122.982 122.982 122.851 0.131 26021 11467 1 18 . 1 1 53 53 VAL HA H 53 4.261 4.261 3.919 0.342 26021 11468 1 18 . 1 1 53 53 VAL CA C 53 60.385 60.385 61.462 -1.077 26021 11469 1 18 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.430 1.392 26021 11470 1 18 . 1 1 53 53 VAL H H 53 7.511 7.511 7.768 -0.257 26021 11471 1 18 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.757 -0.112 26021 11472 1 18 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.400 0.178 26021 11473 1 18 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.221 0.314 26021 11474 1 18 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.307 -0.116 26021 11475 1 18 . 1 1 55 55 PRO C C 55 178.258 178.258 176.871 1.387 26021 11476 1 18 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.278 1.149 26021 11477 1 18 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.974 -0.129 26021 11478 1 18 . 1 1 56 56 ASP N N 56 114.117 114.117 117.548 -3.431 26021 11479 1 18 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.521 -0.030 26021 11480 1 18 . 1 1 56 56 ASP C C 56 176.696 176.696 177.230 -0.534 26021 11481 1 18 . 1 1 56 56 ASP CA C 56 55.138 55.138 56.021 -0.883 26021 11482 1 18 . 1 1 56 56 ASP CB C 56 39.726 39.726 41.069 -1.343 26021 11483 1 18 . 1 1 56 56 ASP H H 56 8.489 8.489 8.458 0.031 26021 11484 1 18 . 1 1 57 57 GLN N N 57 117.641 117.641 115.637 2.004 26021 11485 1 18 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.364 0.010 26021 11486 1 18 . 1 1 57 57 GLN C C 57 175.765 175.765 175.395 0.370 26021 11487 1 18 . 1 1 57 57 GLN CA C 57 55.290 55.290 54.799 0.491 26021 11488 1 18 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.595 0.051 26021 11489 1 18 . 1 1 57 57 GLN H H 57 8.206 8.206 7.765 0.441 26021 11490 1 18 . 1 1 58 58 LEU N N 58 122.141 122.141 121.885 0.256 26021 11491 1 18 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.319 0.131 26021 11492 1 18 . 1 1 58 58 LEU C C 58 176.849 176.849 175.491 1.358 26021 11493 1 18 . 1 1 58 58 LEU CA C 58 54.995 54.995 54.995 -0.000 26021 11494 1 18 . 1 1 58 58 LEU CB C 58 43.231 43.231 41.657 1.574 26021 11495 1 18 . 1 1 58 58 LEU H H 58 7.152 7.152 7.347 -0.195 26021 11496 1 18 . 1 1 59 59 ASP N N 59 125.643 125.643 125.064 0.579 26021 11497 1 18 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.826 -0.107 26021 11498 1 18 . 1 1 59 59 ASP C C 59 177.249 177.249 176.759 0.490 26021 11499 1 18 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.894 0.509 26021 11500 1 18 . 1 1 59 59 ASP CB C 59 42.232 42.232 44.139 -1.907 26021 11501 1 18 . 1 1 59 59 ASP H H 59 9.312 9.312 8.244 1.068 26021 11502 1 18 . 1 1 60 60 SER N N 60 116.550 116.550 116.448 0.102 26021 11503 1 18 . 1 1 60 60 SER HA H 60 4.124 4.124 4.218 -0.094 26021 11504 1 18 . 1 1 60 60 SER C C 60 176.840 176.840 175.905 0.935 26021 11505 1 18 . 1 1 60 60 SER CA C 60 61.722 61.722 60.607 1.115 26021 11506 1 18 . 1 1 60 60 SER CB C 60 62.815 62.815 63.408 -0.594 26021 11507 1 18 . 1 1 60 60 SER H H 60 8.647 8.647 8.645 0.002 26021 11508 1 18 . 1 1 61 61 GLN N N 61 121.394 121.394 120.794 0.600 26021 11509 1 18 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.158 -0.027 26021 11510 1 18 . 1 1 61 61 GLN C C 61 178.629 178.629 177.400 1.229 26021 11511 1 18 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.141 0.612 26021 11512 1 18 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.982 -0.729 26021 11513 1 18 . 1 1 61 61 GLN H H 61 8.453 8.453 7.846 0.607 26021 11514 1 18 . 1 1 62 62 ASP N N 62 122.187 122.187 118.776 3.411 26021 11515 1 18 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.338 0.281 26021 11516 1 18 . 1 1 62 62 ASP C C 62 178.318 178.318 177.880 0.438 26021 11517 1 18 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.532 -0.070 26021 11518 1 18 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.739 0.297 26021 11519 1 18 . 1 1 62 62 ASP H H 62 8.311 8.311 7.889 0.422 26021 11520 1 18 . 1 1 63 63 LYS N N 63 120.325 120.325 118.164 2.161 26021 11521 1 18 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.217 -0.208 26021 11522 1 18 . 1 1 63 63 LYS C C 63 178.765 178.765 179.215 -0.450 26021 11523 1 18 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.829 0.924 26021 11524 1 18 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.486 -0.033 26021 11525 1 18 . 1 1 63 63 LYS H H 63 7.923 7.923 7.944 -0.021 26021 11526 1 18 . 1 1 64 64 LEU N N 64 119.491 119.491 120.223 -0.732 26021 11527 1 18 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.087 0.139 26021 11528 1 18 . 1 1 64 64 LEU C C 64 179.526 179.526 178.953 0.573 26021 11529 1 18 . 1 1 64 64 LEU CA C 64 57.798 57.798 56.950 0.848 26021 11530 1 18 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.238 0.537 26021 11531 1 18 . 1 1 64 64 LEU H H 64 7.820 7.820 7.297 0.523 26021 11532 1 18 . 1 1 65 65 TRP N N 65 120.674 120.674 122.229 -1.555 26021 11533 1 18 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.471 -0.163 26021 11534 1 18 . 1 1 65 65 TRP C C 65 177.379 177.379 177.127 0.252 26021 11535 1 18 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.592 1.210 26021 11536 1 18 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.875 -0.464 26021 11537 1 18 . 1 1 65 65 TRP H H 65 8.196 8.196 8.008 0.188 26021 11538 1 18 . 1 1 66 66 ALA N N 66 120.606 120.606 119.772 0.834 26021 11539 1 18 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.501 0.208 26021 11540 1 18 . 1 1 66 66 ALA C C 66 180.376 180.376 179.150 1.226 26021 11541 1 18 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.720 0.844 26021 11542 1 18 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.926 -0.272 26021 11543 1 18 . 1 1 66 66 ALA H H 66 8.305 8.305 7.599 0.706 26021 11544 1 18 . 1 1 67 67 ASP N N 67 119.175 119.175 118.206 0.969 26021 11545 1 18 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.323 0.127 26021 11546 1 18 . 1 1 67 67 ASP C C 67 178.757 178.757 177.840 0.917 26021 11547 1 18 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.077 0.415 26021 11548 1 18 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.699 -0.545 26021 11549 1 18 . 1 1 67 67 ASP H H 67 7.945 7.945 8.157 -0.212 26021 11550 1 18 . 1 1 68 68 GLU N N 68 122.322 122.322 119.593 2.729 26021 11551 1 18 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.154 -0.139 26021 11552 1 18 . 1 1 68 68 GLU C C 68 180.055 180.055 178.979 1.076 26021 11553 1 18 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.161 0.949 26021 11554 1 18 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.361 0.286 26021 11555 1 18 . 1 1 68 68 GLU H H 68 8.168 8.168 7.576 0.592 26021 11556 1 18 . 1 1 69 69 VAL N N 69 122.135 122.135 116.768 5.367 26021 11557 1 18 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.668 -0.416 26021 11558 1 18 . 1 1 69 69 VAL C C 69 177.736 177.736 177.794 -0.058 26021 11559 1 18 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.464 1.075 26021 11560 1 18 . 1 1 69 69 VAL CB C 69 31.242 31.242 30.866 0.376 26021 11561 1 18 . 1 1 69 69 VAL H H 69 8.424 8.424 7.132 1.292 26021 11562 1 18 . 1 1 70 70 ARG N N 70 121.373 121.373 119.814 1.559 26021 11563 1 18 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.045 -0.353 26021 11564 1 18 . 1 1 70 70 ARG C C 70 179.117 179.117 178.979 0.138 26021 11565 1 18 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.816 1.349 26021 11566 1 18 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.794 -0.140 26021 11567 1 18 . 1 1 70 70 ARG H H 70 7.916 7.916 7.323 0.593 26021 11568 1 18 . 1 1 71 71 GLU N N 71 119.075 119.075 119.629 -0.554 26021 11569 1 18 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.837 0.226 26021 11570 1 18 . 1 1 71 71 GLU C C 71 179.119 179.119 179.100 0.019 26021 11571 1 18 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.920 0.767 26021 11572 1 18 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.630 0.640 26021 11573 1 18 . 1 1 71 71 GLU H H 71 8.031 8.031 8.500 -0.469 26021 11574 1 18 . 1 1 72 72 LEU N N 72 120.503 120.503 120.225 0.278 26021 11575 1 18 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.175 -0.118 26021 11576 1 18 . 1 1 72 72 LEU C C 72 178.734 178.734 178.902 -0.168 26021 11577 1 18 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.711 0.711 26021 11578 1 18 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.159 0.249 26021 11579 1 18 . 1 1 72 72 LEU H H 72 8.175 8.175 7.625 0.550 26021 11580 1 18 . 1 1 73 73 SER N N 73 115.243 115.243 115.915 -0.672 26021 11581 1 18 . 1 1 73 73 SER HA H 73 3.824 3.824 4.121 -0.297 26021 11582 1 18 . 1 1 73 73 SER C C 73 175.697 175.697 176.913 -1.216 26021 11583 1 18 . 1 1 73 73 SER CA C 73 62.384 62.384 61.273 1.111 26021 11584 1 18 . 1 1 73 73 SER CB C 73 62.093 62.093 62.982 -0.889 26021 11585 1 18 . 1 1 73 73 SER H H 73 8.411 8.411 8.301 0.110 26021 11586 1 18 . 1 1 74 74 TYR N N 74 121.342 121.342 122.621 -1.279 26021 11587 1 18 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.242 0.249 26021 11588 1 18 . 1 1 74 74 TYR C C 74 178.747 178.747 178.464 0.283 26021 11589 1 18 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.187 0.248 26021 11590 1 18 . 1 1 74 74 TYR CB C 74 37.507 37.507 37.958 -0.451 26021 11591 1 18 . 1 1 74 74 TYR H H 74 7.314 7.314 7.800 -0.486 26021 11592 1 18 . 1 1 75 75 VAL N N 75 120.779 120.779 118.479 2.300 26021 11593 1 18 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.783 0.078 26021 11594 1 18 . 1 1 75 75 VAL C C 75 179.788 179.788 178.281 1.507 26021 11595 1 18 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.828 0.220 26021 11596 1 18 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.128 0.586 26021 11597 1 18 . 1 1 75 75 VAL H H 75 7.740 7.740 7.761 -0.021 26021 11598 1 18 . 1 1 76 76 ILE N N 76 120.598 120.598 119.630 0.968 26021 11599 1 18 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.711 -0.011 26021 11600 1 18 . 1 1 76 76 ILE C C 76 177.066 177.066 177.427 -0.361 26021 11601 1 18 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.417 1.502 26021 11602 1 18 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.241 0.144 26021 11603 1 18 . 1 1 76 76 ILE H H 76 8.584 8.584 7.858 0.726 26021 11604 1 18 . 1 1 77 77 GLU N N 77 120.468 120.468 119.752 0.716 26021 11605 1 18 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.915 -0.266 26021 11606 1 18 . 1 1 77 77 GLU C C 77 177.502 177.502 178.391 -0.889 26021 11607 1 18 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.582 1.280 26021 11608 1 18 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.991 0.361 26021 11609 1 18 . 1 1 77 77 GLU H H 77 8.445 8.445 7.769 0.676 26021 11610 1 18 . 1 1 78 78 ASP N N 78 117.382 117.382 119.449 -2.067 26021 11611 1 18 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.303 0.088 26021 11612 1 18 . 1 1 78 78 ASP C C 78 177.382 177.382 178.117 -0.735 26021 11613 1 18 . 1 1 78 78 ASP CA C 78 57.495 57.495 57.293 0.202 26021 11614 1 18 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.474 1.461 26021 11615 1 18 . 1 1 78 78 ASP H H 78 7.885 7.885 7.692 0.193 26021 11616 1 18 . 1 1 79 79 ALA N N 79 120.171 120.171 122.432 -2.261 26021 11617 1 18 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.010 0.040 26021 11618 1 18 . 1 1 79 79 ALA C C 79 181.193 181.193 179.901 1.292 26021 11619 1 18 . 1 1 79 79 ALA CA C 79 55.055 55.055 54.912 0.143 26021 11620 1 18 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.500 -0.080 26021 11621 1 18 . 1 1 79 79 ALA H H 79 7.754 7.754 7.557 0.197 26021 11622 1 18 . 1 1 80 80 VAL N N 80 119.541 119.541 117.970 1.571 26021 11623 1 18 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.662 0.015 26021 11624 1 18 . 1 1 80 80 VAL C C 80 177.096 177.096 177.866 -0.770 26021 11625 1 18 . 1 1 80 80 VAL CA C 80 67.084 67.084 66.253 0.831 26021 11626 1 18 . 1 1 80 80 VAL CB C 80 31.443 31.443 30.868 0.575 26021 11627 1 18 . 1 1 80 80 VAL H H 80 8.635 8.635 7.523 1.112 26021 11628 1 18 . 1 1 81 81 ASP N N 81 121.140 121.140 118.585 2.555 26021 11629 1 18 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.383 0.086 26021 11630 1 18 . 1 1 81 81 ASP C C 81 179.569 179.569 177.889 1.680 26021 11631 1 18 . 1 1 81 81 ASP CA C 81 57.929 57.929 56.884 1.045 26021 11632 1 18 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.679 -0.744 26021 11633 1 18 . 1 1 81 81 ASP H H 81 8.575 8.575 7.995 0.580 26021 11634 1 18 . 1 1 82 82 LYS N N 82 118.159 118.159 118.738 -0.579 26021 11635 1 18 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.055 -0.034 26021 11636 1 18 . 1 1 82 82 LYS C C 82 178.890 178.890 178.876 0.014 26021 11637 1 18 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.767 0.300 26021 11638 1 18 . 1 1 82 82 LYS CB C 82 32.587 32.587 31.870 0.717 26021 11639 1 18 . 1 1 82 82 LYS H H 82 8.079 8.079 7.990 0.089 26021 11640 1 18 . 1 1 83 83 PHE N N 83 120.900 120.900 118.923 1.977 26021 11641 1 18 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.373 -0.097 26021 11642 1 18 . 1 1 83 83 PHE C C 83 177.269 177.269 177.074 0.195 26021 11643 1 18 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.120 0.823 26021 11644 1 18 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.245 0.502 26021 11645 1 18 . 1 1 83 83 PHE H H 83 8.015 8.015 7.535 0.480 26021 11646 1 18 . 1 1 84 84 LEU N N 84 118.209 118.209 119.326 -1.117 26021 11647 1 18 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.003 -0.061 26021 11648 1 18 . 1 1 84 84 LEU C C 84 178.774 178.774 178.580 0.194 26021 11649 1 18 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.544 -0.374 26021 11650 1 18 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.813 0.380 26021 11651 1 18 . 1 1 84 84 LEU H H 84 8.338 8.338 7.255 1.083 26021 11652 1 18 . 1 1 85 85 VAL N N 85 116.078 116.078 118.313 -2.235 26021 11653 1 18 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.636 0.355 26021 11654 1 18 . 1 1 85 85 VAL C C 85 177.252 177.252 177.757 -0.505 26021 11655 1 18 . 1 1 85 85 VAL CA C 85 64.180 64.180 66.365 -2.185 26021 11656 1 18 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.376 0.514 26021 11657 1 18 . 1 1 85 85 VAL H H 85 7.447 7.447 8.416 -0.969 26021 11658 1 18 . 1 1 86 86 ARG N N 86 120.842 120.842 118.761 2.081 26021 11659 1 18 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.183 0.044 26021 11660 1 18 . 1 1 86 86 ARG C C 86 177.520 177.520 179.033 -1.513 26021 11661 1 18 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.026 -0.967 26021 11662 1 18 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.939 0.324 26021 11663 1 18 . 1 1 86 86 ARG H H 86 7.598 7.598 7.393 0.205 26021 11664 1 18 . 1 1 87 87 VAL N N 87 119.293 119.293 118.193 1.100 26021 11665 1 18 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.742 0.083 26021 11666 1 18 . 1 1 87 87 VAL C C 87 176.121 176.121 177.025 -0.904 26021 11667 1 18 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.407 -1.969 26021 11668 1 18 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.602 1.170 26021 11669 1 18 . 1 1 87 87 VAL H H 87 7.994 7.994 7.403 0.591 26021 11670 1 18 . 1 1 88 88 HIS N N 88 120.016 120.016 118.067 1.949 26021 11671 1 18 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.511 0.126 26021 11672 1 18 . 1 1 88 88 HIS C C 88 175.639 175.639 175.985 -0.346 26021 11673 1 18 . 1 1 88 88 HIS CA C 88 56.351 56.351 55.966 0.385 26021 11674 1 18 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.502 -0.821 26021 11675 1 18 . 1 1 88 88 HIS H H 88 7.969 7.969 8.209 -0.240 26021 11676 1 18 . 1 1 89 89 GLY N N 89 109.587 109.587 109.400 0.187 26021 11677 1 18 . 1 1 89 89 GLY C C 89 173.730 173.730 174.497 -0.767 26021 11678 1 18 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.615 -0.447 26021 11679 1 18 . 1 1 89 89 GLY H H 89 8.083 8.083 8.000 0.083 26021 11680 1 18 . 1 1 90 90 VAL N N 90 118.224 118.224 120.017 -1.793 26021 11681 1 18 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.068 0.070 26021 11682 1 18 . 1 1 90 90 VAL C C 90 176.018 176.018 175.879 0.139 26021 11683 1 18 . 1 1 90 90 VAL CA C 90 62.425 62.425 61.160 1.265 26021 11684 1 18 . 1 1 90 90 VAL CB C 90 32.616 32.616 32.515 0.101 26021 11685 1 18 . 1 1 90 90 VAL H H 90 7.944 7.944 7.551 0.393 26021 11686 1 18 . 1 1 91 91 GLU N N 91 124.313 124.313 124.262 0.051 26021 11687 1 18 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.412 0.194 26021 11688 1 18 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.141 0.035 26021 11689 1 18 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.710 1.050 26021 11690 1 18 . 1 1 91 91 GLU H H 91 8.423 8.423 8.362 0.061 26021 11691 1 18 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.440 -0.103 26021 11692 1 18 . 1 1 92 92 PRO C C 92 176.504 176.504 175.868 0.636 26021 11693 1 18 . 1 1 92 92 PRO CA C 92 63.372 63.372 62.879 0.493 26021 11694 1 18 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.329 -0.162 26021 11695 1 18 . 1 1 93 93 ASP N N 93 120.275 120.275 118.801 1.474 26021 11696 1 18 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.654 -0.082 26021 11697 1 18 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.816 0.154 26021 11698 1 18 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.078 -1.563 26021 11699 1 18 . 1 1 93 93 ASP H H 93 8.286 8.286 8.159 0.127 26021 11700 1 18 . 1 1 94 94 ASP N N 94 121.181 121.181 123.330 -2.149 26021 11701 1 18 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.777 -0.212 26021 11702 1 18 . 1 1 94 94 ASP C C 94 176.474 176.474 177.666 -1.192 26021 11703 1 18 . 1 1 94 94 ASP CA C 94 54.373 54.373 54.844 -0.471 26021 11704 1 18 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.923 -0.699 26021 11705 1 18 . 1 1 94 94 ASP H H 94 8.259 8.259 8.464 -0.205 26021 11706 1 18 . 1 1 95 95 ASN N N 95 118.728 118.728 119.786 -1.058 26021 11707 1 18 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.550 0.144 26021 11708 1 18 . 1 1 95 95 ASN C C 95 176.272 176.272 177.072 -0.800 26021 11709 1 18 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.835 -1.849 26021 11710 1 18 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.796 -0.067 26021 11711 1 18 . 1 1 95 95 ASN H H 95 8.474 8.474 8.234 0.240 26021 11712 1 18 . 1 1 96 96 THR N N 96 113.868 113.868 114.849 -0.981 26021 11713 1 18 . 1 1 96 96 THR HA H 96 4.220 4.220 4.178 0.042 26021 11714 1 18 . 1 1 96 96 THR C C 96 175.107 175.107 175.906 -0.799 26021 11715 1 18 . 1 1 96 96 THR CA C 96 63.200 63.200 64.719 -1.519 26021 11716 1 18 . 1 1 96 96 THR CB C 96 69.475 69.475 68.277 1.198 26021 11717 1 18 . 1 1 96 96 THR H H 96 8.263 8.263 8.273 -0.010 26021 11718 1 18 . 1 1 97 97 ASN N N 97 119.954 119.954 118.473 1.481 26021 11719 1 18 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.691 -0.075 26021 11720 1 18 . 1 1 97 97 ASN C C 97 176.275 176.275 176.372 -0.097 26021 11721 1 18 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.489 -0.533 26021 11722 1 18 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.531 0.161 26021 11723 1 18 . 1 1 97 97 ASN H H 97 8.431 8.431 7.904 0.527 26021 11724 1 18 . 1 1 98 98 GLY N N 98 108.847 108.847 106.933 1.914 26021 11725 1 18 . 1 1 98 98 GLY C C 98 175.533 175.533 175.277 0.256 26021 11726 1 18 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.019 -0.008 26021 11727 1 18 . 1 1 98 98 GLY H H 98 8.338 8.338 7.686 0.652 26021 11728 1 18 . 1 1 99 99 PHE N N 99 118.492 118.492 119.471 -0.979 26021 11729 1 18 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.097 0.151 26021 11730 1 18 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.175 0.784 26021 11731 1 18 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.218 -1.059 26021 11732 1 18 . 1 1 99 99 PHE H H 99 8.370 8.370 8.806 -0.436 26021 11733 1 18 . 1 1 100 100 LYS N N 100 120.987 120.987 119.697 1.290 26021 11734 1 18 . 1 1 100 100 LYS H H 100 8.256 8.256 8.393 -0.137 26021 11735 1 18 . 1 1 101 101 GLY N N 101 108.186 108.186 106.480 1.706 26021 11736 1 18 . 1 1 101 101 GLY C C 101 177.075 177.075 175.846 1.229 26021 11737 1 18 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.163 0.739 26021 11738 1 18 . 1 1 101 101 GLY H H 101 8.300 8.300 7.614 0.686 26021 11739 1 18 . 1 1 102 102 LEU N N 102 121.439 121.439 123.784 -2.345 26021 11740 1 18 . 1 1 102 102 LEU HA H 102 4.097 4.097 3.991 0.106 26021 11741 1 18 . 1 1 102 102 LEU C C 102 179.836 179.836 178.110 1.726 26021 11742 1 18 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.583 -0.225 26021 11743 1 18 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.935 -0.166 26021 11744 1 18 . 1 1 102 102 LEU H H 102 7.777 7.777 8.095 -0.318 26021 11745 1 18 . 1 1 103 103 MET N N 103 122.290 122.290 118.040 4.250 26021 11746 1 18 . 1 1 103 103 MET HA H 103 4.220 4.220 3.750 0.470 26021 11747 1 18 . 1 1 103 103 MET C C 103 177.739 177.739 177.820 -0.081 26021 11748 1 18 . 1 1 103 103 MET CA C 103 58.739 58.739 58.286 0.453 26021 11749 1 18 . 1 1 103 103 MET CB C 103 31.895 31.895 31.862 0.033 26021 11750 1 18 . 1 1 103 103 MET H H 103 8.409 8.409 8.080 0.329 26021 11751 1 18 . 1 1 104 104 LYS N N 104 119.750 119.750 117.962 1.788 26021 11752 1 18 . 1 1 104 104 LYS HA H 104 4.067 4.067 3.971 0.096 26021 11753 1 18 . 1 1 104 104 LYS C C 104 179.301 179.301 179.377 -0.076 26021 11754 1 18 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.689 1.075 26021 11755 1 18 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.660 0.387 26021 11756 1 18 . 1 1 104 104 LYS H H 104 7.916 7.916 7.497 0.419 26021 11757 1 18 . 1 1 105 105 ARG N N 105 117.967 117.967 119.498 -1.531 26021 11758 1 18 . 1 1 105 105 ARG HA H 105 4.026 4.026 3.950 0.076 26021 11759 1 18 . 1 1 105 105 ARG C C 105 178.777 178.777 178.629 0.148 26021 11760 1 18 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.853 -0.489 26021 11761 1 18 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.267 0.730 26021 11762 1 18 . 1 1 105 105 ARG H H 105 7.719 7.719 8.536 -0.817 26021 11763 1 18 . 1 1 106 106 THR N N 106 117.211 117.211 112.252 4.959 26021 11764 1 18 . 1 1 106 106 THR HA H 106 4.301 4.301 4.239 0.062 26021 11765 1 18 . 1 1 106 106 THR C C 106 176.254 176.254 176.305 -0.051 26021 11766 1 18 . 1 1 106 106 THR CA C 106 67.860 67.860 66.472 1.389 26021 11767 1 18 . 1 1 106 106 THR CB C 106 67.860 67.860 68.430 -0.570 26021 11768 1 18 . 1 1 106 106 THR H H 106 8.152 8.152 8.196 -0.044 26021 11769 1 18 . 1 1 107 107 THR N N 107 117.939 117.939 117.904 0.035 26021 11770 1 18 . 1 1 107 107 THR HA H 107 3.971 3.971 3.940 0.031 26021 11771 1 18 . 1 1 107 107 THR C C 107 176.780 176.780 176.694 0.086 26021 11772 1 18 . 1 1 107 107 THR CA C 107 66.822 66.822 66.829 -0.007 26021 11773 1 18 . 1 1 107 107 THR CB C 107 68.818 68.818 68.155 0.663 26021 11774 1 18 . 1 1 107 107 THR H H 107 8.651 8.651 8.321 0.330 26021 11775 1 18 . 1 1 108 108 LYS N N 108 120.867 120.867 120.597 0.270 26021 11776 1 18 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.136 -0.114 26021 11777 1 18 . 1 1 108 108 LYS C C 108 179.045 179.045 179.424 -0.379 26021 11778 1 18 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.600 1.234 26021 11779 1 18 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.003 0.470 26021 11780 1 18 . 1 1 108 108 LYS H H 108 7.694 7.694 7.845 -0.151 26021 11781 1 18 . 1 1 109 109 LEU N N 109 119.472 119.472 121.607 -2.135 26021 11782 1 18 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.189 0.132 26021 11783 1 18 . 1 1 109 109 LEU C C 109 179.974 179.974 179.173 0.801 26021 11784 1 18 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.626 -0.033 26021 11785 1 18 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.196 -0.336 26021 11786 1 18 . 1 1 109 109 LEU H H 109 7.559 7.559 7.764 -0.205 26021 11787 1 18 . 1 1 110 110 LEU N N 110 121.832 121.832 118.988 2.844 26021 11788 1 18 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.011 0.180 26021 11789 1 18 . 1 1 110 110 LEU C C 110 178.101 178.101 178.576 -0.475 26021 11790 1 18 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.830 0.062 26021 11791 1 18 . 1 1 110 110 LEU CB C 110 41.884 41.884 40.458 1.426 26021 11792 1 18 . 1 1 110 110 LEU H H 110 8.567 8.567 8.295 0.272 26021 11793 1 18 . 1 1 111 111 LYS N N 111 117.972 117.972 117.183 0.789 26021 11794 1 18 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.015 -0.036 26021 11795 1 18 . 1 1 111 111 LYS C C 111 177.677 177.677 178.240 -0.563 26021 11796 1 18 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.720 0.065 26021 11797 1 18 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.814 0.394 26021 11798 1 18 . 1 1 111 111 LYS H H 111 7.965 7.965 7.678 0.287 26021 11799 1 18 . 1 1 112 112 LYS N N 112 115.433 115.433 116.825 -1.392 26021 11800 1 18 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.163 -0.053 26021 11801 1 18 . 1 1 112 112 LYS C C 112 178.270 178.270 178.350 -0.080 26021 11802 1 18 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.178 0.773 26021 11803 1 18 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.549 0.242 26021 11804 1 18 . 1 1 112 112 LYS H H 112 7.334 7.334 7.904 -0.570 26021 11805 1 18 . 1 1 113 113 VAL N N 113 114.861 114.861 119.009 -4.148 26021 11806 1 18 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.750 0.081 26021 11807 1 18 . 1 1 113 113 VAL C C 113 176.999 176.999 177.253 -0.254 26021 11808 1 18 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.471 -1.966 26021 11809 1 18 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.054 0.233 26021 11810 1 18 . 1 1 113 113 VAL H H 113 7.298 7.298 7.202 0.096 26021 11811 1 18 . 1 1 114 114 VAL N N 114 121.457 121.457 119.261 2.196 26021 11812 1 18 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.736 -0.014 26021 11813 1 18 . 1 1 114 114 VAL C C 114 177.737 177.737 177.061 0.676 26021 11814 1 18 . 1 1 114 114 VAL CA C 114 65.224 65.224 65.274 -0.050 26021 11815 1 18 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.459 0.294 26021 11816 1 18 . 1 1 114 114 VAL H H 114 7.855 7.855 8.379 -0.524 26021 11817 1 18 . 1 1 115 115 ASP N N 115 120.804 120.804 120.408 0.396 26021 11818 1 18 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.453 0.002 26021 11819 1 18 . 1 1 115 115 ASP C C 115 177.380 177.380 177.580 -0.200 26021 11820 1 18 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.791 -0.870 26021 11821 1 18 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.806 -0.434 26021 11822 1 18 . 1 1 115 115 ASP H H 115 8.311 8.311 8.425 -0.114 26021 11823 1 18 . 1 1 116 116 LYS N N 116 119.582 119.582 118.023 1.559 26021 11824 1 18 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.339 -0.244 26021 11825 1 18 . 1 1 116 116 LYS C C 116 177.077 177.077 178.711 -1.634 26021 11826 1 18 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.472 0.238 26021 11827 1 18 . 1 1 116 116 LYS CB C 116 33.488 33.488 32.822 0.666 26021 11828 1 18 . 1 1 116 116 LYS H H 116 7.639 7.639 7.989 -0.350 26021 11829 1 18 . 1 1 117 117 HIS N N 117 115.246 115.246 117.231 -1.985 26021 11830 1 18 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.392 0.233 26021 11831 1 18 . 1 1 117 117 HIS C C 117 175.497 175.497 176.597 -1.100 26021 11832 1 18 . 1 1 117 117 HIS CA C 117 56.175 56.175 57.426 -1.251 26021 11833 1 18 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.491 -0.016 26021 11834 1 18 . 1 1 117 117 HIS H H 117 8.108 8.108 7.975 0.133 26021 11835 1 18 . 1 1 118 118 GLY N N 118 109.944 109.944 107.825 2.119 26021 11836 1 18 . 1 1 118 118 GLY C C 118 174.093 174.093 174.782 -0.689 26021 11837 1 18 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.579 0.485 26021 11838 1 18 . 1 1 118 118 GLY H H 118 8.153 8.153 7.914 0.239 26021 11839 1 18 . 1 1 119 119 ILE N N 119 118.468 118.468 122.574 -4.106 26021 11840 1 18 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.837 0.285 26021 11841 1 18 . 1 1 119 119 ILE C C 119 174.777 174.777 174.882 -0.105 26021 11842 1 18 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.359 -0.258 26021 11843 1 18 . 1 1 119 119 ILE CB C 119 38.631 38.631 35.311 3.320 26021 11844 1 18 . 1 1 119 119 ILE H H 119 7.828 7.828 7.457 0.371 26021 11845 1 19 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.534 0.215 26021 11846 1 19 . 1 1 4 4 ASN C C 4 175.260 175.260 175.627 -0.367 26021 11847 1 19 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.362 -0.531 26021 11848 1 19 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.565 0.116 26021 11849 1 19 . 1 1 5 5 ALA N N 5 123.648 123.648 120.231 3.417 26021 11850 1 19 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.650 -0.360 26021 11851 1 19 . 1 1 5 5 ALA C C 5 178.256 178.256 178.910 -0.654 26021 11852 1 19 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.757 1.324 26021 11853 1 19 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.975 0.050 26021 11854 1 19 . 1 1 5 5 ALA H H 5 8.520 8.520 8.162 0.358 26021 11855 1 19 . 1 1 6 6 GLY N N 6 107.044 107.044 108.962 -1.918 26021 11856 1 19 . 1 1 6 6 GLY C C 6 174.961 174.961 175.525 -0.564 26021 11857 1 19 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.860 -1.030 26021 11858 1 19 . 1 1 6 6 GLY H H 6 8.350 8.350 8.284 0.066 26021 11859 1 19 . 1 1 7 7 ALA N N 7 123.366 123.366 124.059 -0.693 26021 11860 1 19 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.034 0.182 26021 11861 1 19 . 1 1 7 7 ALA C C 7 179.006 179.006 179.412 -0.406 26021 11862 1 19 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.992 -1.289 26021 11863 1 19 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.312 0.531 26021 11864 1 19 . 1 1 7 7 ALA H H 7 8.078 8.078 7.997 0.081 26021 11865 1 19 . 1 1 8 8 ILE N N 8 117.376 117.376 118.523 -1.147 26021 11866 1 19 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.690 0.090 26021 11867 1 19 . 1 1 8 8 ILE C C 8 177.032 177.032 178.295 -1.263 26021 11868 1 19 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.783 -1.625 26021 11869 1 19 . 1 1 8 8 ILE CB C 8 36.289 36.289 37.585 -1.296 26021 11870 1 19 . 1 1 8 8 ILE H H 8 7.943 7.943 7.911 0.032 26021 11871 1 19 . 1 1 9 9 ALA N N 9 121.414 121.414 122.327 -0.913 26021 11872 1 19 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.032 -0.099 26021 11873 1 19 . 1 1 9 9 ALA C C 9 180.515 180.515 179.090 1.425 26021 11874 1 19 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.707 0.391 26021 11875 1 19 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.147 0.014 26021 11876 1 19 . 1 1 9 9 ALA H H 9 8.062 8.062 7.869 0.193 26021 11877 1 19 . 1 1 10 10 LYS N N 10 114.594 114.594 119.013 -4.419 26021 11878 1 19 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.120 0.044 26021 11879 1 19 . 1 1 10 10 LYS C C 10 178.099 178.099 178.104 -0.005 26021 11880 1 19 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.470 -0.630 26021 11881 1 19 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.316 0.153 26021 11882 1 19 . 1 1 10 10 LYS H H 10 7.554 7.554 7.835 -0.281 26021 11883 1 19 . 1 1 11 11 LEU N N 11 119.662 119.662 118.457 1.205 26021 11884 1 19 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.175 -0.097 26021 11885 1 19 . 1 1 11 11 LEU C C 11 177.930 177.930 178.061 -0.131 26021 11886 1 19 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.215 0.341 26021 11887 1 19 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.852 1.236 26021 11888 1 19 . 1 1 11 11 LEU H H 11 7.814 7.814 7.360 0.454 26021 11889 1 19 . 1 1 12 12 ILE N N 12 117.945 117.945 120.685 -2.740 26021 11890 1 19 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.910 -0.218 26021 11891 1 19 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.211 1.418 26021 11892 1 19 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.693 1.717 26021 11893 1 19 . 1 1 12 12 ILE H H 12 7.426 7.426 7.584 -0.158 26021 11894 1 19 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.283 0.120 26021 11895 1 19 . 1 1 13 13 PRO C C 13 179.030 179.030 178.923 0.107 26021 11896 1 19 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.387 -0.143 26021 11897 1 19 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.029 -0.220 26021 11898 1 19 . 1 1 14 14 LYS N N 14 117.855 117.855 118.748 -0.893 26021 11899 1 19 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.050 0.095 26021 11900 1 19 . 1 1 14 14 LYS C C 14 178.565 178.565 178.647 -0.082 26021 11901 1 19 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.703 -0.270 26021 11902 1 19 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.121 0.804 26021 11903 1 19 . 1 1 14 14 LYS H H 14 6.685 6.685 7.367 -0.682 26021 11904 1 19 . 1 1 15 15 LEU N N 15 118.008 118.008 117.256 0.752 26021 11905 1 19 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.337 -0.334 26021 11906 1 19 . 1 1 15 15 LEU C C 15 178.662 178.662 179.142 -0.480 26021 11907 1 19 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.858 0.854 26021 11908 1 19 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.246 -0.247 26021 11909 1 19 . 1 1 15 15 LEU H H 15 8.148 8.148 7.580 0.568 26021 11910 1 19 . 1 1 16 16 GLY N N 16 103.895 103.895 107.911 -4.016 26021 11911 1 19 . 1 1 16 16 GLY C C 16 176.838 176.838 175.573 1.265 26021 11912 1 19 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.022 0.343 26021 11913 1 19 . 1 1 16 16 GLY H H 16 8.104 8.104 8.053 0.051 26021 11914 1 19 . 1 1 17 17 GLU N N 17 121.655 121.655 121.619 0.036 26021 11915 1 19 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.091 0.042 26021 11916 1 19 . 1 1 17 17 GLU C C 17 179.007 179.007 178.649 0.358 26021 11917 1 19 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.026 -0.215 26021 11918 1 19 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.644 -0.511 26021 11919 1 19 . 1 1 17 17 GLU H H 17 7.817 7.817 7.878 -0.062 26021 11920 1 19 . 1 1 18 18 LEU N N 18 117.834 117.834 117.499 0.335 26021 11921 1 19 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.087 0.031 26021 11922 1 19 . 1 1 18 18 LEU C C 18 177.658 177.658 178.026 -0.368 26021 11923 1 19 . 1 1 18 18 LEU CA C 18 57.029 57.029 56.740 0.289 26021 11924 1 19 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.454 0.216 26021 11925 1 19 . 1 1 18 18 LEU H H 18 7.389 7.389 7.879 -0.490 26021 11926 1 19 . 1 1 19 19 LEU N N 19 113.694 113.694 116.910 -3.216 26021 11927 1 19 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.252 -0.090 26021 11928 1 19 . 1 1 19 19 LEU C C 19 178.123 178.123 178.010 0.113 26021 11929 1 19 . 1 1 19 19 LEU CA C 19 55.852 55.852 56.121 -0.269 26021 11930 1 19 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.316 -0.096 26021 11931 1 19 . 1 1 19 19 LEU H H 19 7.269 7.269 7.416 -0.147 26021 11932 1 19 . 1 1 20 20 VAL N N 20 112.778 112.778 118.054 -5.276 26021 11933 1 19 . 1 1 20 20 VAL HA H 20 4.443 4.443 3.991 0.452 26021 11934 1 19 . 1 1 20 20 VAL C C 20 177.021 177.021 176.985 0.036 26021 11935 1 19 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.981 -2.126 26021 11936 1 19 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.607 0.171 26021 11937 1 19 . 1 1 20 20 VAL H H 20 7.356 7.356 7.214 0.142 26021 11938 1 19 . 1 1 21 21 GLY N N 21 108.962 108.962 107.890 1.072 26021 11939 1 19 . 1 1 21 21 GLY C C 21 173.813 173.813 174.308 -0.495 26021 11940 1 19 . 1 1 21 21 GLY CA C 21 45.046 45.046 45.091 -0.045 26021 11941 1 19 . 1 1 21 21 GLY H H 21 7.925 7.925 7.792 0.133 26021 11942 1 19 . 1 1 22 22 GLU N N 22 120.607 120.607 124.770 -4.163 26021 11943 1 19 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.426 -0.148 26021 11944 1 19 . 1 1 22 22 GLU C C 22 175.869 175.869 175.422 0.447 26021 11945 1 19 . 1 1 22 22 GLU CA C 22 56.030 56.030 56.402 -0.372 26021 11946 1 19 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.959 -0.278 26021 11947 1 19 . 1 1 22 22 GLU H H 22 8.300 8.300 8.155 0.145 26021 11948 1 19 . 1 1 23 23 TYR N N 23 120.738 120.738 118.465 2.273 26021 11949 1 19 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.249 -0.692 26021 11950 1 19 . 1 1 23 23 TYR C C 23 175.264 175.264 173.946 1.318 26021 11951 1 19 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.169 0.393 26021 11952 1 19 . 1 1 23 23 TYR CB C 23 39.246 39.246 40.283 -1.037 26021 11953 1 19 . 1 1 23 23 TYR H H 23 7.756 7.756 8.138 -0.382 26021 11954 1 19 . 1 1 24 24 LYS N N 24 122.095 122.095 124.258 -2.163 26021 11955 1 19 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.304 -0.121 26021 11956 1 19 . 1 1 24 24 LYS C C 24 175.742 175.742 175.011 0.731 26021 11957 1 19 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.616 0.502 26021 11958 1 19 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.568 0.151 26021 11959 1 19 . 1 1 24 24 LYS H H 24 8.692 8.692 8.644 0.048 26021 11960 1 19 . 1 1 25 25 LEU N N 25 121.123 121.123 119.500 1.623 26021 11961 1 19 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.654 -0.162 26021 11962 1 19 . 1 1 25 25 LEU C C 25 177.487 177.487 176.051 1.436 26021 11963 1 19 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.078 1.256 26021 11964 1 19 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.759 -1.001 26021 11965 1 19 . 1 1 25 25 LEU H H 25 8.088 8.088 7.414 0.674 26021 11966 1 19 . 1 1 26 26 HIS N N 26 122.993 122.993 118.847 4.146 26021 11967 1 19 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.605 -0.104 26021 11968 1 19 . 1 1 26 26 HIS C C 26 176.716 176.716 176.328 0.388 26021 11969 1 19 . 1 1 26 26 HIS CA C 26 57.197 57.197 55.796 1.401 26021 11970 1 19 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.665 0.693 26021 11971 1 19 . 1 1 26 26 HIS H H 26 8.882 8.882 8.594 0.288 26021 11972 1 19 . 1 1 27 27 LYS N N 27 124.894 124.894 121.576 3.318 26021 11973 1 19 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.355 -0.407 26021 11974 1 19 . 1 1 27 27 LYS C C 27 178.873 178.873 178.618 0.255 26021 11975 1 19 . 1 1 27 27 LYS CA C 27 60.011 60.011 59.245 0.767 26021 11976 1 19 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.528 -0.086 26021 11977 1 19 . 1 1 27 27 LYS H H 27 8.699 8.699 8.431 0.268 26021 11978 1 19 . 1 1 28 28 GLY N N 28 111.258 111.258 105.935 5.323 26021 11979 1 19 . 1 1 28 28 GLY C C 28 176.131 176.131 175.763 0.368 26021 11980 1 19 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.199 0.291 26021 11981 1 19 . 1 1 28 28 GLY H H 28 9.814 9.814 8.550 1.264 26021 11982 1 19 . 1 1 29 29 VAL N N 29 122.719 122.719 122.390 0.329 26021 11983 1 19 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.759 0.133 26021 11984 1 19 . 1 1 29 29 VAL C C 29 177.628 177.628 178.056 -0.428 26021 11985 1 19 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.137 0.383 26021 11986 1 19 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.777 -0.035 26021 11987 1 19 . 1 1 29 29 VAL H H 29 7.431 7.431 7.226 0.205 26021 11988 1 19 . 1 1 30 30 LYS N N 30 119.791 119.791 119.858 -0.067 26021 11989 1 19 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.727 -0.092 26021 11990 1 19 . 1 1 30 30 LYS C C 30 177.666 177.666 178.298 -0.632 26021 11991 1 19 . 1 1 30 30 LYS CA C 30 61.024 61.024 58.964 2.060 26021 11992 1 19 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.207 1.198 26021 11993 1 19 . 1 1 30 30 LYS H H 30 8.255 8.255 7.485 0.770 26021 11994 1 19 . 1 1 31 31 LYS N N 31 117.918 117.918 117.724 0.194 26021 11995 1 19 . 1 1 31 31 LYS HA H 31 4.116 4.116 3.978 0.138 26021 11996 1 19 . 1 1 31 31 LYS C C 31 177.784 177.784 178.509 -0.725 26021 11997 1 19 . 1 1 31 31 LYS CA C 31 58.703 58.703 58.974 -0.271 26021 11998 1 19 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.876 -0.031 26021 11999 1 19 . 1 1 31 31 LYS H H 31 7.689 7.689 7.422 0.267 26021 12000 1 19 . 1 1 32 32 ASN N N 32 116.347 116.347 117.306 -0.959 26021 12001 1 19 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.554 -0.034 26021 12002 1 19 . 1 1 32 32 ASN C C 32 177.764 177.764 176.872 0.892 26021 12003 1 19 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.408 0.907 26021 12004 1 19 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.503 0.129 26021 12005 1 19 . 1 1 32 32 ASN H H 32 7.556 7.556 7.685 -0.129 26021 12006 1 19 . 1 1 33 33 ILE N N 33 120.592 120.592 120.303 0.289 26021 12007 1 19 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.692 -0.410 26021 12008 1 19 . 1 1 33 33 ILE C C 33 177.074 177.074 177.516 -0.442 26021 12009 1 19 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.511 2.377 26021 12010 1 19 . 1 1 33 33 ILE CB C 33 37.178 37.178 36.488 0.690 26021 12011 1 19 . 1 1 33 33 ILE H H 33 8.236 8.236 7.228 1.008 26021 12012 1 19 . 1 1 34 34 GLU N N 34 120.595 120.595 119.720 0.875 26021 12013 1 19 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.888 -0.100 26021 12014 1 19 . 1 1 34 34 GLU C C 34 179.739 179.739 178.741 0.998 26021 12015 1 19 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.602 0.637 26021 12016 1 19 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.835 1.010 26021 12017 1 19 . 1 1 34 34 GLU H H 34 8.551 8.551 7.878 0.673 26021 12018 1 19 . 1 1 35 35 ASP N N 35 120.600 120.600 120.867 -0.267 26021 12019 1 19 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.451 -0.039 26021 12020 1 19 . 1 1 35 35 ASP C C 35 178.681 178.681 178.644 0.037 26021 12021 1 19 . 1 1 35 35 ASP CA C 35 57.462 57.462 57.016 0.446 26021 12022 1 19 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.469 -0.719 26021 12023 1 19 . 1 1 35 35 ASP H H 35 8.670 8.670 8.124 0.546 26021 12024 1 19 . 1 1 36 36 LEU N N 36 123.004 123.004 120.984 2.020 26021 12025 1 19 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.372 -0.277 26021 12026 1 19 . 1 1 36 36 LEU C C 36 178.035 178.035 179.596 -1.561 26021 12027 1 19 . 1 1 36 36 LEU CA C 36 58.028 58.028 58.332 -0.304 26021 12028 1 19 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.053 -0.177 26021 12029 1 19 . 1 1 36 36 LEU H H 36 8.166 8.166 7.566 0.600 26021 12030 1 19 . 1 1 37 37 LEU N N 37 120.178 120.178 119.303 0.875 26021 12031 1 19 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.075 -0.219 26021 12032 1 19 . 1 1 37 37 LEU C C 37 178.128 178.128 178.156 -0.028 26021 12033 1 19 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.612 1.063 26021 12034 1 19 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.505 0.650 26021 12035 1 19 . 1 1 37 37 LEU H H 37 8.736 8.736 8.068 0.668 26021 12036 1 19 . 1 1 38 38 LYS N N 38 118.110 118.110 119.885 -1.775 26021 12037 1 19 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.888 0.045 26021 12038 1 19 . 1 1 38 38 LYS C C 38 179.533 179.533 178.578 0.955 26021 12039 1 19 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.236 0.037 26021 12040 1 19 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.295 -0.018 26021 12041 1 19 . 1 1 38 38 LYS H H 38 7.770 7.770 8.097 -0.327 26021 12042 1 19 . 1 1 39 39 GLU N N 39 119.265 119.265 118.802 0.463 26021 12043 1 19 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.189 0.113 26021 12044 1 19 . 1 1 39 39 GLU C C 39 179.720 179.720 179.185 0.535 26021 12045 1 19 . 1 1 39 39 GLU CA C 39 58.758 58.758 58.689 0.069 26021 12046 1 19 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.411 0.179 26021 12047 1 19 . 1 1 39 39 GLU H H 39 7.709 7.709 8.058 -0.349 26021 12048 1 19 . 1 1 40 40 LEU N N 40 119.007 119.007 121.570 -2.563 26021 12049 1 19 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.169 -0.119 26021 12050 1 19 . 1 1 40 40 LEU C C 40 179.690 179.690 179.000 0.690 26021 12051 1 19 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.337 0.314 26021 12052 1 19 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.115 0.570 26021 12053 1 19 . 1 1 40 40 LEU H H 40 8.851 8.851 8.046 0.805 26021 12054 1 19 . 1 1 41 41 LYS N N 41 120.500 120.500 119.452 1.048 26021 12055 1 19 . 1 1 41 41 LYS HA H 41 3.952 3.952 3.993 -0.041 26021 12056 1 19 . 1 1 41 41 LYS C C 41 180.223 180.223 178.834 1.389 26021 12057 1 19 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.877 1.014 26021 12058 1 19 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.150 -0.083 26021 12059 1 19 . 1 1 41 41 LYS H H 41 8.482 8.482 8.579 -0.097 26021 12060 1 19 . 1 1 42 42 THR N N 42 119.555 119.555 112.150 7.405 26021 12061 1 19 . 1 1 42 42 THR HA H 42 4.000 4.000 4.054 -0.054 26021 12062 1 19 . 1 1 42 42 THR C C 42 176.633 176.633 176.956 -0.323 26021 12063 1 19 . 1 1 42 42 THR CA C 42 66.574 66.574 65.644 0.930 26021 12064 1 19 . 1 1 42 42 THR CB C 42 67.924 67.924 68.354 -0.430 26021 12065 1 19 . 1 1 42 42 THR H H 42 7.863 7.863 7.638 0.225 26021 12066 1 19 . 1 1 43 43 MET N N 43 122.839 122.839 121.788 1.051 26021 12067 1 19 . 1 1 43 43 MET HA H 43 4.022 4.022 4.144 -0.122 26021 12068 1 19 . 1 1 43 43 MET C C 43 177.290 177.290 177.911 -0.621 26021 12069 1 19 . 1 1 43 43 MET CA C 43 59.731 59.731 59.535 0.196 26021 12070 1 19 . 1 1 43 43 MET CB C 43 33.610 33.610 32.490 1.120 26021 12071 1 19 . 1 1 43 43 MET H H 43 8.714 8.714 7.754 0.960 26021 12072 1 19 . 1 1 44 44 ASN N N 44 118.049 118.049 118.154 -0.105 26021 12073 1 19 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.297 0.077 26021 12074 1 19 . 1 1 44 44 ASN C C 44 176.297 176.297 177.437 -1.140 26021 12075 1 19 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.406 0.489 26021 12076 1 19 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.956 0.450 26021 12077 1 19 . 1 1 44 44 ASN H H 44 8.988 8.988 8.352 0.636 26021 12078 1 19 . 1 1 45 45 ALA N N 45 119.260 119.260 121.302 -2.042 26021 12079 1 19 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.200 -0.134 26021 12080 1 19 . 1 1 45 45 ALA C C 45 180.476 180.476 179.834 0.642 26021 12081 1 19 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.346 0.922 26021 12082 1 19 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.408 -0.720 26021 12083 1 19 . 1 1 45 45 ALA H H 45 7.675 7.675 8.026 -0.351 26021 12084 1 19 . 1 1 46 46 ALA N N 46 121.126 121.126 123.389 -2.263 26021 12085 1 19 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.085 0.031 26021 12086 1 19 . 1 1 46 46 ALA C C 46 179.314 179.314 179.187 0.127 26021 12087 1 19 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.003 -0.017 26021 12088 1 19 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.345 -0.123 26021 12089 1 19 . 1 1 46 46 ALA H H 46 7.872 7.872 7.689 0.183 26021 12090 1 19 . 1 1 47 47 LEU N N 47 119.328 119.328 115.104 4.224 26021 12091 1 19 . 1 1 47 47 LEU HA H 47 4.191 4.191 3.947 0.244 26021 12092 1 19 . 1 1 47 47 LEU C C 47 180.403 180.403 177.962 2.441 26021 12093 1 19 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.814 0.232 26021 12094 1 19 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.510 0.440 26021 12095 1 19 . 1 1 47 47 LEU H H 47 8.529 8.529 7.590 0.939 26021 12096 1 19 . 1 1 48 48 ILE N N 48 121.653 121.653 119.087 2.566 26021 12097 1 19 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.767 -0.065 26021 12098 1 19 . 1 1 48 48 ILE C C 48 178.730 178.730 178.714 0.016 26021 12099 1 19 . 1 1 48 48 ILE CA C 48 64.910 64.910 63.186 1.724 26021 12100 1 19 . 1 1 48 48 ILE CB C 48 37.912 37.912 36.656 1.256 26021 12101 1 19 . 1 1 48 48 ILE H H 48 8.386 8.386 7.711 0.675 26021 12102 1 19 . 1 1 49 49 LYS N N 49 119.896 119.896 120.268 -0.372 26021 12103 1 19 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.121 -0.078 26021 12104 1 19 . 1 1 49 49 LYS C C 49 179.999 179.999 179.182 0.817 26021 12105 1 19 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.245 -0.188 26021 12106 1 19 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.598 -0.637 26021 12107 1 19 . 1 1 49 49 LYS H H 49 7.456 7.456 7.551 -0.095 26021 12108 1 19 . 1 1 50 50 ILE N N 50 119.964 119.964 114.709 5.255 26021 12109 1 19 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.042 -0.306 26021 12110 1 19 . 1 1 50 50 ILE C C 50 177.960 177.960 176.992 0.968 26021 12111 1 19 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.049 1.300 26021 12112 1 19 . 1 1 50 50 ILE CB C 50 38.132 38.132 38.103 0.029 26021 12113 1 19 . 1 1 50 50 ILE H H 50 8.154 8.154 8.360 -0.206 26021 12114 1 19 . 1 1 51 51 GLY N N 51 106.709 106.709 105.617 1.092 26021 12115 1 19 . 1 1 51 51 GLY C C 51 174.461 174.461 174.814 -0.353 26021 12116 1 19 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.284 0.625 26021 12117 1 19 . 1 1 51 51 GLY H H 51 7.932 7.932 7.534 0.398 26021 12118 1 19 . 1 1 52 52 GLU N N 52 118.736 118.736 119.964 -1.228 26021 12119 1 19 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.269 0.051 26021 12120 1 19 . 1 1 52 52 GLU C C 52 176.789 176.789 177.344 -0.555 26021 12121 1 19 . 1 1 52 52 GLU CA C 52 56.274 56.274 56.911 -0.637 26021 12122 1 19 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.110 0.002 26021 12123 1 19 . 1 1 52 52 GLU H H 52 7.597 7.597 7.626 -0.029 26021 12124 1 19 . 1 1 53 53 VAL N N 53 122.982 122.982 119.081 3.901 26021 12125 1 19 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.051 0.210 26021 12126 1 19 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.958 0.427 26021 12127 1 19 . 1 1 53 53 VAL CB C 53 32.822 32.822 30.764 2.058 26021 12128 1 19 . 1 1 53 53 VAL H H 53 7.511 7.511 7.449 0.062 26021 12129 1 19 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.780 -0.135 26021 12130 1 19 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.517 0.061 26021 12131 1 19 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.020 0.514 26021 12132 1 19 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.337 -0.146 26021 12133 1 19 . 1 1 55 55 PRO C C 55 178.258 178.258 176.810 1.448 26021 12134 1 19 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.278 1.150 26021 12135 1 19 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.956 -0.110 26021 12136 1 19 . 1 1 56 56 ASP N N 56 114.117 114.117 116.736 -2.619 26021 12137 1 19 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.537 -0.046 26021 12138 1 19 . 1 1 56 56 ASP C C 56 176.696 176.696 177.449 -0.753 26021 12139 1 19 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.656 -0.518 26021 12140 1 19 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.992 -1.266 26021 12141 1 19 . 1 1 56 56 ASP H H 56 8.489 8.489 8.464 0.025 26021 12142 1 19 . 1 1 57 57 GLN N N 57 117.641 117.641 116.218 1.423 26021 12143 1 19 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.378 -0.004 26021 12144 1 19 . 1 1 57 57 GLN C C 57 175.765 175.765 176.252 -0.487 26021 12145 1 19 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.879 -0.589 26021 12146 1 19 . 1 1 57 57 GLN CB C 57 29.646 29.646 30.312 -0.666 26021 12147 1 19 . 1 1 57 57 GLN H H 57 8.206 8.206 7.531 0.675 26021 12148 1 19 . 1 1 58 58 LEU N N 58 122.141 122.141 122.804 -0.663 26021 12149 1 19 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.144 0.306 26021 12150 1 19 . 1 1 58 58 LEU C C 58 176.849 176.849 176.609 0.240 26021 12151 1 19 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.881 -0.886 26021 12152 1 19 . 1 1 58 58 LEU CB C 58 43.231 43.231 40.892 2.338 26021 12153 1 19 . 1 1 58 58 LEU H H 58 7.152 7.152 7.385 -0.233 26021 12154 1 19 . 1 1 59 59 ASP N N 59 125.643 125.643 127.405 -1.762 26021 12155 1 19 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.974 -0.255 26021 12156 1 19 . 1 1 59 59 ASP C C 59 177.249 177.249 177.069 0.180 26021 12157 1 19 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.962 0.440 26021 12158 1 19 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.741 -1.509 26021 12159 1 19 . 1 1 59 59 ASP H H 59 9.312 9.312 8.145 1.167 26021 12160 1 19 . 1 1 60 60 SER N N 60 116.550 116.550 115.576 0.974 26021 12161 1 19 . 1 1 60 60 SER HA H 60 4.124 4.124 4.143 -0.019 26021 12162 1 19 . 1 1 60 60 SER C C 60 176.840 176.840 175.980 0.860 26021 12163 1 19 . 1 1 60 60 SER CA C 60 61.722 61.722 61.174 0.548 26021 12164 1 19 . 1 1 60 60 SER CB C 60 62.815 62.815 63.305 -0.490 26021 12165 1 19 . 1 1 60 60 SER H H 60 8.647 8.647 8.686 -0.039 26021 12166 1 19 . 1 1 61 61 GLN N N 61 121.394 121.394 120.706 0.688 26021 12167 1 19 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.200 -0.069 26021 12168 1 19 . 1 1 61 61 GLN C C 61 178.629 178.629 177.326 1.303 26021 12169 1 19 . 1 1 61 61 GLN CA C 61 58.753 58.753 57.953 0.800 26021 12170 1 19 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.398 -0.144 26021 12171 1 19 . 1 1 61 61 GLN H H 61 8.453 8.453 7.978 0.475 26021 12172 1 19 . 1 1 62 62 ASP N N 62 122.187 122.187 121.048 1.139 26021 12173 1 19 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.469 0.150 26021 12174 1 19 . 1 1 62 62 ASP C C 62 178.318 178.318 178.231 0.087 26021 12175 1 19 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.917 -0.455 26021 12176 1 19 . 1 1 62 62 ASP CB C 62 41.036 41.036 41.046 -0.010 26021 12177 1 19 . 1 1 62 62 ASP H H 62 8.311 8.311 8.187 0.124 26021 12178 1 19 . 1 1 63 63 LYS N N 63 120.325 120.325 118.164 2.161 26021 12179 1 19 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.139 -0.130 26021 12180 1 19 . 1 1 63 63 LYS C C 63 178.765 178.765 178.957 -0.192 26021 12181 1 19 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.919 0.834 26021 12182 1 19 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.026 0.427 26021 12183 1 19 . 1 1 63 63 LYS H H 63 7.923 7.923 7.632 0.291 26021 12184 1 19 . 1 1 64 64 LEU N N 64 119.491 119.491 120.122 -0.631 26021 12185 1 19 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.128 0.098 26021 12186 1 19 . 1 1 64 64 LEU C C 64 179.526 179.526 179.074 0.452 26021 12187 1 19 . 1 1 64 64 LEU CA C 64 57.798 57.798 58.102 -0.304 26021 12188 1 19 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.675 0.100 26021 12189 1 19 . 1 1 64 64 LEU H H 64 7.820 7.820 7.389 0.431 26021 12190 1 19 . 1 1 65 65 TRP N N 65 120.674 120.674 121.458 -0.784 26021 12191 1 19 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.329 -0.021 26021 12192 1 19 . 1 1 65 65 TRP C C 65 177.379 177.379 177.375 0.004 26021 12193 1 19 . 1 1 65 65 TRP CA C 65 61.802 61.802 59.766 2.036 26021 12194 1 19 . 1 1 65 65 TRP CB C 65 28.411 28.411 29.059 -0.648 26021 12195 1 19 . 1 1 65 65 TRP H H 65 8.196 8.196 8.311 -0.115 26021 12196 1 19 . 1 1 66 66 ALA N N 66 120.606 120.606 120.461 0.145 26021 12197 1 19 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.481 0.228 26021 12198 1 19 . 1 1 66 66 ALA C C 66 180.376 180.376 179.328 1.048 26021 12199 1 19 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.815 0.749 26021 12200 1 19 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.832 -0.178 26021 12201 1 19 . 1 1 66 66 ALA H H 66 8.305 8.305 7.569 0.736 26021 12202 1 19 . 1 1 67 67 ASP N N 67 119.175 119.175 117.381 1.794 26021 12203 1 19 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.371 0.079 26021 12204 1 19 . 1 1 67 67 ASP C C 67 178.757 178.757 177.902 0.855 26021 12205 1 19 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.627 0.865 26021 12206 1 19 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.834 -0.680 26021 12207 1 19 . 1 1 67 67 ASP H H 67 7.945 7.945 7.805 0.140 26021 12208 1 19 . 1 1 68 68 GLU N N 68 122.322 122.322 119.131 3.191 26021 12209 1 19 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.254 -0.239 26021 12210 1 19 . 1 1 68 68 GLU C C 68 180.055 180.055 179.045 1.010 26021 12211 1 19 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.514 0.596 26021 12212 1 19 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.483 0.164 26021 12213 1 19 . 1 1 68 68 GLU H H 68 8.168 8.168 7.956 0.212 26021 12214 1 19 . 1 1 69 69 VAL N N 69 122.135 122.135 117.058 5.077 26021 12215 1 19 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.807 -0.555 26021 12216 1 19 . 1 1 69 69 VAL C C 69 177.736 177.736 178.018 -0.282 26021 12217 1 19 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.659 0.880 26021 12218 1 19 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.094 0.148 26021 12219 1 19 . 1 1 69 69 VAL H H 69 8.424 8.424 7.277 1.147 26021 12220 1 19 . 1 1 70 70 ARG N N 70 121.373 121.373 120.013 1.360 26021 12221 1 19 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.079 -0.387 26021 12222 1 19 . 1 1 70 70 ARG C C 70 179.117 179.117 179.087 0.030 26021 12223 1 19 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.719 1.446 26021 12224 1 19 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.781 -0.127 26021 12225 1 19 . 1 1 70 70 ARG H H 70 7.916 7.916 7.392 0.524 26021 12226 1 19 . 1 1 71 71 GLU N N 71 119.075 119.075 119.882 -0.807 26021 12227 1 19 . 1 1 71 71 GLU HA H 71 4.063 4.063 4.086 -0.023 26021 12228 1 19 . 1 1 71 71 GLU C C 71 179.119 179.119 179.332 -0.213 26021 12229 1 19 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.116 0.571 26021 12230 1 19 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.749 0.521 26021 12231 1 19 . 1 1 71 71 GLU H H 71 8.031 8.031 8.461 -0.430 26021 12232 1 19 . 1 1 72 72 LEU N N 72 120.503 120.503 119.907 0.596 26021 12233 1 19 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.181 -0.123 26021 12234 1 19 . 1 1 72 72 LEU C C 72 178.734 178.734 178.819 -0.085 26021 12235 1 19 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.547 0.875 26021 12236 1 19 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.908 -0.500 26021 12237 1 19 . 1 1 72 72 LEU H H 72 8.175 8.175 7.603 0.572 26021 12238 1 19 . 1 1 73 73 SER N N 73 115.243 115.243 115.241 0.002 26021 12239 1 19 . 1 1 73 73 SER HA H 73 3.824 3.824 4.093 -0.269 26021 12240 1 19 . 1 1 73 73 SER C C 73 175.697 175.697 176.237 -0.540 26021 12241 1 19 . 1 1 73 73 SER CA C 73 62.384 62.384 61.266 1.118 26021 12242 1 19 . 1 1 73 73 SER CB C 73 62.093 62.093 62.685 -0.592 26021 12243 1 19 . 1 1 73 73 SER H H 73 8.411 8.411 8.128 0.283 26021 12244 1 19 . 1 1 74 74 TYR N N 74 121.342 121.342 122.519 -1.177 26021 12245 1 19 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.218 0.273 26021 12246 1 19 . 1 1 74 74 TYR C C 74 178.747 178.747 177.809 0.938 26021 12247 1 19 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.741 -0.306 26021 12248 1 19 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.496 -0.989 26021 12249 1 19 . 1 1 74 74 TYR H H 74 7.314 7.314 7.660 -0.346 26021 12250 1 19 . 1 1 75 75 VAL N N 75 120.779 120.779 119.398 1.381 26021 12251 1 19 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.543 0.318 26021 12252 1 19 . 1 1 75 75 VAL C C 75 179.788 179.788 177.960 1.828 26021 12253 1 19 . 1 1 75 75 VAL CA C 75 66.048 66.048 66.131 -0.083 26021 12254 1 19 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.439 0.275 26021 12255 1 19 . 1 1 75 75 VAL H H 75 7.740 7.740 7.746 -0.006 26021 12256 1 19 . 1 1 76 76 ILE N N 76 120.598 120.598 118.498 2.100 26021 12257 1 19 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.708 -0.008 26021 12258 1 19 . 1 1 76 76 ILE C C 76 177.066 177.066 177.904 -0.838 26021 12259 1 19 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.350 1.569 26021 12260 1 19 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.355 0.030 26021 12261 1 19 . 1 1 76 76 ILE H H 76 8.584 8.584 7.362 1.222 26021 12262 1 19 . 1 1 77 77 GLU N N 77 120.468 120.468 120.810 -0.342 26021 12263 1 19 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.873 -0.224 26021 12264 1 19 . 1 1 77 77 GLU C C 77 177.502 177.502 178.335 -0.833 26021 12265 1 19 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.899 0.963 26021 12266 1 19 . 1 1 77 77 GLU CB C 77 29.352 29.352 29.072 0.280 26021 12267 1 19 . 1 1 77 77 GLU H H 77 8.445 8.445 7.779 0.666 26021 12268 1 19 . 1 1 78 78 ASP N N 78 117.382 117.382 119.628 -2.246 26021 12269 1 19 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.335 0.056 26021 12270 1 19 . 1 1 78 78 ASP C C 78 177.382 177.382 178.226 -0.844 26021 12271 1 19 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.979 0.516 26021 12272 1 19 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.037 1.898 26021 12273 1 19 . 1 1 78 78 ASP H H 78 7.885 7.885 7.742 0.143 26021 12274 1 19 . 1 1 79 79 ALA N N 79 120.171 120.171 121.785 -1.614 26021 12275 1 19 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.113 -0.063 26021 12276 1 19 . 1 1 79 79 ALA C C 79 181.193 181.193 179.152 2.041 26021 12277 1 19 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.222 -0.167 26021 12278 1 19 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.273 0.147 26021 12279 1 19 . 1 1 79 79 ALA H H 79 7.754 7.754 7.965 -0.211 26021 12280 1 19 . 1 1 80 80 VAL N N 80 119.541 119.541 111.690 7.851 26021 12281 1 19 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.938 -0.261 26021 12282 1 19 . 1 1 80 80 VAL C C 80 177.096 177.096 177.683 -0.587 26021 12283 1 19 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.195 2.889 26021 12284 1 19 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.786 -0.343 26021 12285 1 19 . 1 1 80 80 VAL H H 80 8.635 8.635 7.312 1.323 26021 12286 1 19 . 1 1 81 81 ASP N N 81 121.140 121.140 121.788 -0.648 26021 12287 1 19 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.435 0.034 26021 12288 1 19 . 1 1 81 81 ASP C C 81 179.569 179.569 178.726 0.843 26021 12289 1 19 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.497 0.432 26021 12290 1 19 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.731 -0.796 26021 12291 1 19 . 1 1 81 81 ASP H H 81 8.575 8.575 8.588 -0.013 26021 12292 1 19 . 1 1 82 82 LYS N N 82 118.159 118.159 119.430 -1.271 26021 12293 1 19 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.028 -0.007 26021 12294 1 19 . 1 1 82 82 LYS C C 82 178.890 178.890 178.945 -0.055 26021 12295 1 19 . 1 1 82 82 LYS CA C 82 59.067 59.067 59.158 -0.091 26021 12296 1 19 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.209 0.379 26021 12297 1 19 . 1 1 82 82 LYS H H 82 8.079 8.079 7.793 0.286 26021 12298 1 19 . 1 1 83 83 PHE N N 83 120.900 120.900 119.722 1.178 26021 12299 1 19 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.375 -0.099 26021 12300 1 19 . 1 1 83 83 PHE C C 83 177.269 177.269 176.675 0.594 26021 12301 1 19 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.338 0.605 26021 12302 1 19 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.480 0.267 26021 12303 1 19 . 1 1 83 83 PHE H H 83 8.015 8.015 7.792 0.223 26021 12304 1 19 . 1 1 84 84 LEU N N 84 118.209 118.209 119.006 -0.797 26021 12305 1 19 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.090 -0.148 26021 12306 1 19 . 1 1 84 84 LEU C C 84 178.774 178.774 177.899 0.875 26021 12307 1 19 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.321 0.849 26021 12308 1 19 . 1 1 84 84 LEU CB C 84 42.193 42.193 40.949 1.244 26021 12309 1 19 . 1 1 84 84 LEU H H 84 8.338 8.338 7.807 0.531 26021 12310 1 19 . 1 1 85 85 VAL N N 85 116.078 116.078 120.191 -4.113 26021 12311 1 19 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.755 0.236 26021 12312 1 19 . 1 1 85 85 VAL C C 85 177.252 177.252 177.094 0.158 26021 12313 1 19 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.358 -1.178 26021 12314 1 19 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.372 0.518 26021 12315 1 19 . 1 1 85 85 VAL H H 85 7.447 7.447 7.242 0.205 26021 12316 1 19 . 1 1 86 86 ARG N N 86 120.842 120.842 117.564 3.278 26021 12317 1 19 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.098 0.129 26021 12318 1 19 . 1 1 86 86 ARG C C 86 177.520 177.520 179.163 -1.643 26021 12319 1 19 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.363 -1.304 26021 12320 1 19 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.915 0.349 26021 12321 1 19 . 1 1 86 86 ARG H H 86 7.598 7.598 7.378 0.220 26021 12322 1 19 . 1 1 87 87 VAL N N 87 119.293 119.293 116.272 3.021 26021 12323 1 19 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.792 0.033 26021 12324 1 19 . 1 1 87 87 VAL C C 87 176.121 176.121 177.397 -1.276 26021 12325 1 19 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.567 -2.129 26021 12326 1 19 . 1 1 87 87 VAL CB C 87 31.772 31.772 31.172 0.600 26021 12327 1 19 . 1 1 87 87 VAL H H 87 7.994 7.994 7.973 0.021 26021 12328 1 19 . 1 1 88 88 HIS N N 88 120.016 120.016 117.083 2.933 26021 12329 1 19 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.534 0.103 26021 12330 1 19 . 1 1 88 88 HIS C C 88 175.639 175.639 175.805 -0.166 26021 12331 1 19 . 1 1 88 88 HIS CA C 88 56.351 56.351 55.786 0.565 26021 12332 1 19 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.101 -0.420 26021 12333 1 19 . 1 1 88 88 HIS H H 88 7.969 7.969 8.064 -0.095 26021 12334 1 19 . 1 1 89 89 GLY N N 89 109.587 109.587 108.827 0.760 26021 12335 1 19 . 1 1 89 89 GLY C C 89 173.730 173.730 174.575 -0.845 26021 12336 1 19 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.703 -0.534 26021 12337 1 19 . 1 1 89 89 GLY H H 89 8.083 8.083 8.096 -0.013 26021 12338 1 19 . 1 1 90 90 VAL N N 90 118.224 118.224 121.226 -3.002 26021 12339 1 19 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.233 -0.095 26021 12340 1 19 . 1 1 90 90 VAL C C 90 176.018 176.018 175.927 0.091 26021 12341 1 19 . 1 1 90 90 VAL CA C 90 62.425 62.425 61.075 1.350 26021 12342 1 19 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.081 -0.465 26021 12343 1 19 . 1 1 90 90 VAL H H 90 7.944 7.944 7.463 0.481 26021 12344 1 19 . 1 1 91 91 GLU N N 91 124.313 124.313 126.971 -2.658 26021 12345 1 19 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.275 0.331 26021 12346 1 19 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.730 -0.554 26021 12347 1 19 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.820 0.940 26021 12348 1 19 . 1 1 91 91 GLU H H 91 8.423 8.423 8.367 0.056 26021 12349 1 19 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.347 -0.010 26021 12350 1 19 . 1 1 92 92 PRO C C 92 176.504 176.504 175.620 0.884 26021 12351 1 19 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.293 0.079 26021 12352 1 19 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.087 0.080 26021 12353 1 19 . 1 1 93 93 ASP N N 93 120.275 120.275 122.861 -2.586 26021 12354 1 19 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.747 -0.175 26021 12355 1 19 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.668 0.302 26021 12356 1 19 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.688 -3.173 26021 12357 1 19 . 1 1 93 93 ASP H H 93 8.286 8.286 7.999 0.287 26021 12358 1 19 . 1 1 94 94 ASP N N 94 121.181 121.181 122.291 -1.110 26021 12359 1 19 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.620 -0.055 26021 12360 1 19 . 1 1 94 94 ASP C C 94 176.474 176.474 177.345 -0.871 26021 12361 1 19 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.739 -1.366 26021 12362 1 19 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.691 -0.466 26021 12363 1 19 . 1 1 94 94 ASP H H 94 8.259 8.259 8.628 -0.369 26021 12364 1 19 . 1 1 95 95 ASN N N 95 118.728 118.728 119.609 -0.881 26021 12365 1 19 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.483 0.211 26021 12366 1 19 . 1 1 95 95 ASN C C 95 176.272 176.272 177.493 -1.221 26021 12367 1 19 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.636 -1.650 26021 12368 1 19 . 1 1 95 95 ASN CB C 95 38.729 38.729 37.811 0.918 26021 12369 1 19 . 1 1 95 95 ASN H H 95 8.474 8.474 8.591 -0.117 26021 12370 1 19 . 1 1 96 96 THR N N 96 113.868 113.868 113.992 -0.124 26021 12371 1 19 . 1 1 96 96 THR HA H 96 4.220 4.220 4.049 0.171 26021 12372 1 19 . 1 1 96 96 THR C C 96 175.107 175.107 176.573 -1.466 26021 12373 1 19 . 1 1 96 96 THR CA C 96 63.200 63.200 64.734 -1.534 26021 12374 1 19 . 1 1 96 96 THR CB C 96 69.475 69.475 68.408 1.067 26021 12375 1 19 . 1 1 96 96 THR H H 96 8.263 8.263 8.180 0.083 26021 12376 1 19 . 1 1 97 97 ASN N N 97 119.954 119.954 119.166 0.788 26021 12377 1 19 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.445 0.171 26021 12378 1 19 . 1 1 97 97 ASN C C 97 176.275 176.275 176.428 -0.153 26021 12379 1 19 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.781 -0.825 26021 12380 1 19 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.791 -0.099 26021 12381 1 19 . 1 1 97 97 ASN H H 97 8.431 8.431 8.087 0.344 26021 12382 1 19 . 1 1 98 98 GLY N N 98 108.847 108.847 107.327 1.520 26021 12383 1 19 . 1 1 98 98 GLY C C 98 175.533 175.533 175.044 0.489 26021 12384 1 19 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.069 -0.058 26021 12385 1 19 . 1 1 98 98 GLY H H 98 8.338 8.338 8.138 0.200 26021 12386 1 19 . 1 1 99 99 PHE N N 99 118.492 118.492 119.394 -0.902 26021 12387 1 19 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.126 0.122 26021 12388 1 19 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.051 0.908 26021 12389 1 19 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.344 -1.185 26021 12390 1 19 . 1 1 99 99 PHE H H 99 8.370 8.370 8.426 -0.056 26021 12391 1 19 . 1 1 100 100 LYS N N 100 120.987 120.987 118.800 2.187 26021 12392 1 19 . 1 1 100 100 LYS H H 100 8.256 8.256 8.423 -0.167 26021 12393 1 19 . 1 1 101 101 GLY N N 101 108.186 108.186 107.114 1.072 26021 12394 1 19 . 1 1 101 101 GLY C C 101 177.075 177.075 175.673 1.402 26021 12395 1 19 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.029 0.873 26021 12396 1 19 . 1 1 101 101 GLY H H 101 8.300 8.300 7.568 0.732 26021 12397 1 19 . 1 1 102 102 LEU N N 102 121.439 121.439 123.242 -1.803 26021 12398 1 19 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.052 0.045 26021 12399 1 19 . 1 1 102 102 LEU C C 102 179.836 179.836 177.952 1.884 26021 12400 1 19 . 1 1 102 102 LEU CA C 102 57.358 57.358 56.992 0.366 26021 12401 1 19 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.850 -0.080 26021 12402 1 19 . 1 1 102 102 LEU H H 102 7.777 7.777 7.300 0.477 26021 12403 1 19 . 1 1 103 103 MET N N 103 122.290 122.290 119.618 2.672 26021 12404 1 19 . 1 1 103 103 MET HA H 103 4.220 4.220 3.785 0.435 26021 12405 1 19 . 1 1 103 103 MET C C 103 177.739 177.739 177.888 -0.149 26021 12406 1 19 . 1 1 103 103 MET CA C 103 58.739 58.739 58.512 0.227 26021 12407 1 19 . 1 1 103 103 MET CB C 103 31.895 31.895 31.864 0.031 26021 12408 1 19 . 1 1 103 103 MET H H 103 8.409 8.409 7.886 0.523 26021 12409 1 19 . 1 1 104 104 LYS N N 104 119.750 119.750 117.948 1.802 26021 12410 1 19 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.010 0.057 26021 12411 1 19 . 1 1 104 104 LYS C C 104 179.301 179.301 179.386 -0.085 26021 12412 1 19 . 1 1 104 104 LYS CA C 104 59.764 59.764 59.081 0.683 26021 12413 1 19 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.803 0.244 26021 12414 1 19 . 1 1 104 104 LYS H H 104 7.916 7.916 7.877 0.039 26021 12415 1 19 . 1 1 105 105 ARG N N 105 117.967 117.967 118.251 -0.284 26021 12416 1 19 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.107 -0.081 26021 12417 1 19 . 1 1 105 105 ARG C C 105 178.777 178.777 178.254 0.523 26021 12418 1 19 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.217 0.147 26021 12419 1 19 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.442 0.555 26021 12420 1 19 . 1 1 105 105 ARG H H 105 7.719 7.719 7.697 0.022 26021 12421 1 19 . 1 1 106 106 THR N N 106 117.211 117.211 111.856 5.355 26021 12422 1 19 . 1 1 106 106 THR HA H 106 4.301 4.301 4.323 -0.022 26021 12423 1 19 . 1 1 106 106 THR C C 106 176.254 176.254 176.806 -0.552 26021 12424 1 19 . 1 1 106 106 THR CA C 106 67.860 67.860 65.271 2.589 26021 12425 1 19 . 1 1 106 106 THR CB C 106 67.860 67.860 69.087 -1.227 26021 12426 1 19 . 1 1 106 106 THR H H 106 8.152 8.152 8.052 0.100 26021 12427 1 19 . 1 1 107 107 THR N N 107 117.939 117.939 118.149 -0.210 26021 12428 1 19 . 1 1 107 107 THR HA H 107 3.971 3.971 3.911 0.060 26021 12429 1 19 . 1 1 107 107 THR C C 107 176.780 176.780 176.045 0.735 26021 12430 1 19 . 1 1 107 107 THR CA C 107 66.822 66.822 67.244 -0.422 26021 12431 1 19 . 1 1 107 107 THR CB C 107 68.818 68.818 68.350 0.468 26021 12432 1 19 . 1 1 107 107 THR H H 107 8.651 8.651 8.450 0.201 26021 12433 1 19 . 1 1 108 108 LYS N N 108 120.867 120.867 121.613 -0.746 26021 12434 1 19 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.031 -0.009 26021 12435 1 19 . 1 1 108 108 LYS C C 108 179.045 179.045 178.544 0.501 26021 12436 1 19 . 1 1 108 108 LYS CA C 108 59.834 59.834 58.989 0.845 26021 12437 1 19 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.112 0.361 26021 12438 1 19 . 1 1 108 108 LYS H H 108 7.694 7.694 7.577 0.117 26021 12439 1 19 . 1 1 109 109 LEU N N 109 119.472 119.472 118.684 0.788 26021 12440 1 19 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.238 0.083 26021 12441 1 19 . 1 1 109 109 LEU C C 109 179.974 179.974 179.082 0.892 26021 12442 1 19 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.748 -0.155 26021 12443 1 19 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.356 -0.496 26021 12444 1 19 . 1 1 109 109 LEU H H 109 7.559 7.559 7.832 -0.273 26021 12445 1 19 . 1 1 110 110 LEU N N 110 121.832 121.832 120.776 1.056 26021 12446 1 19 . 1 1 110 110 LEU HA H 110 4.191 4.191 3.918 0.273 26021 12447 1 19 . 1 1 110 110 LEU C C 110 178.101 178.101 178.867 -0.766 26021 12448 1 19 . 1 1 110 110 LEU CA C 110 57.892 57.892 58.346 -0.454 26021 12449 1 19 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.193 0.691 26021 12450 1 19 . 1 1 110 110 LEU H H 110 8.567 8.567 7.667 0.900 26021 12451 1 19 . 1 1 111 111 LYS N N 111 117.972 117.972 116.845 1.127 26021 12452 1 19 . 1 1 111 111 LYS HA H 111 3.979 3.979 3.997 -0.018 26021 12453 1 19 . 1 1 111 111 LYS C C 111 177.677 177.677 178.835 -1.158 26021 12454 1 19 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.589 0.196 26021 12455 1 19 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.764 0.445 26021 12456 1 19 . 1 1 111 111 LYS H H 111 7.965 7.965 8.659 -0.694 26021 12457 1 19 . 1 1 112 112 LYS N N 112 115.433 115.433 118.236 -2.803 26021 12458 1 19 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.100 0.010 26021 12459 1 19 . 1 1 112 112 LYS C C 112 178.270 178.270 177.665 0.605 26021 12460 1 19 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.042 0.909 26021 12461 1 19 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.486 0.305 26021 12462 1 19 . 1 1 112 112 LYS H H 112 7.334 7.334 7.554 -0.220 26021 12463 1 19 . 1 1 113 113 VAL N N 113 114.861 114.861 119.401 -4.540 26021 12464 1 19 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.703 0.128 26021 12465 1 19 . 1 1 113 113 VAL C C 113 176.999 176.999 177.262 -0.263 26021 12466 1 19 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.837 -2.332 26021 12467 1 19 . 1 1 113 113 VAL CB C 113 32.287 32.287 32.463 -0.176 26021 12468 1 19 . 1 1 113 113 VAL H H 113 7.298 7.298 7.525 -0.227 26021 12469 1 19 . 1 1 114 114 VAL N N 114 121.457 121.457 117.473 3.984 26021 12470 1 19 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.764 -0.042 26021 12471 1 19 . 1 1 114 114 VAL C C 114 177.737 177.737 177.545 0.192 26021 12472 1 19 . 1 1 114 114 VAL CA C 114 65.224 65.224 66.062 -0.838 26021 12473 1 19 . 1 1 114 114 VAL CB C 114 31.753 31.753 30.759 0.995 26021 12474 1 19 . 1 1 114 114 VAL H H 114 7.855 7.855 8.563 -0.708 26021 12475 1 19 . 1 1 115 115 ASP N N 115 120.804 120.804 119.529 1.275 26021 12476 1 19 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.448 0.007 26021 12477 1 19 . 1 1 115 115 ASP C C 115 177.380 177.380 176.904 0.476 26021 12478 1 19 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.292 -0.371 26021 12479 1 19 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.830 -0.458 26021 12480 1 19 . 1 1 115 115 ASP H H 115 8.311 8.311 8.129 0.182 26021 12481 1 19 . 1 1 116 116 LYS N N 116 119.582 119.582 118.415 1.167 26021 12482 1 19 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.073 0.022 26021 12483 1 19 . 1 1 116 116 LYS C C 116 177.077 177.077 177.783 -0.706 26021 12484 1 19 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.926 -0.215 26021 12485 1 19 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.482 0.006 26021 12486 1 19 . 1 1 116 116 LYS H H 116 7.639 7.639 7.854 -0.215 26021 12487 1 19 . 1 1 117 117 HIS N N 117 115.246 115.246 112.380 2.866 26021 12488 1 19 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.818 -0.193 26021 12489 1 19 . 1 1 117 117 HIS C C 117 175.497 175.497 175.843 -0.346 26021 12490 1 19 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.389 -0.214 26021 12491 1 19 . 1 1 117 117 HIS CB C 117 30.475 30.475 32.228 -1.753 26021 12492 1 19 . 1 1 117 117 HIS H H 117 8.108 8.108 7.863 0.245 26021 12493 1 19 . 1 1 118 118 GLY N N 118 109.944 109.944 108.659 1.285 26021 12494 1 19 . 1 1 118 118 GLY C C 118 174.093 174.093 174.104 -0.011 26021 12495 1 19 . 1 1 118 118 GLY CA C 118 46.064 46.064 44.932 1.132 26021 12496 1 19 . 1 1 118 118 GLY H H 118 8.153 8.153 7.703 0.450 26021 12497 1 19 . 1 1 119 119 ILE N N 119 118.468 118.468 122.703 -4.235 26021 12498 1 19 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.880 0.242 26021 12499 1 19 . 1 1 119 119 ILE C C 119 174.777 174.777 175.884 -1.107 26021 12500 1 19 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.543 -0.442 26021 12501 1 19 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.511 2.120 26021 12502 1 19 . 1 1 119 119 ILE H H 119 7.828 7.828 7.951 -0.123 26021 12503 1 20 . 1 1 4 4 ASN HA H 4 4.749 4.749 4.584 0.165 26021 12504 1 20 . 1 1 4 4 ASN C C 4 175.260 175.260 175.478 -0.218 26021 12505 1 20 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.460 -0.629 26021 12506 1 20 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.213 0.468 26021 12507 1 20 . 1 1 5 5 ALA N N 5 123.648 123.648 121.196 2.452 26021 12508 1 20 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.682 -0.392 26021 12509 1 20 . 1 1 5 5 ALA C C 5 178.256 178.256 178.471 -0.215 26021 12510 1 20 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.337 1.744 26021 12511 1 20 . 1 1 5 5 ALA CB C 5 19.025 19.025 19.453 -0.428 26021 12512 1 20 . 1 1 5 5 ALA H H 5 8.520 8.520 7.700 0.820 26021 12513 1 20 . 1 1 6 6 GLY N N 6 107.044 107.044 107.948 -0.904 26021 12514 1 20 . 1 1 6 6 GLY C C 6 174.961 174.961 175.272 -0.311 26021 12515 1 20 . 1 1 6 6 GLY CA C 6 45.830 45.830 47.207 -1.377 26021 12516 1 20 . 1 1 6 6 GLY H H 6 8.350 8.350 7.968 0.382 26021 12517 1 20 . 1 1 7 7 ALA N N 7 123.366 123.366 123.211 0.155 26021 12518 1 20 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.221 -0.005 26021 12519 1 20 . 1 1 7 7 ALA C C 7 179.006 179.006 178.782 0.224 26021 12520 1 20 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.315 -0.612 26021 12521 1 20 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.506 0.338 26021 12522 1 20 . 1 1 7 7 ALA H H 7 8.078 8.078 8.151 -0.073 26021 12523 1 20 . 1 1 8 8 ILE N N 8 117.376 117.376 118.594 -1.218 26021 12524 1 20 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.767 0.013 26021 12525 1 20 . 1 1 8 8 ILE C C 8 177.032 177.032 178.153 -1.121 26021 12526 1 20 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.079 -0.921 26021 12527 1 20 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.119 -1.830 26021 12528 1 20 . 1 1 8 8 ILE H H 8 7.943 7.943 7.389 0.554 26021 12529 1 20 . 1 1 9 9 ALA N N 9 121.414 121.414 122.866 -1.452 26021 12530 1 20 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.073 -0.140 26021 12531 1 20 . 1 1 9 9 ALA C C 9 180.515 180.515 179.227 1.288 26021 12532 1 20 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.741 0.357 26021 12533 1 20 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.209 -0.048 26021 12534 1 20 . 1 1 9 9 ALA H H 9 8.062 8.062 7.928 0.134 26021 12535 1 20 . 1 1 10 10 LYS N N 10 114.594 114.594 118.681 -4.087 26021 12536 1 20 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.107 0.057 26021 12537 1 20 . 1 1 10 10 LYS C C 10 178.099 178.099 178.089 0.010 26021 12538 1 20 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.539 -0.699 26021 12539 1 20 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.169 0.300 26021 12540 1 20 . 1 1 10 10 LYS H H 10 7.554 7.554 7.762 -0.208 26021 12541 1 20 . 1 1 11 11 LEU N N 11 119.662 119.662 118.965 0.697 26021 12542 1 20 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.131 -0.053 26021 12543 1 20 . 1 1 11 11 LEU C C 11 177.930 177.930 178.093 -0.163 26021 12544 1 20 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.200 0.356 26021 12545 1 20 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.710 1.378 26021 12546 1 20 . 1 1 11 11 LEU H H 11 7.814 7.814 7.219 0.595 26021 12547 1 20 . 1 1 12 12 ILE N N 12 117.945 117.945 120.380 -2.435 26021 12548 1 20 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.884 -0.192 26021 12549 1 20 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.083 1.546 26021 12550 1 20 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.724 1.686 26021 12551 1 20 . 1 1 12 12 ILE H H 12 7.426 7.426 7.568 -0.142 26021 12552 1 20 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.271 0.132 26021 12553 1 20 . 1 1 13 13 PRO C C 13 179.030 179.030 178.604 0.426 26021 12554 1 20 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.209 0.035 26021 12555 1 20 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.075 -0.266 26021 12556 1 20 . 1 1 14 14 LYS N N 14 117.855 117.855 117.364 0.491 26021 12557 1 20 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.038 0.107 26021 12558 1 20 . 1 1 14 14 LYS C C 14 178.565 178.565 177.967 0.598 26021 12559 1 20 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.059 0.374 26021 12560 1 20 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.054 0.871 26021 12561 1 20 . 1 1 14 14 LYS H H 14 6.685 6.685 7.417 -0.732 26021 12562 1 20 . 1 1 15 15 LEU N N 15 118.008 118.008 117.271 0.737 26021 12563 1 20 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.368 -0.365 26021 12564 1 20 . 1 1 15 15 LEU C C 15 178.662 178.662 178.674 -0.012 26021 12565 1 20 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.431 1.281 26021 12566 1 20 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.490 -0.491 26021 12567 1 20 . 1 1 15 15 LEU H H 15 8.148 8.148 7.429 0.719 26021 12568 1 20 . 1 1 16 16 GLY N N 16 103.895 103.895 108.199 -4.304 26021 12569 1 20 . 1 1 16 16 GLY C C 16 176.838 176.838 175.407 1.431 26021 12570 1 20 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.067 0.298 26021 12571 1 20 . 1 1 16 16 GLY H H 16 8.104 8.104 7.714 0.390 26021 12572 1 20 . 1 1 17 17 GLU N N 17 121.655 121.655 121.252 0.403 26021 12573 1 20 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.052 0.081 26021 12574 1 20 . 1 1 17 17 GLU C C 17 179.007 179.007 177.974 1.033 26021 12575 1 20 . 1 1 17 17 GLU CA C 17 58.811 58.811 59.118 -0.307 26021 12576 1 20 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.580 -0.447 26021 12577 1 20 . 1 1 17 17 GLU H H 17 7.817 7.817 7.587 0.230 26021 12578 1 20 . 1 1 18 18 LEU N N 18 117.834 117.834 115.795 2.039 26021 12579 1 20 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.291 -0.173 26021 12580 1 20 . 1 1 18 18 LEU C C 18 177.658 177.658 177.659 -0.001 26021 12581 1 20 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.375 1.654 26021 12582 1 20 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.768 -0.098 26021 12583 1 20 . 1 1 18 18 LEU H H 18 7.389 7.389 7.774 -0.385 26021 12584 1 20 . 1 1 19 19 LEU N N 19 113.694 113.694 117.332 -3.638 26021 12585 1 20 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.292 -0.130 26021 12586 1 20 . 1 1 19 19 LEU C C 19 178.123 178.123 178.237 -0.114 26021 12587 1 20 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.777 0.075 26021 12588 1 20 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.435 -0.215 26021 12589 1 20 . 1 1 19 19 LEU H H 19 7.269 7.269 7.389 -0.120 26021 12590 1 20 . 1 1 20 20 VAL N N 20 112.778 112.778 113.201 -0.423 26021 12591 1 20 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.088 0.355 26021 12592 1 20 . 1 1 20 20 VAL C C 20 177.021 177.021 177.151 -0.130 26021 12593 1 20 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.764 -1.909 26021 12594 1 20 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.187 0.591 26021 12595 1 20 . 1 1 20 20 VAL H H 20 7.356 7.356 7.960 -0.604 26021 12596 1 20 . 1 1 21 21 GLY N N 21 108.962 108.962 107.622 1.340 26021 12597 1 20 . 1 1 21 21 GLY C C 21 173.813 173.813 174.572 -0.759 26021 12598 1 20 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.935 0.111 26021 12599 1 20 . 1 1 21 21 GLY H H 21 7.925 7.925 8.096 -0.171 26021 12600 1 20 . 1 1 22 22 GLU N N 22 120.607 120.607 123.968 -3.361 26021 12601 1 20 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.339 -0.061 26021 12602 1 20 . 1 1 22 22 GLU C C 22 175.869 175.869 175.576 0.293 26021 12603 1 20 . 1 1 22 22 GLU CA C 22 56.030 56.030 56.462 -0.432 26021 12604 1 20 . 1 1 22 22 GLU CB C 22 28.681 28.681 28.493 0.188 26021 12605 1 20 . 1 1 22 22 GLU H H 22 8.300 8.300 8.518 -0.218 26021 12606 1 20 . 1 1 23 23 TYR N N 23 120.738 120.738 119.304 1.434 26021 12607 1 20 . 1 1 23 23 TYR HA H 23 4.557 4.557 5.023 -0.466 26021 12608 1 20 . 1 1 23 23 TYR C C 23 175.264 175.264 174.078 1.186 26021 12609 1 20 . 1 1 23 23 TYR CA C 23 57.561 57.561 56.836 0.725 26021 12610 1 20 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.908 -0.663 26021 12611 1 20 . 1 1 23 23 TYR H H 23 7.756 7.756 7.896 -0.140 26021 12612 1 20 . 1 1 24 24 LYS N N 24 122.095 122.095 122.493 -0.398 26021 12613 1 20 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.510 -0.327 26021 12614 1 20 . 1 1 24 24 LYS C C 24 175.742 175.742 174.446 1.296 26021 12615 1 20 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.761 0.357 26021 12616 1 20 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.819 -0.100 26021 12617 1 20 . 1 1 24 24 LYS H H 24 8.692 8.692 8.800 -0.108 26021 12618 1 20 . 1 1 25 25 LEU N N 25 121.123 121.123 120.209 0.914 26021 12619 1 20 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.522 -0.030 26021 12620 1 20 . 1 1 25 25 LEU C C 25 177.487 177.487 175.656 1.831 26021 12621 1 20 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.344 0.990 26021 12622 1 20 . 1 1 25 25 LEU CB C 25 43.758 43.758 45.021 -1.263 26021 12623 1 20 . 1 1 25 25 LEU H H 25 8.088 8.088 7.705 0.383 26021 12624 1 20 . 1 1 26 26 HIS N N 26 122.993 122.993 118.556 4.437 26021 12625 1 20 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.726 -0.225 26021 12626 1 20 . 1 1 26 26 HIS C C 26 176.716 176.716 176.376 0.340 26021 12627 1 20 . 1 1 26 26 HIS CA C 26 57.197 57.197 55.904 1.293 26021 12628 1 20 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.958 0.399 26021 12629 1 20 . 1 1 26 26 HIS H H 26 8.882 8.882 8.482 0.400 26021 12630 1 20 . 1 1 27 27 LYS N N 27 124.894 124.894 119.501 5.393 26021 12631 1 20 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.343 -0.395 26021 12632 1 20 . 1 1 27 27 LYS C C 27 178.873 178.873 178.479 0.394 26021 12633 1 20 . 1 1 27 27 LYS CA C 27 60.011 60.011 59.021 0.990 26021 12634 1 20 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.473 -0.031 26021 12635 1 20 . 1 1 27 27 LYS H H 27 8.699 8.699 8.622 0.077 26021 12636 1 20 . 1 1 28 28 GLY N N 28 111.258 111.258 106.472 4.786 26021 12637 1 20 . 1 1 28 28 GLY C C 28 176.131 176.131 175.410 0.721 26021 12638 1 20 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.150 0.340 26021 12639 1 20 . 1 1 28 28 GLY H H 28 9.814 9.814 8.638 1.176 26021 12640 1 20 . 1 1 29 29 VAL N N 29 122.719 122.719 122.279 0.440 26021 12641 1 20 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.709 0.183 26021 12642 1 20 . 1 1 29 29 VAL C C 29 177.628 177.628 177.925 -0.297 26021 12643 1 20 . 1 1 29 29 VAL CA C 29 65.520 65.520 64.885 0.635 26021 12644 1 20 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.682 0.060 26021 12645 1 20 . 1 1 29 29 VAL H H 29 7.431 7.431 7.155 0.276 26021 12646 1 20 . 1 1 30 30 LYS N N 30 119.791 119.791 119.890 -0.099 26021 12647 1 20 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.685 -0.050 26021 12648 1 20 . 1 1 30 30 LYS C C 30 177.666 177.666 178.038 -0.372 26021 12649 1 20 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.451 1.573 26021 12650 1 20 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.151 1.254 26021 12651 1 20 . 1 1 30 30 LYS H H 30 8.255 8.255 7.626 0.629 26021 12652 1 20 . 1 1 31 31 LYS N N 31 117.918 117.918 118.238 -0.320 26021 12653 1 20 . 1 1 31 31 LYS HA H 31 4.116 4.116 3.916 0.200 26021 12654 1 20 . 1 1 31 31 LYS C C 31 177.784 177.784 178.570 -0.786 26021 12655 1 20 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.532 -0.829 26021 12656 1 20 . 1 1 31 31 LYS CB C 31 31.845 31.845 32.001 -0.156 26021 12657 1 20 . 1 1 31 31 LYS H H 31 7.689 7.689 7.581 0.108 26021 12658 1 20 . 1 1 32 32 ASN N N 32 116.347 116.347 116.671 -0.324 26021 12659 1 20 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.308 0.212 26021 12660 1 20 . 1 1 32 32 ASN C C 32 177.764 177.764 176.714 1.050 26021 12661 1 20 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.354 0.961 26021 12662 1 20 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.323 0.309 26021 12663 1 20 . 1 1 32 32 ASN H H 32 7.556 7.556 7.783 -0.227 26021 12664 1 20 . 1 1 33 33 ILE N N 33 120.592 120.592 120.003 0.589 26021 12665 1 20 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.765 -0.483 26021 12666 1 20 . 1 1 33 33 ILE C C 33 177.074 177.074 177.581 -0.507 26021 12667 1 20 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.328 2.559 26021 12668 1 20 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.088 0.090 26021 12669 1 20 . 1 1 33 33 ILE H H 33 8.236 8.236 7.647 0.589 26021 12670 1 20 . 1 1 34 34 GLU N N 34 120.595 120.595 119.572 1.023 26021 12671 1 20 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.830 -0.042 26021 12672 1 20 . 1 1 34 34 GLU C C 34 179.739 179.739 178.467 1.272 26021 12673 1 20 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.616 0.623 26021 12674 1 20 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.976 0.869 26021 12675 1 20 . 1 1 34 34 GLU H H 34 8.551 8.551 8.384 0.167 26021 12676 1 20 . 1 1 35 35 ASP N N 35 120.600 120.600 120.979 -0.379 26021 12677 1 20 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.464 -0.052 26021 12678 1 20 . 1 1 35 35 ASP C C 35 178.681 178.681 178.521 0.160 26021 12679 1 20 . 1 1 35 35 ASP CA C 35 57.462 57.462 57.142 0.320 26021 12680 1 20 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.340 -0.590 26021 12681 1 20 . 1 1 35 35 ASP H H 35 8.670 8.670 7.712 0.958 26021 12682 1 20 . 1 1 36 36 LEU N N 36 123.004 123.004 121.589 1.415 26021 12683 1 20 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.179 -0.084 26021 12684 1 20 . 1 1 36 36 LEU C C 36 178.035 178.035 178.870 -0.835 26021 12685 1 20 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.674 0.354 26021 12686 1 20 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.033 -0.157 26021 12687 1 20 . 1 1 36 36 LEU H H 36 8.166 8.166 7.415 0.751 26021 12688 1 20 . 1 1 37 37 LEU N N 37 120.178 120.178 119.486 0.692 26021 12689 1 20 . 1 1 37 37 LEU HA H 37 3.856 3.856 3.960 -0.104 26021 12690 1 20 . 1 1 37 37 LEU C C 37 178.128 178.128 178.438 -0.310 26021 12691 1 20 . 1 1 37 37 LEU CA C 37 58.675 58.675 58.208 0.467 26021 12692 1 20 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.426 0.729 26021 12693 1 20 . 1 1 37 37 LEU H H 37 8.736 8.736 8.066 0.670 26021 12694 1 20 . 1 1 38 38 LYS N N 38 118.110 118.110 119.415 -1.305 26021 12695 1 20 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.936 -0.003 26021 12696 1 20 . 1 1 38 38 LYS C C 38 179.533 179.533 178.964 0.569 26021 12697 1 20 . 1 1 38 38 LYS CA C 38 60.273 60.273 59.778 0.495 26021 12698 1 20 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.192 0.085 26021 12699 1 20 . 1 1 38 38 LYS H H 38 7.770 7.770 7.578 0.192 26021 12700 1 20 . 1 1 39 39 GLU N N 39 119.265 119.265 119.571 -0.306 26021 12701 1 20 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.090 0.212 26021 12702 1 20 . 1 1 39 39 GLU C C 39 179.720 179.720 179.173 0.547 26021 12703 1 20 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.175 -0.417 26021 12704 1 20 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.632 -0.042 26021 12705 1 20 . 1 1 39 39 GLU H H 39 7.709 7.709 7.794 -0.085 26021 12706 1 20 . 1 1 40 40 LEU N N 40 119.007 119.007 119.914 -0.907 26021 12707 1 20 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.111 -0.061 26021 12708 1 20 . 1 1 40 40 LEU C C 40 179.690 179.690 178.638 1.052 26021 12709 1 20 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.358 0.292 26021 12710 1 20 . 1 1 40 40 LEU CB C 40 41.685 41.685 40.935 0.750 26021 12711 1 20 . 1 1 40 40 LEU H H 40 8.851 8.851 8.600 0.251 26021 12712 1 20 . 1 1 41 41 LYS N N 41 120.500 120.500 118.774 1.726 26021 12713 1 20 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.022 -0.070 26021 12714 1 20 . 1 1 41 41 LYS C C 41 180.223 180.223 178.714 1.509 26021 12715 1 20 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.732 1.159 26021 12716 1 20 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.005 0.062 26021 12717 1 20 . 1 1 41 41 LYS H H 41 8.482 8.482 8.133 0.349 26021 12718 1 20 . 1 1 42 42 THR N N 42 119.555 119.555 111.725 7.830 26021 12719 1 20 . 1 1 42 42 THR HA H 42 4.000 4.000 4.166 -0.166 26021 12720 1 20 . 1 1 42 42 THR C C 42 176.633 176.633 176.575 0.058 26021 12721 1 20 . 1 1 42 42 THR CA C 42 66.574 66.574 65.370 1.204 26021 12722 1 20 . 1 1 42 42 THR CB C 42 67.924 67.924 68.537 -0.613 26021 12723 1 20 . 1 1 42 42 THR H H 42 7.863 7.863 7.537 0.326 26021 12724 1 20 . 1 1 43 43 MET N N 43 122.839 122.839 121.678 1.161 26021 12725 1 20 . 1 1 43 43 MET HA H 43 4.022 4.022 4.385 -0.363 26021 12726 1 20 . 1 1 43 43 MET C C 43 177.290 177.290 178.125 -0.835 26021 12727 1 20 . 1 1 43 43 MET CA C 43 59.731 59.731 58.458 1.273 26021 12728 1 20 . 1 1 43 43 MET CB C 43 33.610 33.610 31.845 1.765 26021 12729 1 20 . 1 1 43 43 MET H H 43 8.714 8.714 7.411 1.303 26021 12730 1 20 . 1 1 44 44 ASN N N 44 118.049 118.049 118.159 -0.110 26021 12731 1 20 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.362 0.012 26021 12732 1 20 . 1 1 44 44 ASN C C 44 176.297 176.297 177.467 -1.170 26021 12733 1 20 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.696 0.199 26021 12734 1 20 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.934 0.472 26021 12735 1 20 . 1 1 44 44 ASN H H 44 8.988 8.988 8.201 0.787 26021 12736 1 20 . 1 1 45 45 ALA N N 45 119.260 119.260 121.511 -2.251 26021 12737 1 20 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.224 -0.158 26021 12738 1 20 . 1 1 45 45 ALA C C 45 180.476 180.476 179.215 1.261 26021 12739 1 20 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.441 0.827 26021 12740 1 20 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.362 -0.674 26021 12741 1 20 . 1 1 45 45 ALA H H 45 7.675 7.675 7.586 0.089 26021 12742 1 20 . 1 1 46 46 ALA N N 46 121.126 121.126 123.257 -2.131 26021 12743 1 20 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.215 -0.099 26021 12744 1 20 . 1 1 46 46 ALA C C 46 179.314 179.314 179.311 0.003 26021 12745 1 20 . 1 1 46 46 ALA CA C 46 54.986 54.986 54.955 0.031 26021 12746 1 20 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.875 -0.653 26021 12747 1 20 . 1 1 46 46 ALA H H 46 7.872 7.872 7.890 -0.018 26021 12748 1 20 . 1 1 47 47 LEU N N 47 119.328 119.328 116.567 2.761 26021 12749 1 20 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.227 -0.036 26021 12750 1 20 . 1 1 47 47 LEU C C 47 180.403 180.403 178.378 2.025 26021 12751 1 20 . 1 1 47 47 LEU CA C 47 58.046 58.046 58.203 -0.157 26021 12752 1 20 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.647 0.303 26021 12753 1 20 . 1 1 47 47 LEU H H 47 8.529 8.529 8.174 0.355 26021 12754 1 20 . 1 1 48 48 ILE N N 48 121.653 121.653 116.750 4.903 26021 12755 1 20 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.870 -0.168 26021 12756 1 20 . 1 1 48 48 ILE C C 48 178.730 178.730 177.864 0.866 26021 12757 1 20 . 1 1 48 48 ILE CA C 48 64.910 64.910 62.798 2.111 26021 12758 1 20 . 1 1 48 48 ILE CB C 48 37.912 37.912 36.866 1.046 26021 12759 1 20 . 1 1 48 48 ILE H H 48 8.386 8.386 7.305 1.081 26021 12760 1 20 . 1 1 49 49 LYS N N 49 119.896 119.896 118.701 1.195 26021 12761 1 20 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.225 -0.182 26021 12762 1 20 . 1 1 49 49 LYS C C 49 179.999 179.999 179.296 0.703 26021 12763 1 20 . 1 1 49 49 LYS CA C 49 59.057 59.057 58.777 0.280 26021 12764 1 20 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.718 -0.757 26021 12765 1 20 . 1 1 49 49 LYS H H 49 7.456 7.456 7.522 -0.066 26021 12766 1 20 . 1 1 50 50 ILE N N 50 119.964 119.964 116.076 3.888 26021 12767 1 20 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.007 -0.271 26021 12768 1 20 . 1 1 50 50 ILE C C 50 177.960 177.960 177.750 0.210 26021 12769 1 20 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.808 0.541 26021 12770 1 20 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.379 0.753 26021 12771 1 20 . 1 1 50 50 ILE H H 50 8.154 8.154 8.597 -0.443 26021 12772 1 20 . 1 1 51 51 GLY N N 51 106.709 106.709 107.800 -1.091 26021 12773 1 20 . 1 1 51 51 GLY C C 51 174.461 174.461 175.118 -0.657 26021 12774 1 20 . 1 1 51 51 GLY CA C 51 45.909 45.909 46.054 -0.145 26021 12775 1 20 . 1 1 51 51 GLY H H 51 7.932 7.932 7.731 0.201 26021 12776 1 20 . 1 1 52 52 GLU N N 52 118.736 118.736 119.725 -0.989 26021 12777 1 20 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.439 -0.118 26021 12778 1 20 . 1 1 52 52 GLU C C 52 176.789 176.789 175.605 1.184 26021 12779 1 20 . 1 1 52 52 GLU CA C 52 56.274 56.274 55.750 0.524 26021 12780 1 20 . 1 1 52 52 GLU CB C 52 30.112 30.112 29.842 0.270 26021 12781 1 20 . 1 1 52 52 GLU H H 52 7.597 7.597 7.562 0.035 26021 12782 1 20 . 1 1 53 53 VAL N N 53 122.982 122.982 120.247 2.735 26021 12783 1 20 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.463 -0.202 26021 12784 1 20 . 1 1 53 53 VAL CA C 53 60.385 60.385 58.795 1.590 26021 12785 1 20 . 1 1 53 53 VAL CB C 53 32.822 32.822 33.194 -0.372 26021 12786 1 20 . 1 1 53 53 VAL H H 53 7.511 7.511 7.475 0.036 26021 12787 1 20 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.795 -0.150 26021 12788 1 20 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.575 0.003 26021 12789 1 20 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.236 0.299 26021 12790 1 20 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.289 -0.098 26021 12791 1 20 . 1 1 55 55 PRO C C 55 178.258 178.258 178.417 -0.159 26021 12792 1 20 . 1 1 55 55 PRO CA C 55 65.428 65.428 65.097 0.331 26021 12793 1 20 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.835 0.011 26021 12794 1 20 . 1 1 56 56 ASP N N 56 114.117 114.117 118.331 -4.214 26021 12795 1 20 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.411 0.080 26021 12796 1 20 . 1 1 56 56 ASP C C 56 176.696 176.696 176.915 -0.219 26021 12797 1 20 . 1 1 56 56 ASP CA C 56 55.138 55.138 56.108 -0.971 26021 12798 1 20 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.486 -0.760 26021 12799 1 20 . 1 1 56 56 ASP H H 56 8.489 8.489 8.502 -0.013 26021 12800 1 20 . 1 1 57 57 GLN N N 57 117.641 117.641 117.364 0.277 26021 12801 1 20 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.364 0.010 26021 12802 1 20 . 1 1 57 57 GLN C C 57 175.765 175.765 175.300 0.465 26021 12803 1 20 . 1 1 57 57 GLN CA C 57 55.290 55.290 54.751 0.539 26021 12804 1 20 . 1 1 57 57 GLN CB C 57 29.646 29.646 28.780 0.866 26021 12805 1 20 . 1 1 57 57 GLN H H 57 8.206 8.206 7.778 0.428 26021 12806 1 20 . 1 1 58 58 LEU N N 58 122.141 122.141 120.198 1.943 26021 12807 1 20 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.653 -0.203 26021 12808 1 20 . 1 1 58 58 LEU C C 58 176.849 176.849 175.857 0.992 26021 12809 1 20 . 1 1 58 58 LEU CA C 58 54.995 54.995 53.435 1.560 26021 12810 1 20 . 1 1 58 58 LEU CB C 58 43.231 43.231 45.464 -2.233 26021 12811 1 20 . 1 1 58 58 LEU H H 58 7.152 7.152 7.593 -0.441 26021 12812 1 20 . 1 1 59 59 ASP N N 59 125.643 125.643 119.248 6.395 26021 12813 1 20 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.805 -0.086 26021 12814 1 20 . 1 1 59 59 ASP C C 59 177.249 177.249 177.434 -0.185 26021 12815 1 20 . 1 1 59 59 ASP CA C 59 53.403 53.403 53.451 -0.048 26021 12816 1 20 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.148 -0.916 26021 12817 1 20 . 1 1 59 59 ASP H H 59 9.312 9.312 8.833 0.479 26021 12818 1 20 . 1 1 60 60 SER N N 60 116.550 116.550 116.016 0.534 26021 12819 1 20 . 1 1 60 60 SER HA H 60 4.124 4.124 4.223 -0.099 26021 12820 1 20 . 1 1 60 60 SER C C 60 176.840 176.840 175.880 0.960 26021 12821 1 20 . 1 1 60 60 SER CA C 60 61.722 61.722 61.561 0.161 26021 12822 1 20 . 1 1 60 60 SER CB C 60 62.815 62.815 63.183 -0.368 26021 12823 1 20 . 1 1 60 60 SER H H 60 8.647 8.647 8.551 0.096 26021 12824 1 20 . 1 1 61 61 GLN N N 61 121.394 121.394 119.888 1.506 26021 12825 1 20 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.356 -0.225 26021 12826 1 20 . 1 1 61 61 GLN C C 61 178.629 178.629 177.483 1.146 26021 12827 1 20 . 1 1 61 61 GLN CA C 61 58.753 58.753 57.900 0.853 26021 12828 1 20 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.924 -0.671 26021 12829 1 20 . 1 1 61 61 GLN H H 61 8.453 8.453 7.949 0.504 26021 12830 1 20 . 1 1 62 62 ASP N N 62 122.187 122.187 119.123 3.064 26021 12831 1 20 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.427 0.192 26021 12832 1 20 . 1 1 62 62 ASP C C 62 178.318 178.318 177.844 0.474 26021 12833 1 20 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.330 0.132 26021 12834 1 20 . 1 1 62 62 ASP CB C 62 41.036 41.036 39.990 1.046 26021 12835 1 20 . 1 1 62 62 ASP H H 62 8.311 8.311 8.624 -0.313 26021 12836 1 20 . 1 1 63 63 LYS N N 63 120.325 120.325 118.038 2.287 26021 12837 1 20 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.255 -0.246 26021 12838 1 20 . 1 1 63 63 LYS C C 63 178.765 178.765 178.559 0.206 26021 12839 1 20 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.777 0.976 26021 12840 1 20 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.195 0.258 26021 12841 1 20 . 1 1 63 63 LYS H H 63 7.923 7.923 7.588 0.335 26021 12842 1 20 . 1 1 64 64 LEU N N 64 119.491 119.491 120.219 -0.728 26021 12843 1 20 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.194 0.032 26021 12844 1 20 . 1 1 64 64 LEU C C 64 179.526 179.526 178.576 0.950 26021 12845 1 20 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.141 0.657 26021 12846 1 20 . 1 1 64 64 LEU CB C 64 41.775 41.775 40.801 0.974 26021 12847 1 20 . 1 1 64 64 LEU H H 64 7.820 7.820 7.891 -0.071 26021 12848 1 20 . 1 1 65 65 TRP N N 65 120.674 120.674 121.923 -1.249 26021 12849 1 20 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.153 0.155 26021 12850 1 20 . 1 1 65 65 TRP C C 65 177.379 177.379 177.265 0.114 26021 12851 1 20 . 1 1 65 65 TRP CA C 65 61.802 61.802 61.730 0.072 26021 12852 1 20 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.998 -0.587 26021 12853 1 20 . 1 1 65 65 TRP H H 65 8.196 8.196 7.386 0.810 26021 12854 1 20 . 1 1 66 66 ALA N N 66 120.606 120.606 119.510 1.096 26021 12855 1 20 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.405 0.304 26021 12856 1 20 . 1 1 66 66 ALA C C 66 180.376 180.376 178.609 1.767 26021 12857 1 20 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.257 1.307 26021 12858 1 20 . 1 1 66 66 ALA CB C 66 17.654 17.654 18.323 -0.669 26021 12859 1 20 . 1 1 66 66 ALA H H 66 8.305 8.305 8.019 0.286 26021 12860 1 20 . 1 1 67 67 ASP N N 67 119.175 119.175 118.929 0.246 26021 12861 1 20 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.272 0.178 26021 12862 1 20 . 1 1 67 67 ASP C C 67 178.757 178.757 178.077 0.680 26021 12863 1 20 . 1 1 67 67 ASP CA C 67 57.492 57.492 57.273 0.219 26021 12864 1 20 . 1 1 67 67 ASP CB C 67 40.154 40.154 41.091 -0.937 26021 12865 1 20 . 1 1 67 67 ASP H H 67 7.945 7.945 7.530 0.415 26021 12866 1 20 . 1 1 68 68 GLU N N 68 122.322 122.322 119.165 3.157 26021 12867 1 20 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.160 -0.145 26021 12868 1 20 . 1 1 68 68 GLU C C 68 180.055 180.055 178.826 1.229 26021 12869 1 20 . 1 1 68 68 GLU CA C 68 60.110 60.110 58.880 1.230 26021 12870 1 20 . 1 1 68 68 GLU CB C 68 29.647 29.647 28.895 0.752 26021 12871 1 20 . 1 1 68 68 GLU H H 68 8.168 8.168 8.289 -0.121 26021 12872 1 20 . 1 1 69 69 VAL N N 69 122.135 122.135 119.842 2.293 26021 12873 1 20 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.487 -0.235 26021 12874 1 20 . 1 1 69 69 VAL C C 69 177.736 177.736 178.149 -0.413 26021 12875 1 20 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.874 0.665 26021 12876 1 20 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.186 0.056 26021 12877 1 20 . 1 1 69 69 VAL H H 69 8.424 8.424 7.146 1.278 26021 12878 1 20 . 1 1 70 70 ARG N N 70 121.373 121.373 119.005 2.368 26021 12879 1 20 . 1 1 70 70 ARG HA H 70 3.692 3.692 4.029 -0.337 26021 12880 1 20 . 1 1 70 70 ARG C C 70 179.117 179.117 178.877 0.240 26021 12881 1 20 . 1 1 70 70 ARG CA C 70 60.165 60.165 58.857 1.308 26021 12882 1 20 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.741 -0.087 26021 12883 1 20 . 1 1 70 70 ARG H H 70 7.916 7.916 7.745 0.171 26021 12884 1 20 . 1 1 71 71 GLU N N 71 119.075 119.075 120.202 -1.127 26021 12885 1 20 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.924 0.139 26021 12886 1 20 . 1 1 71 71 GLU C C 71 179.119 179.119 179.134 -0.015 26021 12887 1 20 . 1 1 71 71 GLU CA C 71 59.687 59.687 58.707 0.980 26021 12888 1 20 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.798 0.472 26021 12889 1 20 . 1 1 71 71 GLU H H 71 8.031 8.031 7.675 0.356 26021 12890 1 20 . 1 1 72 72 LEU N N 72 120.503 120.503 120.833 -0.330 26021 12891 1 20 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.093 -0.036 26021 12892 1 20 . 1 1 72 72 LEU C C 72 178.734 178.734 178.764 -0.030 26021 12893 1 20 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.927 0.495 26021 12894 1 20 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.711 -0.303 26021 12895 1 20 . 1 1 72 72 LEU H H 72 8.175 8.175 8.108 0.067 26021 12896 1 20 . 1 1 73 73 SER N N 73 115.243 115.243 115.418 -0.175 26021 12897 1 20 . 1 1 73 73 SER HA H 73 3.824 3.824 4.089 -0.265 26021 12898 1 20 . 1 1 73 73 SER C C 73 175.697 175.697 176.754 -1.057 26021 12899 1 20 . 1 1 73 73 SER CA C 73 62.384 62.384 61.490 0.894 26021 12900 1 20 . 1 1 73 73 SER CB C 73 62.093 62.093 62.974 -0.881 26021 12901 1 20 . 1 1 73 73 SER H H 73 8.411 8.411 7.891 0.520 26021 12902 1 20 . 1 1 74 74 TYR N N 74 121.342 121.342 121.102 0.240 26021 12903 1 20 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.679 -0.188 26021 12904 1 20 . 1 1 74 74 TYR C C 74 178.747 178.747 178.548 0.199 26021 12905 1 20 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.208 0.227 26021 12906 1 20 . 1 1 74 74 TYR CB C 74 37.507 37.507 37.985 -0.478 26021 12907 1 20 . 1 1 74 74 TYR H H 74 7.314 7.314 7.943 -0.629 26021 12908 1 20 . 1 1 75 75 VAL N N 75 120.779 120.779 119.536 1.243 26021 12909 1 20 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.943 -0.082 26021 12910 1 20 . 1 1 75 75 VAL C C 75 179.788 179.788 178.059 1.729 26021 12911 1 20 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.361 0.687 26021 12912 1 20 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.460 0.254 26021 12913 1 20 . 1 1 75 75 VAL H H 75 7.740 7.740 8.008 -0.268 26021 12914 1 20 . 1 1 76 76 ILE N N 76 120.598 120.598 119.834 0.764 26021 12915 1 20 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.668 0.032 26021 12916 1 20 . 1 1 76 76 ILE C C 76 177.066 177.066 177.791 -0.725 26021 12917 1 20 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.490 1.429 26021 12918 1 20 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.376 0.009 26021 12919 1 20 . 1 1 76 76 ILE H H 76 8.584 8.584 8.098 0.486 26021 12920 1 20 . 1 1 77 77 GLU N N 77 120.468 120.468 120.230 0.238 26021 12921 1 20 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.894 -0.245 26021 12922 1 20 . 1 1 77 77 GLU C C 77 177.502 177.502 178.375 -0.873 26021 12923 1 20 . 1 1 77 77 GLU CA C 77 60.862 60.862 60.230 0.632 26021 12924 1 20 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.852 0.500 26021 12925 1 20 . 1 1 77 77 GLU H H 77 8.445 8.445 7.861 0.584 26021 12926 1 20 . 1 1 78 78 ASP N N 78 117.382 117.382 119.761 -2.379 26021 12927 1 20 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.308 0.083 26021 12928 1 20 . 1 1 78 78 ASP C C 78 177.382 177.382 178.072 -0.690 26021 12929 1 20 . 1 1 78 78 ASP CA C 78 57.495 57.495 57.117 0.377 26021 12930 1 20 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.524 1.411 26021 12931 1 20 . 1 1 78 78 ASP H H 78 7.885 7.885 7.667 0.218 26021 12932 1 20 . 1 1 79 79 ALA N N 79 120.171 120.171 121.803 -1.632 26021 12933 1 20 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.023 0.027 26021 12934 1 20 . 1 1 79 79 ALA C C 79 181.193 181.193 179.019 2.174 26021 12935 1 20 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.105 -0.050 26021 12936 1 20 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.601 -0.181 26021 12937 1 20 . 1 1 79 79 ALA H H 79 7.754 7.754 8.036 -0.282 26021 12938 1 20 . 1 1 80 80 VAL N N 80 119.541 119.541 112.392 7.149 26021 12939 1 20 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.893 -0.215 26021 12940 1 20 . 1 1 80 80 VAL C C 80 177.096 177.096 177.529 -0.433 26021 12941 1 20 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.209 2.875 26021 12942 1 20 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.765 -0.322 26021 12943 1 20 . 1 1 80 80 VAL H H 80 8.635 8.635 7.425 1.210 26021 12944 1 20 . 1 1 81 81 ASP N N 81 121.140 121.140 122.153 -1.013 26021 12945 1 20 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.356 0.113 26021 12946 1 20 . 1 1 81 81 ASP C C 81 179.569 179.569 177.962 1.607 26021 12947 1 20 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.548 0.381 26021 12948 1 20 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.607 -0.672 26021 12949 1 20 . 1 1 81 81 ASP H H 81 8.575 8.575 8.534 0.041 26021 12950 1 20 . 1 1 82 82 LYS N N 82 118.159 118.159 118.688 -0.529 26021 12951 1 20 . 1 1 82 82 LYS HA H 82 4.021 4.021 3.927 0.094 26021 12952 1 20 . 1 1 82 82 LYS C C 82 178.890 178.890 178.451 0.439 26021 12953 1 20 . 1 1 82 82 LYS CA C 82 59.067 59.067 59.345 -0.278 26021 12954 1 20 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.305 0.282 26021 12955 1 20 . 1 1 82 82 LYS H H 82 8.079 8.079 7.659 0.420 26021 12956 1 20 . 1 1 83 83 PHE N N 83 120.900 120.900 119.466 1.434 26021 12957 1 20 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.303 -0.027 26021 12958 1 20 . 1 1 83 83 PHE C C 83 177.269 177.269 176.628 0.641 26021 12959 1 20 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.850 0.093 26021 12960 1 20 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.316 0.431 26021 12961 1 20 . 1 1 83 83 PHE H H 83 8.015 8.015 7.810 0.205 26021 12962 1 20 . 1 1 84 84 LEU N N 84 118.209 118.209 118.529 -0.320 26021 12963 1 20 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.012 -0.070 26021 12964 1 20 . 1 1 84 84 LEU C C 84 178.774 178.774 178.420 0.354 26021 12965 1 20 . 1 1 84 84 LEU CA C 84 57.170 57.170 57.059 0.111 26021 12966 1 20 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.359 0.834 26021 12967 1 20 . 1 1 84 84 LEU H H 84 8.338 8.338 7.745 0.593 26021 12968 1 20 . 1 1 85 85 VAL N N 85 116.078 116.078 118.106 -2.028 26021 12969 1 20 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.530 0.461 26021 12970 1 20 . 1 1 85 85 VAL C C 85 177.252 177.252 177.652 -0.400 26021 12971 1 20 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.567 -1.387 26021 12972 1 20 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.081 0.809 26021 12973 1 20 . 1 1 85 85 VAL H H 85 7.447 7.447 7.422 0.025 26021 12974 1 20 . 1 1 86 86 ARG N N 86 120.842 120.842 118.154 2.688 26021 12975 1 20 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.117 0.110 26021 12976 1 20 . 1 1 86 86 ARG C C 86 177.520 177.520 179.373 -1.853 26021 12977 1 20 . 1 1 86 86 ARG CA C 86 57.059 57.059 57.670 -0.611 26021 12978 1 20 . 1 1 86 86 ARG CB C 86 30.263 30.263 29.804 0.459 26021 12979 1 20 . 1 1 86 86 ARG H H 86 7.598 7.598 7.335 0.263 26021 12980 1 20 . 1 1 87 87 VAL N N 87 119.293 119.293 117.273 2.020 26021 12981 1 20 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.766 0.059 26021 12982 1 20 . 1 1 87 87 VAL C C 87 176.121 176.121 177.343 -1.222 26021 12983 1 20 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.578 -2.139 26021 12984 1 20 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.482 1.290 26021 12985 1 20 . 1 1 87 87 VAL H H 87 7.994 7.994 7.466 0.528 26021 12986 1 20 . 1 1 88 88 HIS N N 88 120.016 120.016 118.575 1.441 26021 12987 1 20 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.412 0.225 26021 12988 1 20 . 1 1 88 88 HIS C C 88 175.639 175.639 175.898 -0.259 26021 12989 1 20 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.057 0.294 26021 12990 1 20 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.165 -0.484 26021 12991 1 20 . 1 1 88 88 HIS H H 88 7.969 7.969 7.769 0.200 26021 12992 1 20 . 1 1 89 89 GLY N N 89 109.587 109.587 107.094 2.493 26021 12993 1 20 . 1 1 89 89 GLY C C 89 173.730 173.730 173.951 -0.221 26021 12994 1 20 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.303 -0.134 26021 12995 1 20 . 1 1 89 89 GLY H H 89 8.083 8.083 8.170 -0.087 26021 12996 1 20 . 1 1 90 90 VAL N N 90 118.224 118.224 122.941 -4.717 26021 12997 1 20 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.258 -0.120 26021 12998 1 20 . 1 1 90 90 VAL C C 90 176.018 176.018 174.941 1.077 26021 12999 1 20 . 1 1 90 90 VAL CA C 90 62.425 62.425 60.702 1.724 26021 13000 1 20 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.630 -1.014 26021 13001 1 20 . 1 1 90 90 VAL H H 90 7.944 7.944 7.621 0.323 26021 13002 1 20 . 1 1 91 91 GLU N N 91 124.313 124.313 126.827 -2.514 26021 13003 1 20 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.326 0.280 26021 13004 1 20 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.724 -0.548 26021 13005 1 20 . 1 1 91 91 GLU CB C 91 29.760 29.760 28.763 0.997 26021 13006 1 20 . 1 1 91 91 GLU H H 91 8.423 8.423 8.558 -0.135 26021 13007 1 20 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.365 -0.028 26021 13008 1 20 . 1 1 92 92 PRO C C 92 176.504 176.504 175.490 1.014 26021 13009 1 20 . 1 1 92 92 PRO CA C 92 63.372 63.372 62.785 0.587 26021 13010 1 20 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.489 -0.322 26021 13011 1 20 . 1 1 93 93 ASP N N 93 120.275 120.275 118.929 1.346 26021 13012 1 20 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.858 -0.286 26021 13013 1 20 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.924 0.046 26021 13014 1 20 . 1 1 93 93 ASP CB C 93 41.515 41.515 44.022 -2.507 26021 13015 1 20 . 1 1 93 93 ASP H H 93 8.286 8.286 8.455 -0.169 26021 13016 1 20 . 1 1 94 94 ASP N N 94 121.181 121.181 122.617 -1.436 26021 13017 1 20 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.536 0.029 26021 13018 1 20 . 1 1 94 94 ASP C C 94 176.474 176.474 177.284 -0.810 26021 13019 1 20 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.660 -1.286 26021 13020 1 20 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.294 -0.069 26021 13021 1 20 . 1 1 94 94 ASP H H 94 8.259 8.259 8.717 -0.458 26021 13022 1 20 . 1 1 95 95 ASN N N 95 118.728 118.728 119.045 -0.317 26021 13023 1 20 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.583 0.111 26021 13024 1 20 . 1 1 95 95 ASN C C 95 176.272 176.272 177.642 -1.370 26021 13025 1 20 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.885 -1.899 26021 13026 1 20 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.353 0.376 26021 13027 1 20 . 1 1 95 95 ASN H H 95 8.474 8.474 8.491 -0.017 26021 13028 1 20 . 1 1 96 96 THR N N 96 113.868 113.868 110.941 2.927 26021 13029 1 20 . 1 1 96 96 THR HA H 96 4.220 4.220 4.082 0.138 26021 13030 1 20 . 1 1 96 96 THR C C 96 175.107 175.107 175.961 -0.854 26021 13031 1 20 . 1 1 96 96 THR CA C 96 63.200 63.200 64.596 -1.396 26021 13032 1 20 . 1 1 96 96 THR CB C 96 69.475 69.475 68.574 0.901 26021 13033 1 20 . 1 1 96 96 THR H H 96 8.263 8.263 8.214 0.049 26021 13034 1 20 . 1 1 97 97 ASN N N 97 119.954 119.954 118.426 1.528 26021 13035 1 20 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.551 0.065 26021 13036 1 20 . 1 1 97 97 ASN C C 97 176.275 176.275 176.395 -0.120 26021 13037 1 20 . 1 1 97 97 ASN CA C 97 53.956 53.956 53.960 -0.004 26021 13038 1 20 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.426 0.266 26021 13039 1 20 . 1 1 97 97 ASN H H 97 8.431 8.431 7.503 0.928 26021 13040 1 20 . 1 1 98 98 GLY N N 98 108.847 108.847 107.518 1.329 26021 13041 1 20 . 1 1 98 98 GLY C C 98 175.533 175.533 175.360 0.173 26021 13042 1 20 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.054 -0.043 26021 13043 1 20 . 1 1 98 98 GLY H H 98 8.338 8.338 8.047 0.291 26021 13044 1 20 . 1 1 99 99 PHE N N 99 118.492 118.492 120.574 -2.082 26021 13045 1 20 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.032 0.216 26021 13046 1 20 . 1 1 99 99 PHE CA C 99 60.959 60.959 59.849 1.110 26021 13047 1 20 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.070 -0.911 26021 13048 1 20 . 1 1 99 99 PHE H H 99 8.370 8.370 8.352 0.018 26021 13049 1 20 . 1 1 100 100 LYS N N 100 120.987 120.987 119.759 1.228 26021 13050 1 20 . 1 1 100 100 LYS H H 100 8.256 8.256 8.284 -0.028 26021 13051 1 20 . 1 1 101 101 GLY N N 101 108.186 108.186 106.117 2.069 26021 13052 1 20 . 1 1 101 101 GLY C C 101 177.075 177.075 175.859 1.216 26021 13053 1 20 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.319 0.583 26021 13054 1 20 . 1 1 101 101 GLY H H 101 8.300 8.300 7.796 0.504 26021 13055 1 20 . 1 1 102 102 LEU N N 102 121.439 121.439 123.366 -1.927 26021 13056 1 20 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.160 -0.063 26021 13057 1 20 . 1 1 102 102 LEU C C 102 179.836 179.836 178.243 1.593 26021 13058 1 20 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.331 0.027 26021 13059 1 20 . 1 1 102 102 LEU CB C 102 41.770 41.770 42.042 -0.272 26021 13060 1 20 . 1 1 102 102 LEU H H 102 7.777 7.777 7.734 0.043 26021 13061 1 20 . 1 1 103 103 MET N N 103 122.290 122.290 118.608 3.682 26021 13062 1 20 . 1 1 103 103 MET HA H 103 4.220 4.220 4.072 0.148 26021 13063 1 20 . 1 1 103 103 MET C C 103 177.739 177.739 177.794 -0.055 26021 13064 1 20 . 1 1 103 103 MET CA C 103 58.739 58.739 57.718 1.021 26021 13065 1 20 . 1 1 103 103 MET CB C 103 31.895 31.895 31.959 -0.064 26021 13066 1 20 . 1 1 103 103 MET H H 103 8.409 8.409 8.230 0.179 26021 13067 1 20 . 1 1 104 104 LYS N N 104 119.750 119.750 118.922 0.828 26021 13068 1 20 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.039 0.028 26021 13069 1 20 . 1 1 104 104 LYS C C 104 179.301 179.301 179.091 0.210 26021 13070 1 20 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.943 0.821 26021 13071 1 20 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.742 0.305 26021 13072 1 20 . 1 1 104 104 LYS H H 104 7.916 7.916 7.473 0.443 26021 13073 1 20 . 1 1 105 105 ARG N N 105 117.967 117.967 118.706 -0.739 26021 13074 1 20 . 1 1 105 105 ARG HA H 105 4.026 4.026 3.961 0.065 26021 13075 1 20 . 1 1 105 105 ARG C C 105 178.777 178.777 178.278 0.499 26021 13076 1 20 . 1 1 105 105 ARG CA C 105 59.364 59.364 60.068 -0.704 26021 13077 1 20 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.301 0.696 26021 13078 1 20 . 1 1 105 105 ARG H H 105 7.719 7.719 8.230 -0.511 26021 13079 1 20 . 1 1 106 106 THR N N 106 117.211 117.211 111.029 6.182 26021 13080 1 20 . 1 1 106 106 THR HA H 106 4.301 4.301 4.367 -0.066 26021 13081 1 20 . 1 1 106 106 THR C C 106 176.254 176.254 176.255 -0.001 26021 13082 1 20 . 1 1 106 106 THR CA C 106 67.860 67.860 65.023 2.837 26021 13083 1 20 . 1 1 106 106 THR CB C 106 67.860 67.860 68.400 -0.540 26021 13084 1 20 . 1 1 106 106 THR H H 106 8.152 8.152 7.478 0.674 26021 13085 1 20 . 1 1 107 107 THR N N 107 117.939 117.939 119.462 -1.523 26021 13086 1 20 . 1 1 107 107 THR HA H 107 3.971 3.971 3.934 0.037 26021 13087 1 20 . 1 1 107 107 THR C C 107 176.780 176.780 176.124 0.656 26021 13088 1 20 . 1 1 107 107 THR CA C 107 66.822 66.822 67.102 -0.280 26021 13089 1 20 . 1 1 107 107 THR CB C 107 68.818 68.818 68.183 0.635 26021 13090 1 20 . 1 1 107 107 THR H H 107 8.651 8.651 7.908 0.743 26021 13091 1 20 . 1 1 108 108 LYS N N 108 120.867 120.867 121.083 -0.216 26021 13092 1 20 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.006 0.016 26021 13093 1 20 . 1 1 108 108 LYS C C 108 179.045 179.045 179.100 -0.055 26021 13094 1 20 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.723 0.111 26021 13095 1 20 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.413 0.060 26021 13096 1 20 . 1 1 108 108 LYS H H 108 7.694 7.694 7.900 -0.206 26021 13097 1 20 . 1 1 109 109 LEU N N 109 119.472 119.472 119.126 0.346 26021 13098 1 20 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.321 0.000 26021 13099 1 20 . 1 1 109 109 LEU C C 109 179.974 179.974 178.994 0.980 26021 13100 1 20 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.296 0.297 26021 13101 1 20 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.006 -0.146 26021 13102 1 20 . 1 1 109 109 LEU H H 109 7.559 7.559 7.697 -0.138 26021 13103 1 20 . 1 1 110 110 LEU N N 110 121.832 121.832 119.443 2.389 26021 13104 1 20 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.064 0.127 26021 13105 1 20 . 1 1 110 110 LEU C C 110 178.101 178.101 179.451 -1.350 26021 13106 1 20 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.886 0.006 26021 13107 1 20 . 1 1 110 110 LEU CB C 110 41.884 41.884 40.389 1.495 26021 13108 1 20 . 1 1 110 110 LEU H H 110 8.567 8.567 7.962 0.605 26021 13109 1 20 . 1 1 111 111 LYS N N 111 117.972 117.972 117.427 0.545 26021 13110 1 20 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.171 -0.192 26021 13111 1 20 . 1 1 111 111 LYS C C 111 177.677 177.677 178.266 -0.589 26021 13112 1 20 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.289 0.496 26021 13113 1 20 . 1 1 111 111 LYS CB C 111 32.209 32.209 32.160 0.049 26021 13114 1 20 . 1 1 111 111 LYS H H 111 7.965 7.965 7.883 0.082 26021 13115 1 20 . 1 1 112 112 LYS N N 112 115.433 115.433 118.288 -2.855 26021 13116 1 20 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.207 -0.097 26021 13117 1 20 . 1 1 112 112 LYS C C 112 178.270 178.270 178.508 -0.238 26021 13118 1 20 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.627 0.324 26021 13119 1 20 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.672 0.119 26021 13120 1 20 . 1 1 112 112 LYS H H 112 7.334 7.334 7.868 -0.534 26021 13121 1 20 . 1 1 113 113 VAL N N 113 114.861 114.861 119.754 -4.893 26021 13122 1 20 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.856 -0.025 26021 13123 1 20 . 1 1 113 113 VAL C C 113 176.999 176.999 177.499 -0.500 26021 13124 1 20 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.181 -1.676 26021 13125 1 20 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.723 0.564 26021 13126 1 20 . 1 1 113 113 VAL H H 113 7.298 7.298 7.998 -0.700 26021 13127 1 20 . 1 1 114 114 VAL N N 114 121.457 121.457 119.345 2.112 26021 13128 1 20 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.756 -0.034 26021 13129 1 20 . 1 1 114 114 VAL C C 114 177.737 177.737 177.034 0.703 26021 13130 1 20 . 1 1 114 114 VAL CA C 114 65.224 65.224 65.196 0.028 26021 13131 1 20 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.436 0.317 26021 13132 1 20 . 1 1 114 114 VAL H H 114 7.855 7.855 7.680 0.175 26021 13133 1 20 . 1 1 115 115 ASP N N 115 120.804 120.804 120.552 0.252 26021 13134 1 20 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.467 -0.012 26021 13135 1 20 . 1 1 115 115 ASP C C 115 177.380 177.380 177.575 -0.195 26021 13136 1 20 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.774 -0.853 26021 13137 1 20 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.896 -0.524 26021 13138 1 20 . 1 1 115 115 ASP H H 115 8.311 8.311 8.420 -0.109 26021 13139 1 20 . 1 1 116 116 LYS N N 116 119.582 119.582 118.109 1.473 26021 13140 1 20 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.337 -0.242 26021 13141 1 20 . 1 1 116 116 LYS C C 116 177.077 177.077 178.740 -1.663 26021 13142 1 20 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.558 0.153 26021 13143 1 20 . 1 1 116 116 LYS CB C 116 33.488 33.488 32.856 0.632 26021 13144 1 20 . 1 1 116 116 LYS H H 116 7.639 7.639 7.978 -0.339 26021 13145 1 20 . 1 1 117 117 HIS N N 117 115.246 115.246 117.196 -1.950 26021 13146 1 20 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.379 0.246 26021 13147 1 20 . 1 1 117 117 HIS C C 117 175.497 175.497 176.588 -1.091 26021 13148 1 20 . 1 1 117 117 HIS CA C 117 56.175 56.175 57.293 -1.118 26021 13149 1 20 . 1 1 117 117 HIS CB C 117 30.475 30.475 30.448 0.027 26021 13150 1 20 . 1 1 117 117 HIS H H 117 8.108 8.108 7.967 0.141 26021 13151 1 20 . 1 1 118 118 GLY N N 118 109.944 109.944 107.834 2.110 26021 13152 1 20 . 1 1 118 118 GLY C C 118 174.093 174.093 174.781 -0.688 26021 13153 1 20 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.583 0.481 26021 13154 1 20 . 1 1 118 118 GLY H H 118 8.153 8.153 7.932 0.221 26021 13155 1 20 . 1 1 119 119 ILE N N 119 118.468 118.468 122.579 -4.111 26021 13156 1 20 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.824 0.298 26021 13157 1 20 . 1 1 119 119 ILE C C 119 174.777 174.777 174.680 0.097 26021 13158 1 20 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.493 -0.392 26021 13159 1 20 . 1 1 119 119 ILE CB C 119 38.631 38.631 35.206 3.425 26021 13160 1 20 . 1 1 119 119 ILE H H 119 7.828 7.828 7.458 0.370 26021 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 111 2.428 -0.592 2.365 26021 2 1 1 "Average Difference" HA 124 0.201 -0.008 0.202 26021 3 1 1 "Average Difference" C 109 0.842 -0.102 0.840 26021 4 1 1 "Average Difference" CA 115 0.977 -0.227 0.954 26021 5 1 1 "Average Difference" CB 106 0.748 -0.078 0.748 26021 6 1 1 "Average Difference" HN 111 0.473 -0.183 0.439 26021 7 1 2 "Average Difference" N 111 2.401 -0.380 2.381 26021 8 1 2 "Average Difference" HA 124 0.210 -0.020 0.210 26021 9 1 2 "Average Difference" C 109 0.805 -0.113 0.801 26021 10 1 2 "Average Difference" CA 115 0.904 -0.244 0.875 26021 11 1 2 "Average Difference" CB 106 0.796 -0.094 0.794 26021 12 1 2 "Average Difference" HN 111 0.495 -0.189 0.460 26021 13 1 3 "Average Difference" N 111 2.399 -0.626 2.327 26021 14 1 3 "Average Difference" HA 124 0.221 0.007 0.222 26021 15 1 3 "Average Difference" C 109 0.793 -0.158 0.780 26021 16 1 3 "Average Difference" CA 115 1.027 -0.295 0.988 26021 17 1 3 "Average Difference" CB 106 0.715 -0.070 0.715 26021 18 1 3 "Average Difference" HN 111 0.473 -0.194 0.434 26021 19 1 4 "Average Difference" N 111 2.359 -0.475 2.321 26021 20 1 4 "Average Difference" HA 124 0.204 -0.008 0.205 26021 21 1 4 "Average Difference" C 109 0.841 -0.124 0.836 26021 22 1 4 "Average Difference" CA 115 0.945 -0.242 0.917 26021 23 1 4 "Average Difference" CB 106 0.792 -0.096 0.789 26021 24 1 4 "Average Difference" HN 111 0.489 -0.211 0.443 26021 25 1 5 "Average Difference" N 111 2.389 -0.568 2.331 26021 26 1 5 "Average Difference" HA 124 0.216 -0.000 0.216 26021 27 1 5 "Average Difference" C 109 0.821 -0.124 0.816 26021 28 1 5 "Average Difference" CA 115 1.041 -0.290 1.004 26021 29 1 5 "Average Difference" CB 106 0.738 -0.083 0.736 26021 30 1 5 "Average Difference" HN 111 0.486 -0.224 0.433 26021 31 1 6 "Average Difference" N 111 2.322 -0.547 2.267 26021 32 1 6 "Average Difference" HA 124 0.210 -0.020 0.210 26021 33 1 6 "Average Difference" C 109 0.840 -0.146 0.831 26021 34 1 6 "Average Difference" CA 115 0.963 -0.274 0.927 26021 35 1 6 "Average Difference" CB 106 0.794 -0.120 0.789 26021 36 1 6 "Average Difference" HN 111 0.498 -0.209 0.454 26021 37 1 7 "Average Difference" N 111 2.291 -0.438 2.259 26021 38 1 7 "Average Difference" HA 124 0.214 0.003 0.215 26021 39 1 7 "Average Difference" C 109 0.786 -0.077 0.786 26021 40 1 7 "Average Difference" CA 115 0.957 -0.229 0.933 26021 41 1 7 "Average Difference" CB 106 0.752 -0.054 0.754 26021 42 1 7 "Average Difference" HN 111 0.494 -0.189 0.459 26021 43 1 8 "Average Difference" N 111 2.320 -0.430 2.291 26021 44 1 8 "Average Difference" HA 124 0.205 -0.005 0.206 26021 45 1 8 "Average Difference" C 109 0.825 -0.105 0.822 26021 46 1 8 "Average Difference" CA 115 0.944 -0.285 0.904 26021 47 1 8 "Average Difference" CB 106 0.762 -0.098 0.759 26021 48 1 8 "Average Difference" HN 111 0.476 -0.158 0.451 26021 49 1 9 "Average Difference" N 111 2.431 -0.493 2.391 26021 50 1 9 "Average Difference" HA 124 0.192 0.003 0.193 26021 51 1 9 "Average Difference" C 109 0.805 -0.120 0.800 26021 52 1 9 "Average Difference" CA 115 0.979 -0.338 0.923 26021 53 1 9 "Average Difference" CB 106 0.752 -0.112 0.747 26021 54 1 9 "Average Difference" HN 111 0.471 -0.217 0.420 26021 55 1 10 "Average Difference" N 111 2.446 -0.669 2.364 26021 56 1 10 "Average Difference" HA 124 0.205 0.014 0.205 26021 57 1 10 "Average Difference" C 109 0.787 -0.121 0.781 26021 58 1 10 "Average Difference" CA 115 0.965 -0.290 0.925 26021 59 1 10 "Average Difference" CB 106 0.769 -0.055 0.770 26021 60 1 10 "Average Difference" HN 111 0.483 -0.214 0.435 26021 61 1 11 "Average Difference" N 111 2.199 -0.406 2.171 26021 62 1 11 "Average Difference" HA 124 0.184 -0.006 0.184 26021 63 1 11 "Average Difference" C 109 0.788 -0.116 0.784 26021 64 1 11 "Average Difference" CA 115 0.942 -0.248 0.913 26021 65 1 11 "Average Difference" CB 106 0.808 -0.085 0.807 26021 66 1 11 "Average Difference" HN 111 0.499 -0.209 0.455 26021 67 1 12 "Average Difference" N 111 2.295 -0.408 2.268 26021 68 1 12 "Average Difference" HA 124 0.212 -0.008 0.213 26021 69 1 12 "Average Difference" C 109 0.797 -0.141 0.789 26021 70 1 12 "Average Difference" CA 115 0.935 -0.233 0.910 26021 71 1 12 "Average Difference" CB 106 0.736 -0.086 0.735 26021 72 1 12 "Average Difference" HN 111 0.525 -0.216 0.481 26021 73 1 13 "Average Difference" N 111 2.664 -0.664 2.592 26021 74 1 13 "Average Difference" HA 124 0.206 -0.001 0.207 26021 75 1 13 "Average Difference" C 109 0.835 -0.136 0.828 26021 76 1 13 "Average Difference" CA 115 0.952 -0.242 0.925 26021 77 1 13 "Average Difference" CB 106 0.684 -0.063 0.684 26021 78 1 13 "Average Difference" HN 111 0.487 -0.196 0.448 26021 79 1 14 "Average Difference" N 111 2.275 -0.456 2.239 26021 80 1 14 "Average Difference" HA 124 0.213 -0.009 0.214 26021 81 1 14 "Average Difference" C 109 0.834 -0.146 0.825 26021 82 1 14 "Average Difference" CA 115 0.997 -0.252 0.969 26021 83 1 14 "Average Difference" CB 106 0.825 -0.097 0.823 26021 84 1 14 "Average Difference" HN 111 0.520 -0.208 0.479 26021 85 1 15 "Average Difference" N 111 2.517 -0.493 2.479 26021 86 1 15 "Average Difference" HA 124 0.213 -0.004 0.214 26021 87 1 15 "Average Difference" C 109 0.837 -0.137 0.830 26021 88 1 15 "Average Difference" CA 115 1.011 -0.200 0.996 26021 89 1 15 "Average Difference" CB 106 0.721 -0.078 0.721 26021 90 1 15 "Average Difference" HN 111 0.492 -0.188 0.456 26021 91 1 16 "Average Difference" N 111 2.506 -0.446 2.477 26021 92 1 16 "Average Difference" HA 124 0.214 -0.018 0.214 26021 93 1 16 "Average Difference" C 109 0.805 -0.169 0.790 26021 94 1 16 "Average Difference" CA 115 0.952 -0.200 0.934 26021 95 1 16 "Average Difference" CB 106 0.705 -0.095 0.701 26021 96 1 16 "Average Difference" HN 111 0.500 -0.186 0.466 26021 97 1 17 "Average Difference" N 111 2.378 -0.464 2.343 26021 98 1 17 "Average Difference" HA 124 0.208 0.006 0.208 26021 99 1 17 "Average Difference" C 109 0.791 -0.160 0.778 26021 100 1 17 "Average Difference" CA 115 1.056 -0.303 1.016 26021 101 1 17 "Average Difference" CB 106 0.709 -0.080 0.708 26021 102 1 17 "Average Difference" HN 111 0.519 -0.226 0.469 26021 103 1 18 "Average Difference" N 111 2.178 -0.296 2.168 26021 104 1 18 "Average Difference" HA 124 0.200 -0.009 0.201 26021 105 1 18 "Average Difference" C 109 0.801 -0.122 0.795 26021 106 1 18 "Average Difference" CA 115 0.924 -0.249 0.894 26021 107 1 18 "Average Difference" CB 106 0.782 -0.128 0.775 26021 108 1 18 "Average Difference" HN 111 0.499 -0.192 0.463 26021 109 1 19 "Average Difference" N 111 2.491 -0.329 2.480 26021 110 1 19 "Average Difference" HA 124 0.198 -0.006 0.198 26021 111 1 19 "Average Difference" C 109 0.833 -0.111 0.829 26021 112 1 19 "Average Difference" CA 115 0.970 -0.241 0.944 26021 113 1 19 "Average Difference" CB 106 0.816 -0.078 0.816 26021 114 1 19 "Average Difference" HN 111 0.474 -0.207 0.428 26021 115 1 20 "Average Difference" N 111 2.470 -0.481 2.434 26021 116 1 20 "Average Difference" HA 124 0.199 -0.002 0.200 26021 117 1 20 "Average Difference" C 109 0.869 -0.192 0.851 26021 118 1 20 "Average Difference" CA 115 0.970 -0.317 0.921 26021 119 1 20 "Average Difference" CB 106 0.816 -0.095 0.814 26021 120 1 20 "Average Difference" HN 111 0.470 -0.198 0.428 26021 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 26021 _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 4 4 ASN HA H 4 4.749 4.749 4.607 0.142 26021 2 1 . 1 1 4 4 ASN C C 4 175.260 175.260 175.730 -0.470 26021 3 1 . 1 1 4 4 ASN CA C 4 53.831 53.831 54.310 -0.479 26021 4 1 . 1 1 4 4 ASN CB C 4 38.681 38.681 38.522 0.159 26021 5 1 . 1 1 5 5 ALA N N 5 123.648 123.648 121.325 2.323 26021 6 1 . 1 1 5 5 ALA HA H 5 4.290 4.290 4.620 -0.330 26021 7 1 . 1 1 5 5 ALA C C 5 178.256 178.256 178.625 -0.369 26021 8 1 . 1 1 5 5 ALA CA C 5 53.081 53.081 51.669 1.412 26021 9 1 . 1 1 5 5 ALA CB C 5 19.025 19.025 18.844 0.181 26021 10 1 . 1 1 5 5 ALA H H 5 8.520 8.520 8.135 0.385 26021 11 1 . 1 1 6 6 GLY N N 6 107.044 107.044 108.146 -1.102 26021 12 1 . 1 1 6 6 GLY C C 6 174.961 174.961 175.360 -0.399 26021 13 1 . 1 1 6 6 GLY CA C 6 45.830 45.830 46.927 -1.097 26021 14 1 . 1 1 6 6 GLY H H 6 8.350 8.350 8.042 0.308 26021 15 1 . 1 1 7 7 ALA N N 7 123.366 123.366 123.594 -0.228 26021 16 1 . 1 1 7 7 ALA HA H 7 4.216 4.216 4.117 0.099 26021 17 1 . 1 1 7 7 ALA C C 7 179.006 179.006 178.839 0.167 26021 18 1 . 1 1 7 7 ALA CA C 7 53.703 53.703 54.549 -0.846 26021 19 1 . 1 1 7 7 ALA CB C 7 18.844 18.844 18.422 0.422 26021 20 1 . 1 1 7 7 ALA H H 7 8.078 8.078 8.070 0.008 26021 21 1 . 1 1 8 8 ILE N N 8 117.376 117.376 118.437 -1.061 26021 22 1 . 1 1 8 8 ILE HA H 8 3.780 3.780 3.743 0.037 26021 23 1 . 1 1 8 8 ILE C C 8 177.032 177.032 178.238 -1.206 26021 24 1 . 1 1 8 8 ILE CA C 8 63.158 63.158 64.149 -0.991 26021 25 1 . 1 1 8 8 ILE CB C 8 36.289 36.289 38.000 -1.711 26021 26 1 . 1 1 8 8 ILE H H 8 7.943 7.943 7.510 0.433 26021 27 1 . 1 1 9 9 ALA N N 9 121.414 121.414 122.753 -1.339 26021 28 1 . 1 1 9 9 ALA HA H 9 3.933 3.933 4.061 -0.128 26021 29 1 . 1 1 9 9 ALA C C 9 180.515 180.515 179.226 1.289 26021 30 1 . 1 1 9 9 ALA CA C 9 55.098 55.098 54.819 0.279 26021 31 1 . 1 1 9 9 ALA CB C 9 18.161 18.161 18.127 0.034 26021 32 1 . 1 1 9 9 ALA H H 9 8.062 8.062 7.889 0.173 26021 33 1 . 1 1 10 10 LYS N N 10 114.594 114.594 118.745 -4.151 26021 34 1 . 1 1 10 10 LYS HA H 10 4.164 4.164 4.118 0.046 26021 35 1 . 1 1 10 10 LYS C C 10 178.099 178.099 178.030 0.069 26021 36 1 . 1 1 10 10 LYS CA C 10 57.840 57.840 58.180 -0.340 26021 37 1 . 1 1 10 10 LYS CB C 10 32.469 32.469 32.193 0.276 26021 38 1 . 1 1 10 10 LYS H H 10 7.554 7.554 7.863 -0.309 26021 39 1 . 1 1 11 11 LEU N N 11 119.662 119.662 118.671 0.991 26021 40 1 . 1 1 11 11 LEU HA H 11 4.078 4.078 4.149 -0.071 26021 41 1 . 1 1 11 11 LEU C C 11 177.930 177.930 178.079 -0.149 26021 42 1 . 1 1 11 11 LEU CA C 11 56.556 56.556 56.169 0.387 26021 43 1 . 1 1 11 11 LEU CB C 11 43.088 43.088 41.771 1.317 26021 44 1 . 1 1 11 11 LEU H H 11 7.814 7.814 7.373 0.441 26021 45 1 . 1 1 12 12 ILE N N 12 117.945 117.945 120.646 -2.701 26021 46 1 . 1 1 12 12 ILE HA H 12 3.692 3.692 3.902 -0.210 26021 47 1 . 1 1 12 12 ILE CA C 12 67.629 67.629 66.065 1.564 26021 48 1 . 1 1 12 12 ILE CB C 12 36.410 36.410 34.765 1.646 26021 49 1 . 1 1 12 12 ILE H H 12 7.426 7.426 7.601 -0.175 26021 50 1 . 1 1 13 13 PRO HA H 13 4.403 4.403 4.292 0.111 26021 51 1 . 1 1 13 13 PRO C C 13 179.030 179.030 178.728 0.302 26021 52 1 . 1 1 13 13 PRO CA C 13 65.244 65.244 65.148 0.096 26021 53 1 . 1 1 13 13 PRO CB C 13 30.809 30.809 31.034 -0.225 26021 54 1 . 1 1 14 14 LYS N N 14 117.855 117.855 118.616 -0.761 26021 55 1 . 1 1 14 14 LYS HA H 14 4.145 4.145 4.065 0.080 26021 56 1 . 1 1 14 14 LYS C C 14 178.565 178.565 178.589 -0.024 26021 57 1 . 1 1 14 14 LYS CA C 14 59.433 59.433 59.212 0.221 26021 58 1 . 1 1 14 14 LYS CB C 14 32.925 32.925 32.033 0.892 26021 59 1 . 1 1 14 14 LYS H H 14 6.685 6.685 7.441 -0.756 26021 60 1 . 1 1 15 15 LEU N N 15 118.008 118.008 117.177 0.831 26021 61 1 . 1 1 15 15 LEU HA H 15 4.003 4.003 4.351 -0.348 26021 62 1 . 1 1 15 15 LEU C C 15 178.662 178.662 178.989 -0.327 26021 63 1 . 1 1 15 15 LEU CA C 15 57.712 57.712 56.592 1.120 26021 64 1 . 1 1 15 15 LEU CB C 15 41.999 41.999 42.229 -0.230 26021 65 1 . 1 1 15 15 LEU H H 15 8.148 8.148 7.552 0.596 26021 66 1 . 1 1 16 16 GLY N N 16 103.895 103.895 108.121 -4.225 26021 67 1 . 1 1 16 16 GLY C C 16 176.838 176.838 175.915 0.923 26021 68 1 . 1 1 16 16 GLY CA C 16 47.365 47.365 47.038 0.327 26021 69 1 . 1 1 16 16 GLY H H 16 8.104 8.104 7.832 0.272 26021 70 1 . 1 1 17 17 GLU N N 17 121.655 121.655 121.729 -0.074 26021 71 1 . 1 1 17 17 GLU HA H 17 4.133 4.133 4.128 0.005 26021 72 1 . 1 1 17 17 GLU C C 17 179.007 179.007 178.373 0.634 26021 73 1 . 1 1 17 17 GLU CA C 17 58.811 58.811 58.970 -0.159 26021 74 1 . 1 1 17 17 GLU CB C 17 29.133 29.133 29.603 -0.470 26021 75 1 . 1 1 17 17 GLU H H 17 7.817 7.817 7.734 0.083 26021 76 1 . 1 1 18 18 LEU N N 18 117.834 117.834 117.599 0.235 26021 77 1 . 1 1 18 18 LEU HA H 18 4.118 4.118 4.377 -0.259 26021 78 1 . 1 1 18 18 LEU C C 18 177.658 177.658 177.542 0.116 26021 79 1 . 1 1 18 18 LEU CA C 18 57.029 57.029 55.577 1.452 26021 80 1 . 1 1 18 18 LEU CB C 18 41.670 41.670 41.621 0.049 26021 81 1 . 1 1 18 18 LEU H H 18 7.389 7.389 7.799 -0.410 26021 82 1 . 1 1 19 19 LEU N N 19 113.694 113.694 117.476 -3.782 26021 83 1 . 1 1 19 19 LEU HA H 19 4.162 4.162 4.373 -0.211 26021 84 1 . 1 1 19 19 LEU C C 19 178.123 178.123 178.223 -0.100 26021 85 1 . 1 1 19 19 LEU CA C 19 55.852 55.852 55.528 0.324 26021 86 1 . 1 1 19 19 LEU CB C 19 42.220 42.220 42.067 0.153 26021 87 1 . 1 1 19 19 LEU H H 19 7.269 7.269 7.567 -0.298 26021 88 1 . 1 1 20 20 VAL N N 20 112.778 112.778 114.408 -1.630 26021 89 1 . 1 1 20 20 VAL HA H 20 4.443 4.443 4.093 0.350 26021 90 1 . 1 1 20 20 VAL C C 20 177.021 177.021 176.870 0.151 26021 91 1 . 1 1 20 20 VAL CA C 20 61.855 61.855 63.739 -1.884 26021 92 1 . 1 1 20 20 VAL CB C 20 32.778 32.778 32.228 0.550 26021 93 1 . 1 1 20 20 VAL H H 20 7.356 7.356 7.627 -0.271 26021 94 1 . 1 1 21 21 GLY N N 21 108.962 108.962 108.407 0.555 26021 95 1 . 1 1 21 21 GLY C C 21 173.813 173.813 174.122 -0.309 26021 96 1 . 1 1 21 21 GLY CA C 21 45.046 45.046 44.916 0.130 26021 97 1 . 1 1 21 21 GLY H H 21 7.925 7.925 8.284 -0.359 26021 98 1 . 1 1 22 22 GLU N N 22 120.607 120.607 122.194 -1.587 26021 99 1 . 1 1 22 22 GLU HA H 22 4.278 4.278 4.498 -0.220 26021 100 1 . 1 1 22 22 GLU C C 22 175.869 175.869 175.312 0.557 26021 101 1 . 1 1 22 22 GLU CA C 22 56.030 56.030 55.480 0.550 26021 102 1 . 1 1 22 22 GLU CB C 22 28.681 28.681 29.014 -0.333 26021 103 1 . 1 1 22 22 GLU H H 22 8.300 8.300 8.348 -0.048 26021 104 1 . 1 1 23 23 TYR N N 23 120.738 120.738 119.935 0.803 26021 105 1 . 1 1 23 23 TYR HA H 23 4.557 4.557 4.875 -0.318 26021 106 1 . 1 1 23 23 TYR C C 23 175.264 175.264 174.484 0.780 26021 107 1 . 1 1 23 23 TYR CA C 23 57.561 57.561 57.077 0.484 26021 108 1 . 1 1 23 23 TYR CB C 23 39.246 39.246 39.748 -0.502 26021 109 1 . 1 1 23 23 TYR H H 23 7.756 7.756 7.600 0.156 26021 110 1 . 1 1 24 24 LYS N N 24 122.095 122.095 122.526 -0.431 26021 111 1 . 1 1 24 24 LYS HA H 24 4.183 4.183 4.563 -0.380 26021 112 1 . 1 1 24 24 LYS C C 24 175.742 175.742 174.792 0.950 26021 113 1 . 1 1 24 24 LYS CA C 24 56.118 56.118 55.922 0.196 26021 114 1 . 1 1 24 24 LYS CB C 24 30.719 30.719 30.901 -0.182 26021 115 1 . 1 1 24 24 LYS H H 24 8.692 8.692 8.641 0.051 26021 116 1 . 1 1 25 25 LEU N N 25 121.123 121.123 118.773 2.350 26021 117 1 . 1 1 25 25 LEU HA H 25 4.492 4.492 4.640 -0.148 26021 118 1 . 1 1 25 25 LEU C C 25 177.487 177.487 176.108 1.379 26021 119 1 . 1 1 25 25 LEU CA C 25 54.334 54.334 53.603 0.731 26021 120 1 . 1 1 25 25 LEU CB C 25 43.758 43.758 44.325 -0.567 26021 121 1 . 1 1 25 25 LEU H H 25 8.088 8.088 7.557 0.531 26021 122 1 . 1 1 26 26 HIS N N 26 122.993 122.993 118.970 4.023 26021 123 1 . 1 1 26 26 HIS HA H 26 4.501 4.501 4.636 -0.135 26021 124 1 . 1 1 26 26 HIS C C 26 176.716 176.716 176.437 0.279 26021 125 1 . 1 1 26 26 HIS CA C 26 57.197 57.197 55.964 1.233 26021 126 1 . 1 1 26 26 HIS CB C 26 31.357 31.357 30.802 0.555 26021 127 1 . 1 1 26 26 HIS H H 26 8.882 8.882 8.457 0.425 26021 128 1 . 1 1 27 27 LYS N N 27 124.894 124.894 122.391 2.503 26021 129 1 . 1 1 27 27 LYS HA H 27 3.948 3.948 4.284 -0.336 26021 130 1 . 1 1 27 27 LYS C C 27 178.873 178.873 178.484 0.389 26021 131 1 . 1 1 27 27 LYS CA C 27 60.011 60.011 58.593 1.418 26021 132 1 . 1 1 27 27 LYS CB C 27 32.442 32.442 32.447 -0.005 26021 133 1 . 1 1 27 27 LYS H H 27 8.699 8.699 8.428 0.271 26021 134 1 . 1 1 28 28 GLY N N 28 111.258 111.258 106.284 4.974 26021 135 1 . 1 1 28 28 GLY C C 28 176.131 176.131 175.663 0.468 26021 136 1 . 1 1 28 28 GLY CA C 28 46.490 46.490 46.423 0.068 26021 137 1 . 1 1 28 28 GLY H H 28 9.814 9.814 8.462 1.352 26021 138 1 . 1 1 29 29 VAL N N 29 122.719 122.719 121.699 1.020 26021 139 1 . 1 1 29 29 VAL HA H 29 3.892 3.892 3.670 0.222 26021 140 1 . 1 1 29 29 VAL C C 29 177.628 177.628 177.699 -0.071 26021 141 1 . 1 1 29 29 VAL CA C 29 65.520 65.520 65.361 0.159 26021 142 1 . 1 1 29 29 VAL CB C 29 31.742 31.742 31.526 0.216 26021 143 1 . 1 1 29 29 VAL H H 29 7.431 7.431 7.384 0.047 26021 144 1 . 1 1 30 30 LYS N N 30 119.791 119.791 119.224 0.567 26021 145 1 . 1 1 30 30 LYS HA H 30 3.635 3.635 3.862 -0.226 26021 146 1 . 1 1 30 30 LYS C C 30 177.666 177.666 178.300 -0.634 26021 147 1 . 1 1 30 30 LYS CA C 30 61.024 61.024 59.435 1.589 26021 148 1 . 1 1 30 30 LYS CB C 30 32.405 32.405 31.543 0.862 26021 149 1 . 1 1 30 30 LYS H H 30 8.255 8.255 7.895 0.360 26021 150 1 . 1 1 31 31 LYS N N 31 117.918 117.918 118.099 -0.181 26021 151 1 . 1 1 31 31 LYS HA H 31 4.116 4.116 4.084 0.032 26021 152 1 . 1 1 31 31 LYS C C 31 177.784 177.784 178.644 -0.860 26021 153 1 . 1 1 31 31 LYS CA C 31 58.703 58.703 59.236 -0.533 26021 154 1 . 1 1 31 31 LYS CB C 31 31.845 31.845 31.960 -0.115 26021 155 1 . 1 1 31 31 LYS H H 31 7.689 7.689 7.725 -0.036 26021 156 1 . 1 1 32 32 ASN N N 32 116.347 116.347 117.204 -0.858 26021 157 1 . 1 1 32 32 ASN HA H 32 4.520 4.520 4.356 0.164 26021 158 1 . 1 1 32 32 ASN C C 32 177.764 177.764 177.080 0.684 26021 159 1 . 1 1 32 32 ASN CA C 32 56.315 56.315 55.645 0.670 26021 160 1 . 1 1 32 32 ASN CB C 32 38.632 38.632 38.602 0.030 26021 161 1 . 1 1 32 32 ASN H H 32 7.556 7.556 7.759 -0.203 26021 162 1 . 1 1 33 33 ILE N N 33 120.592 120.592 120.192 0.400 26021 163 1 . 1 1 33 33 ILE HA H 33 3.282 3.282 3.719 -0.437 26021 164 1 . 1 1 33 33 ILE C C 33 177.074 177.074 177.538 -0.464 26021 165 1 . 1 1 33 33 ILE CA C 33 65.888 65.888 63.663 2.225 26021 166 1 . 1 1 33 33 ILE CB C 33 37.178 37.178 37.033 0.145 26021 167 1 . 1 1 33 33 ILE H H 33 8.236 8.236 7.640 0.596 26021 168 1 . 1 1 34 34 GLU N N 34 120.595 120.595 119.539 1.056 26021 169 1 . 1 1 34 34 GLU HA H 34 3.788 3.788 3.875 -0.087 26021 170 1 . 1 1 34 34 GLU C C 34 179.739 179.739 178.733 1.006 26021 171 1 . 1 1 34 34 GLU CA C 34 60.239 60.239 59.701 0.539 26021 172 1 . 1 1 34 34 GLU CB C 34 29.845 29.845 28.873 0.972 26021 173 1 . 1 1 34 34 GLU H H 34 8.551 8.551 8.407 0.144 26021 174 1 . 1 1 35 35 ASP N N 35 120.600 120.600 120.587 0.013 26021 175 1 . 1 1 35 35 ASP HA H 35 4.412 4.412 4.484 -0.072 26021 176 1 . 1 1 35 35 ASP C C 35 178.681 178.681 178.463 0.218 26021 177 1 . 1 1 35 35 ASP CA C 35 57.462 57.462 56.812 0.650 26021 178 1 . 1 1 35 35 ASP CB C 35 39.750 39.750 40.750 -0.999 26021 179 1 . 1 1 35 35 ASP H H 35 8.670 8.670 7.731 0.939 26021 180 1 . 1 1 36 36 LEU N N 36 123.004 123.004 120.866 2.138 26021 181 1 . 1 1 36 36 LEU HA H 36 4.095 4.095 4.288 -0.193 26021 182 1 . 1 1 36 36 LEU C C 36 178.035 178.035 179.083 -1.048 26021 183 1 . 1 1 36 36 LEU CA C 36 58.028 58.028 57.641 0.387 26021 184 1 . 1 1 36 36 LEU CB C 36 41.876 41.876 42.149 -0.274 26021 185 1 . 1 1 36 36 LEU H H 36 8.166 8.166 7.670 0.496 26021 186 1 . 1 1 37 37 LEU N N 37 120.178 120.178 119.771 0.407 26021 187 1 . 1 1 37 37 LEU HA H 37 3.856 3.856 4.034 -0.177 26021 188 1 . 1 1 37 37 LEU C C 37 178.128 178.128 178.154 -0.026 26021 189 1 . 1 1 37 37 LEU CA C 37 58.675 58.675 57.906 0.769 26021 190 1 . 1 1 37 37 LEU CB C 37 42.155 42.155 41.542 0.613 26021 191 1 . 1 1 37 37 LEU H H 37 8.736 8.736 8.177 0.559 26021 192 1 . 1 1 38 38 LYS N N 38 118.110 118.110 119.231 -1.121 26021 193 1 . 1 1 38 38 LYS HA H 38 3.933 3.933 3.906 0.027 26021 194 1 . 1 1 38 38 LYS C C 38 179.533 179.533 178.839 0.694 26021 195 1 . 1 1 38 38 LYS CA C 38 60.273 60.273 60.041 0.232 26021 196 1 . 1 1 38 38 LYS CB C 38 32.277 32.277 32.199 0.078 26021 197 1 . 1 1 38 38 LYS H H 38 7.770 7.770 7.876 -0.106 26021 198 1 . 1 1 39 39 GLU N N 39 119.265 119.265 119.028 0.237 26021 199 1 . 1 1 39 39 GLU HA H 39 4.302 4.302 4.128 0.174 26021 200 1 . 1 1 39 39 GLU C C 39 179.720 179.720 179.106 0.614 26021 201 1 . 1 1 39 39 GLU CA C 39 58.758 58.758 59.050 -0.292 26021 202 1 . 1 1 39 39 GLU CB C 39 29.590 29.590 29.495 0.095 26021 203 1 . 1 1 39 39 GLU H H 39 7.709 7.709 7.721 -0.012 26021 204 1 . 1 1 40 40 LEU N N 40 119.007 119.007 120.475 -1.468 26021 205 1 . 1 1 40 40 LEU HA H 40 4.050 4.050 4.122 -0.072 26021 206 1 . 1 1 40 40 LEU C C 40 179.690 179.690 178.929 0.761 26021 207 1 . 1 1 40 40 LEU CA C 40 57.651 57.651 57.380 0.271 26021 208 1 . 1 1 40 40 LEU CB C 40 41.685 41.685 41.146 0.539 26021 209 1 . 1 1 40 40 LEU H H 40 8.851 8.851 7.964 0.887 26021 210 1 . 1 1 41 41 LYS N N 41 120.500 120.500 118.961 1.539 26021 211 1 . 1 1 41 41 LYS HA H 41 3.952 3.952 4.013 -0.061 26021 212 1 . 1 1 41 41 LYS C C 41 180.223 180.223 179.008 1.215 26021 213 1 . 1 1 41 41 LYS CA C 41 60.891 60.891 59.810 1.081 26021 214 1 . 1 1 41 41 LYS CB C 41 32.067 32.067 32.113 -0.046 26021 215 1 . 1 1 41 41 LYS H H 41 8.482 8.482 8.394 0.088 26021 216 1 . 1 1 42 42 THR N N 42 119.555 119.555 112.542 7.013 26021 217 1 . 1 1 42 42 THR HA H 42 4.000 4.000 4.157 -0.157 26021 218 1 . 1 1 42 42 THR C C 42 176.633 176.633 176.627 0.006 26021 219 1 . 1 1 42 42 THR CA C 42 66.574 66.574 65.254 1.320 26021 220 1 . 1 1 42 42 THR CB C 42 67.924 67.924 68.667 -0.743 26021 221 1 . 1 1 42 42 THR H H 42 7.863 7.863 7.568 0.295 26021 222 1 . 1 1 43 43 MET N N 43 122.839 122.839 121.545 1.294 26021 223 1 . 1 1 43 43 MET HA H 43 4.022 4.022 4.066 -0.044 26021 224 1 . 1 1 43 43 MET C C 43 177.290 177.290 178.084 -0.794 26021 225 1 . 1 1 43 43 MET CA C 43 59.731 59.731 59.708 0.023 26021 226 1 . 1 1 43 43 MET CB C 43 33.610 33.610 32.225 1.385 26021 227 1 . 1 1 43 43 MET H H 43 8.714 8.714 7.831 0.883 26021 228 1 . 1 1 44 44 ASN N N 44 118.049 118.049 117.724 0.325 26021 229 1 . 1 1 44 44 ASN HA H 44 4.374 4.374 4.311 0.063 26021 230 1 . 1 1 44 44 ASN C C 44 176.297 176.297 177.339 -1.042 26021 231 1 . 1 1 44 44 ASN CA C 44 56.894 56.894 56.435 0.459 26021 232 1 . 1 1 44 44 ASN CB C 44 39.406 39.406 38.778 0.628 26021 233 1 . 1 1 44 44 ASN H H 44 8.988 8.988 8.238 0.750 26021 234 1 . 1 1 45 45 ALA N N 45 119.260 119.260 121.478 -2.218 26021 235 1 . 1 1 45 45 ALA HA H 45 4.066 4.066 4.176 -0.110 26021 236 1 . 1 1 45 45 ALA C C 45 180.476 180.476 179.228 1.248 26021 237 1 . 1 1 45 45 ALA CA C 45 55.268 55.268 54.424 0.844 26021 238 1 . 1 1 45 45 ALA CB C 45 17.688 17.688 18.275 -0.587 26021 239 1 . 1 1 45 45 ALA H H 45 7.675 7.675 7.581 0.094 26021 240 1 . 1 1 46 46 ALA N N 46 121.126 121.126 122.945 -1.819 26021 241 1 . 1 1 46 46 ALA HA H 46 4.116 4.116 4.103 0.014 26021 242 1 . 1 1 46 46 ALA C C 46 179.314 179.314 179.141 0.173 26021 243 1 . 1 1 46 46 ALA CA C 46 54.986 54.986 55.188 -0.202 26021 244 1 . 1 1 46 46 ALA CB C 46 18.222 18.222 18.590 -0.368 26021 245 1 . 1 1 46 46 ALA H H 46 7.872 7.872 7.825 0.047 26021 246 1 . 1 1 47 47 LEU N N 47 119.328 119.328 115.991 3.337 26021 247 1 . 1 1 47 47 LEU HA H 47 4.191 4.191 4.009 0.182 26021 248 1 . 1 1 47 47 LEU C C 47 180.403 180.403 178.287 2.116 26021 249 1 . 1 1 47 47 LEU CA C 47 58.046 58.046 57.983 0.063 26021 250 1 . 1 1 47 47 LEU CB C 47 41.950 41.950 41.461 0.489 26021 251 1 . 1 1 47 47 LEU H H 47 8.529 8.529 7.698 0.831 26021 252 1 . 1 1 48 48 ILE N N 48 121.653 121.653 118.411 3.242 26021 253 1 . 1 1 48 48 ILE HA H 48 3.702 3.702 3.731 -0.029 26021 254 1 . 1 1 48 48 ILE C C 48 178.730 178.730 178.137 0.593 26021 255 1 . 1 1 48 48 ILE CA C 48 64.910 64.910 64.074 0.835 26021 256 1 . 1 1 48 48 ILE CB C 48 37.912 37.912 37.311 0.601 26021 257 1 . 1 1 48 48 ILE H H 48 8.386 8.386 7.261 1.125 26021 258 1 . 1 1 49 49 LYS N N 49 119.896 119.896 119.241 0.655 26021 259 1 . 1 1 49 49 LYS HA H 49 4.043 4.043 4.153 -0.110 26021 260 1 . 1 1 49 49 LYS C C 49 179.999 179.999 179.347 0.652 26021 261 1 . 1 1 49 49 LYS CA C 49 59.057 59.057 59.163 -0.106 26021 262 1 . 1 1 49 49 LYS CB C 49 31.961 31.961 32.675 -0.714 26021 263 1 . 1 1 49 49 LYS H H 49 7.456 7.456 7.549 -0.093 26021 264 1 . 1 1 50 50 ILE N N 50 119.964 119.964 115.417 4.547 26021 265 1 . 1 1 50 50 ILE HA H 50 3.736 3.736 4.117 -0.381 26021 266 1 . 1 1 50 50 ILE C C 50 177.960 177.960 177.634 0.326 26021 267 1 . 1 1 50 50 ILE CA C 50 64.349 64.349 63.815 0.534 26021 268 1 . 1 1 50 50 ILE CB C 50 38.132 38.132 37.729 0.403 26021 269 1 . 1 1 50 50 ILE H H 50 8.154 8.154 8.631 -0.477 26021 270 1 . 1 1 51 51 GLY N N 51 106.709 106.709 107.407 -0.698 26021 271 1 . 1 1 51 51 GLY C C 51 174.461 174.461 174.992 -0.531 26021 272 1 . 1 1 51 51 GLY CA C 51 45.909 45.909 45.903 0.006 26021 273 1 . 1 1 51 51 GLY H H 51 7.932 7.932 7.763 0.169 26021 274 1 . 1 1 52 52 GLU N N 52 118.736 118.736 119.474 -0.738 26021 275 1 . 1 1 52 52 GLU HA H 52 4.320 4.320 4.279 0.041 26021 276 1 . 1 1 52 52 GLU C C 52 176.789 176.789 176.998 -0.209 26021 277 1 . 1 1 52 52 GLU CA C 52 56.274 56.274 56.962 -0.688 26021 278 1 . 1 1 52 52 GLU CB C 52 30.112 30.112 30.111 0.001 26021 279 1 . 1 1 52 52 GLU H H 52 7.597 7.597 7.637 -0.040 26021 280 1 . 1 1 53 53 VAL N N 53 122.982 122.982 118.681 4.301 26021 281 1 . 1 1 53 53 VAL HA H 53 4.261 4.261 4.259 0.002 26021 282 1 . 1 1 53 53 VAL CA C 53 60.385 60.385 59.467 0.918 26021 283 1 . 1 1 53 53 VAL CB C 53 32.822 32.822 31.334 1.488 26021 284 1 . 1 1 53 53 VAL H H 53 7.511 7.511 7.507 0.004 26021 285 1 . 1 1 54 54 PRO HA H 54 4.645 4.645 4.778 -0.133 26021 286 1 . 1 1 54 54 PRO CA C 54 61.578 61.578 61.544 0.034 26021 287 1 . 1 1 54 54 PRO CB C 54 31.535 31.535 31.031 0.504 26021 288 1 . 1 1 55 55 PRO HA H 55 4.191 4.191 4.338 -0.147 26021 289 1 . 1 1 55 55 PRO C C 55 178.258 178.258 177.294 0.964 26021 290 1 . 1 1 55 55 PRO CA C 55 65.428 65.428 64.564 0.864 26021 291 1 . 1 1 55 55 PRO CB C 55 31.846 31.846 31.860 -0.014 26021 292 1 . 1 1 56 56 ASP N N 56 114.117 114.117 117.768 -3.651 26021 293 1 . 1 1 56 56 ASP HA H 56 4.491 4.491 4.496 -0.005 26021 294 1 . 1 1 56 56 ASP C C 56 176.696 176.696 177.205 -0.509 26021 295 1 . 1 1 56 56 ASP CA C 56 55.138 55.138 55.813 -0.675 26021 296 1 . 1 1 56 56 ASP CB C 56 39.726 39.726 40.820 -1.094 26021 297 1 . 1 1 56 56 ASP H H 56 8.489 8.489 8.430 0.059 26021 298 1 . 1 1 57 57 GLN N N 57 117.641 117.641 116.593 1.048 26021 299 1 . 1 1 57 57 GLN HA H 57 4.374 4.374 4.357 0.017 26021 300 1 . 1 1 57 57 GLN C C 57 175.765 175.765 176.048 -0.283 26021 301 1 . 1 1 57 57 GLN CA C 57 55.290 55.290 55.400 -0.110 26021 302 1 . 1 1 57 57 GLN CB C 57 29.646 29.646 29.433 0.213 26021 303 1 . 1 1 57 57 GLN H H 57 8.206 8.206 7.652 0.554 26021 304 1 . 1 1 58 58 LEU N N 58 122.141 122.141 121.858 0.283 26021 305 1 . 1 1 58 58 LEU HA H 58 4.450 4.450 4.315 0.135 26021 306 1 . 1 1 58 58 LEU C C 58 176.849 176.849 176.216 0.633 26021 307 1 . 1 1 58 58 LEU CA C 58 54.995 54.995 55.039 -0.044 26021 308 1 . 1 1 58 58 LEU CB C 58 43.231 43.231 42.433 0.798 26021 309 1 . 1 1 58 58 LEU H H 58 7.152 7.152 7.452 -0.300 26021 310 1 . 1 1 59 59 ASP N N 59 125.643 125.643 122.402 3.241 26021 311 1 . 1 1 59 59 ASP HA H 59 4.719 4.719 4.850 -0.131 26021 312 1 . 1 1 59 59 ASP C C 59 177.249 177.249 176.989 0.260 26021 313 1 . 1 1 59 59 ASP CA C 59 53.403 53.403 52.964 0.439 26021 314 1 . 1 1 59 59 ASP CB C 59 42.232 42.232 43.281 -1.049 26021 315 1 . 1 1 59 59 ASP H H 59 9.312 9.312 8.211 1.101 26021 316 1 . 1 1 60 60 SER N N 60 116.550 116.550 115.343 1.207 26021 317 1 . 1 1 60 60 SER HA H 60 4.124 4.124 4.211 -0.087 26021 318 1 . 1 1 60 60 SER C C 60 176.840 176.840 176.210 0.630 26021 319 1 . 1 1 60 60 SER CA C 60 61.722 61.722 61.141 0.581 26021 320 1 . 1 1 60 60 SER CB C 60 62.815 62.815 63.320 -0.505 26021 321 1 . 1 1 60 60 SER H H 60 8.647 8.647 8.561 0.086 26021 322 1 . 1 1 61 61 GLN N N 61 121.394 121.394 120.207 1.187 26021 323 1 . 1 1 61 61 GLN HA H 61 4.131 4.131 4.197 -0.066 26021 324 1 . 1 1 61 61 GLN C C 61 178.629 178.629 177.559 1.070 26021 325 1 . 1 1 61 61 GLN CA C 61 58.753 58.753 58.469 0.284 26021 326 1 . 1 1 61 61 GLN CB C 61 28.253 28.253 28.572 -0.319 26021 327 1 . 1 1 61 61 GLN H H 61 8.453 8.453 8.202 0.251 26021 328 1 . 1 1 62 62 ASP N N 62 122.187 122.187 119.475 2.712 26021 329 1 . 1 1 62 62 ASP HA H 62 4.619 4.619 4.478 0.141 26021 330 1 . 1 1 62 62 ASP C C 62 178.318 178.318 178.329 -0.011 26021 331 1 . 1 1 62 62 ASP CA C 62 57.462 57.462 57.656 -0.194 26021 332 1 . 1 1 62 62 ASP CB C 62 41.036 41.036 40.569 0.467 26021 333 1 . 1 1 62 62 ASP H H 62 8.311 8.311 8.421 -0.110 26021 334 1 . 1 1 63 63 LYS N N 63 120.325 120.325 118.525 1.800 26021 335 1 . 1 1 63 63 LYS HA H 63 4.009 4.009 4.146 -0.137 26021 336 1 . 1 1 63 63 LYS C C 63 178.765 178.765 179.129 -0.364 26021 337 1 . 1 1 63 63 LYS CA C 63 59.753 59.753 58.838 0.915 26021 338 1 . 1 1 63 63 LYS CB C 63 32.453 32.453 32.192 0.261 26021 339 1 . 1 1 63 63 LYS H H 63 7.923 7.923 7.712 0.211 26021 340 1 . 1 1 64 64 LEU N N 64 119.491 119.491 119.804 -0.313 26021 341 1 . 1 1 64 64 LEU HA H 64 4.226 4.226 4.170 0.056 26021 342 1 . 1 1 64 64 LEU C C 64 179.526 179.526 178.751 0.775 26021 343 1 . 1 1 64 64 LEU CA C 64 57.798 57.798 57.616 0.182 26021 344 1 . 1 1 64 64 LEU CB C 64 41.775 41.775 41.458 0.317 26021 345 1 . 1 1 64 64 LEU H H 64 7.820 7.820 7.491 0.329 26021 346 1 . 1 1 65 65 TRP N N 65 120.674 120.674 121.947 -1.273 26021 347 1 . 1 1 65 65 TRP HA H 65 4.308 4.308 4.351 -0.043 26021 348 1 . 1 1 65 65 TRP C C 65 177.379 177.379 177.500 -0.121 26021 349 1 . 1 1 65 65 TRP CA C 65 61.802 61.802 60.421 1.380 26021 350 1 . 1 1 65 65 TRP CB C 65 28.411 28.411 28.857 -0.446 26021 351 1 . 1 1 65 65 TRP H H 65 8.196 8.196 8.107 0.089 26021 352 1 . 1 1 66 66 ALA N N 66 120.606 120.606 119.929 0.677 26021 353 1 . 1 1 66 66 ALA HA H 66 3.709 3.709 3.531 0.178 26021 354 1 . 1 1 66 66 ALA C C 66 180.376 180.376 179.155 1.221 26021 355 1 . 1 1 66 66 ALA CA C 66 55.564 55.564 54.754 0.810 26021 356 1 . 1 1 66 66 ALA CB C 66 17.654 17.654 17.954 -0.300 26021 357 1 . 1 1 66 66 ALA H H 66 8.305 8.305 7.725 0.580 26021 358 1 . 1 1 67 67 ASP N N 67 119.175 119.175 118.499 0.676 26021 359 1 . 1 1 67 67 ASP HA H 67 4.450 4.450 4.329 0.121 26021 360 1 . 1 1 67 67 ASP C C 67 178.757 178.757 178.087 0.670 26021 361 1 . 1 1 67 67 ASP CA C 67 57.492 57.492 56.964 0.528 26021 362 1 . 1 1 67 67 ASP CB C 67 40.154 40.154 40.835 -0.681 26021 363 1 . 1 1 67 67 ASP H H 67 7.945 7.945 7.778 0.167 26021 364 1 . 1 1 68 68 GLU N N 68 122.322 122.322 119.135 3.187 26021 365 1 . 1 1 68 68 GLU HA H 68 4.015 4.015 4.224 -0.209 26021 366 1 . 1 1 68 68 GLU C C 68 180.055 180.055 179.073 0.982 26021 367 1 . 1 1 68 68 GLU CA C 68 60.110 60.110 59.247 0.864 26021 368 1 . 1 1 68 68 GLU CB C 68 29.647 29.647 29.612 0.035 26021 369 1 . 1 1 68 68 GLU H H 68 8.168 8.168 7.899 0.269 26021 370 1 . 1 1 69 69 VAL N N 69 122.135 122.135 117.928 4.207 26021 371 1 . 1 1 69 69 VAL HA H 69 3.252 3.252 3.719 -0.467 26021 372 1 . 1 1 69 69 VAL C C 69 177.736 177.736 177.890 -0.154 26021 373 1 . 1 1 69 69 VAL CA C 69 66.539 66.539 65.665 0.874 26021 374 1 . 1 1 69 69 VAL CB C 69 31.242 31.242 31.267 -0.025 26021 375 1 . 1 1 69 69 VAL H H 69 8.424 8.424 7.274 1.150 26021 376 1 . 1 1 70 70 ARG N N 70 121.373 121.373 119.723 1.650 26021 377 1 . 1 1 70 70 ARG HA H 70 3.692 3.692 3.987 -0.295 26021 378 1 . 1 1 70 70 ARG C C 70 179.117 179.117 178.740 0.377 26021 379 1 . 1 1 70 70 ARG CA C 70 60.165 60.165 59.051 1.114 26021 380 1 . 1 1 70 70 ARG CB C 70 29.654 29.654 29.893 -0.239 26021 381 1 . 1 1 70 70 ARG H H 70 7.916 7.916 7.611 0.305 26021 382 1 . 1 1 71 71 GLU N N 71 119.075 119.075 119.667 -0.592 26021 383 1 . 1 1 71 71 GLU HA H 71 4.063 4.063 3.996 0.067 26021 384 1 . 1 1 71 71 GLU C C 71 179.119 179.119 179.038 0.081 26021 385 1 . 1 1 71 71 GLU CA C 71 59.687 59.687 59.016 0.671 26021 386 1 . 1 1 71 71 GLU CB C 71 29.270 29.270 28.754 0.516 26021 387 1 . 1 1 71 71 GLU H H 71 8.031 8.031 8.302 -0.271 26021 388 1 . 1 1 72 72 LEU N N 72 120.503 120.503 120.576 -0.073 26021 389 1 . 1 1 72 72 LEU HA H 72 4.057 4.057 4.124 -0.067 26021 390 1 . 1 1 72 72 LEU C C 72 178.734 178.734 178.742 -0.008 26021 391 1 . 1 1 72 72 LEU CA C 72 57.422 57.422 56.879 0.543 26021 392 1 . 1 1 72 72 LEU CB C 72 41.408 41.408 41.644 -0.236 26021 393 1 . 1 1 72 72 LEU H H 72 8.175 8.175 7.697 0.478 26021 394 1 . 1 1 73 73 SER N N 73 115.243 115.243 115.741 -0.498 26021 395 1 . 1 1 73 73 SER HA H 73 3.824 3.824 4.062 -0.238 26021 396 1 . 1 1 73 73 SER C C 73 175.697 175.697 176.513 -0.816 26021 397 1 . 1 1 73 73 SER CA C 73 62.384 62.384 61.381 1.003 26021 398 1 . 1 1 73 73 SER CB C 73 62.093 62.093 62.768 -0.675 26021 399 1 . 1 1 73 73 SER H H 73 8.411 8.411 8.088 0.323 26021 400 1 . 1 1 74 74 TYR N N 74 121.342 121.342 121.454 -0.112 26021 401 1 . 1 1 74 74 TYR HA H 74 4.491 4.491 4.298 0.193 26021 402 1 . 1 1 74 74 TYR C C 74 178.747 178.747 177.926 0.821 26021 403 1 . 1 1 74 74 TYR CA C 74 60.435 60.435 60.761 -0.326 26021 404 1 . 1 1 74 74 TYR CB C 74 37.507 37.507 38.179 -0.672 26021 405 1 . 1 1 74 74 TYR H H 74 7.314 7.314 7.737 -0.423 26021 406 1 . 1 1 75 75 VAL N N 75 120.779 120.779 118.494 2.285 26021 407 1 . 1 1 75 75 VAL HA H 75 3.861 3.861 3.750 0.111 26021 408 1 . 1 1 75 75 VAL C C 75 179.788 179.788 178.056 1.732 26021 409 1 . 1 1 75 75 VAL CA C 75 66.048 66.048 65.416 0.632 26021 410 1 . 1 1 75 75 VAL CB C 75 31.714 31.714 31.424 0.290 26021 411 1 . 1 1 75 75 VAL H H 75 7.740 7.740 7.869 -0.129 26021 412 1 . 1 1 76 76 ILE N N 76 120.598 120.598 120.115 0.483 26021 413 1 . 1 1 76 76 ILE HA H 76 3.700 3.700 3.649 0.051 26021 414 1 . 1 1 76 76 ILE C C 76 177.066 177.066 177.958 -0.892 26021 415 1 . 1 1 76 76 ILE CA C 76 65.919 65.919 64.750 1.169 26021 416 1 . 1 1 76 76 ILE CB C 76 37.385 37.385 37.245 0.140 26021 417 1 . 1 1 76 76 ILE H H 76 8.584 8.584 7.579 1.005 26021 418 1 . 1 1 77 77 GLU N N 77 120.468 120.468 120.070 0.398 26021 419 1 . 1 1 77 77 GLU HA H 77 3.649 3.649 3.901 -0.252 26021 420 1 . 1 1 77 77 GLU C C 77 177.502 177.502 178.476 -0.974 26021 421 1 . 1 1 77 77 GLU CA C 77 60.862 60.862 59.749 1.113 26021 422 1 . 1 1 77 77 GLU CB C 77 29.352 29.352 28.867 0.485 26021 423 1 . 1 1 77 77 GLU H H 77 8.445 8.445 7.922 0.523 26021 424 1 . 1 1 78 78 ASP N N 78 117.382 117.382 119.667 -2.285 26021 425 1 . 1 1 78 78 ASP HA H 78 4.391 4.391 4.375 0.016 26021 426 1 . 1 1 78 78 ASP C C 78 177.382 177.382 177.997 -0.615 26021 427 1 . 1 1 78 78 ASP CA C 78 57.495 57.495 56.974 0.521 26021 428 1 . 1 1 78 78 ASP CB C 78 41.935 41.935 40.465 1.470 26021 429 1 . 1 1 78 78 ASP H H 78 7.885 7.885 7.826 0.059 26021 430 1 . 1 1 79 79 ALA N N 79 120.171 120.171 121.706 -1.535 26021 431 1 . 1 1 79 79 ALA HA H 79 4.050 4.050 4.040 0.011 26021 432 1 . 1 1 79 79 ALA C C 79 181.193 181.193 179.385 1.808 26021 433 1 . 1 1 79 79 ALA CA C 79 55.055 55.055 55.107 -0.052 26021 434 1 . 1 1 79 79 ALA CB C 79 18.420 18.420 18.477 -0.058 26021 435 1 . 1 1 79 79 ALA H H 79 7.754 7.754 7.955 -0.201 26021 436 1 . 1 1 80 80 VAL N N 80 119.541 119.541 114.158 5.383 26021 437 1 . 1 1 80 80 VAL HA H 80 3.677 3.677 3.897 -0.220 26021 438 1 . 1 1 80 80 VAL C C 80 177.096 177.096 177.591 -0.495 26021 439 1 . 1 1 80 80 VAL CA C 80 67.084 67.084 64.523 2.561 26021 440 1 . 1 1 80 80 VAL CB C 80 31.443 31.443 31.712 -0.269 26021 441 1 . 1 1 80 80 VAL H H 80 8.635 8.635 7.449 1.186 26021 442 1 . 1 1 81 81 ASP N N 81 121.140 121.140 121.237 -0.097 26021 443 1 . 1 1 81 81 ASP HA H 81 4.469 4.469 4.353 0.116 26021 444 1 . 1 1 81 81 ASP C C 81 179.569 179.569 178.133 1.436 26021 445 1 . 1 1 81 81 ASP CA C 81 57.929 57.929 57.315 0.614 26021 446 1 . 1 1 81 81 ASP CB C 81 39.935 39.935 40.658 -0.723 26021 447 1 . 1 1 81 81 ASP H H 81 8.575 8.575 8.267 0.308 26021 448 1 . 1 1 82 82 LYS N N 82 118.159 118.159 118.555 -0.396 26021 449 1 . 1 1 82 82 LYS HA H 82 4.021 4.021 4.039 -0.018 26021 450 1 . 1 1 82 82 LYS C C 82 178.890 178.890 178.734 0.156 26021 451 1 . 1 1 82 82 LYS CA C 82 59.067 59.067 58.649 0.418 26021 452 1 . 1 1 82 82 LYS CB C 82 32.587 32.587 32.005 0.583 26021 453 1 . 1 1 82 82 LYS H H 82 8.079 8.079 7.751 0.328 26021 454 1 . 1 1 83 83 PHE N N 83 120.900 120.900 119.925 0.975 26021 455 1 . 1 1 83 83 PHE HA H 83 4.276 4.276 4.318 -0.042 26021 456 1 . 1 1 83 83 PHE C C 83 177.269 177.269 176.851 0.418 26021 457 1 . 1 1 83 83 PHE CA C 83 60.943 60.943 60.710 0.233 26021 458 1 . 1 1 83 83 PHE CB C 83 39.747 39.747 39.389 0.358 26021 459 1 . 1 1 83 83 PHE H H 83 8.015 8.015 7.828 0.187 26021 460 1 . 1 1 84 84 LEU N N 84 118.209 118.209 118.272 -0.063 26021 461 1 . 1 1 84 84 LEU HA H 84 3.942 3.942 4.091 -0.149 26021 462 1 . 1 1 84 84 LEU C C 84 178.774 178.774 178.165 0.609 26021 463 1 . 1 1 84 84 LEU CA C 84 57.170 57.170 56.845 0.325 26021 464 1 . 1 1 84 84 LEU CB C 84 42.193 42.193 41.200 0.993 26021 465 1 . 1 1 84 84 LEU H H 84 8.338 8.338 7.727 0.611 26021 466 1 . 1 1 85 85 VAL N N 85 116.078 116.078 119.523 -3.445 26021 467 1 . 1 1 85 85 VAL HA H 85 3.991 3.991 3.680 0.311 26021 468 1 . 1 1 85 85 VAL C C 85 177.252 177.252 177.296 -0.044 26021 469 1 . 1 1 85 85 VAL CA C 85 64.180 64.180 65.764 -1.584 26021 470 1 . 1 1 85 85 VAL CB C 85 31.890 31.890 31.483 0.407 26021 471 1 . 1 1 85 85 VAL H H 85 7.447 7.447 7.545 -0.098 26021 472 1 . 1 1 86 86 ARG N N 86 120.842 120.842 118.076 2.766 26021 473 1 . 1 1 86 86 ARG HA H 86 4.227 4.227 4.112 0.115 26021 474 1 . 1 1 86 86 ARG C C 86 177.520 177.520 179.145 -1.625 26021 475 1 . 1 1 86 86 ARG CA C 86 57.059 57.059 58.561 -1.502 26021 476 1 . 1 1 86 86 ARG CB C 86 30.263 30.263 30.012 0.251 26021 477 1 . 1 1 86 86 ARG H H 86 7.598 7.598 7.422 0.176 26021 478 1 . 1 1 87 87 VAL N N 87 119.293 119.293 116.883 2.410 26021 479 1 . 1 1 87 87 VAL HA H 87 3.825 3.825 3.784 0.041 26021 480 1 . 1 1 87 87 VAL C C 87 176.121 176.121 177.219 -1.099 26021 481 1 . 1 1 87 87 VAL CA C 87 63.438 63.438 65.315 -1.877 26021 482 1 . 1 1 87 87 VAL CB C 87 31.772 31.772 30.966 0.806 26021 483 1 . 1 1 87 87 VAL H H 87 7.994 7.994 7.746 0.248 26021 484 1 . 1 1 88 88 HIS N N 88 120.016 120.016 117.980 2.036 26021 485 1 . 1 1 88 88 HIS HA H 88 4.637 4.637 4.437 0.200 26021 486 1 . 1 1 88 88 HIS C C 88 175.639 175.639 175.997 -0.358 26021 487 1 . 1 1 88 88 HIS CA C 88 56.351 56.351 56.255 0.096 26021 488 1 . 1 1 88 88 HIS CB C 88 29.681 29.681 30.248 -0.567 26021 489 1 . 1 1 88 88 HIS H H 88 7.969 7.969 8.080 -0.111 26021 490 1 . 1 1 89 89 GLY N N 89 109.587 109.587 107.854 1.733 26021 491 1 . 1 1 89 89 GLY C C 89 173.730 173.730 174.314 -0.584 26021 492 1 . 1 1 89 89 GLY CA C 89 45.169 45.169 45.491 -0.322 26021 493 1 . 1 1 89 89 GLY H H 89 8.083 8.083 8.043 0.040 26021 494 1 . 1 1 90 90 VAL N N 90 118.224 118.224 120.600 -2.376 26021 495 1 . 1 1 90 90 VAL HA H 90 4.138 4.138 4.209 -0.071 26021 496 1 . 1 1 90 90 VAL C C 90 176.018 176.018 175.274 0.744 26021 497 1 . 1 1 90 90 VAL CA C 90 62.425 62.425 61.321 1.105 26021 498 1 . 1 1 90 90 VAL CB C 90 32.616 32.616 33.049 -0.433 26021 499 1 . 1 1 90 90 VAL H H 90 7.944 7.944 7.542 0.402 26021 500 1 . 1 1 91 91 GLU N N 91 124.313 124.313 124.715 -0.402 26021 501 1 . 1 1 91 91 GLU HA H 91 4.606 4.606 4.483 0.123 26021 502 1 . 1 1 91 91 GLU CA C 91 54.176 54.176 54.005 0.171 26021 503 1 . 1 1 91 91 GLU CB C 91 29.760 29.760 29.255 0.505 26021 504 1 . 1 1 91 91 GLU H H 91 8.423 8.423 8.371 0.052 26021 505 1 . 1 1 92 92 PRO HA H 92 4.337 4.337 4.445 -0.108 26021 506 1 . 1 1 92 92 PRO C C 92 176.504 176.504 175.694 0.810 26021 507 1 . 1 1 92 92 PRO CA C 92 63.372 63.372 63.137 0.235 26021 508 1 . 1 1 92 92 PRO CB C 92 32.167 32.167 32.248 -0.081 26021 509 1 . 1 1 93 93 ASP N N 93 120.275 120.275 120.758 -0.483 26021 510 1 . 1 1 93 93 ASP HA H 93 4.572 4.572 4.765 -0.193 26021 511 1 . 1 1 93 93 ASP CA C 93 53.970 53.970 53.489 0.481 26021 512 1 . 1 1 93 93 ASP CB C 93 41.515 41.515 43.874 -2.359 26021 513 1 . 1 1 93 93 ASP H H 93 8.286 8.286 8.182 0.104 26021 514 1 . 1 1 94 94 ASP N N 94 121.181 121.181 121.627 -0.446 26021 515 1 . 1 1 94 94 ASP HA H 94 4.565 4.565 4.606 -0.041 26021 516 1 . 1 1 94 94 ASP C C 94 176.474 176.474 177.347 -0.873 26021 517 1 . 1 1 94 94 ASP CA C 94 54.373 54.373 55.662 -1.289 26021 518 1 . 1 1 94 94 ASP CB C 94 41.225 41.225 41.643 -0.418 26021 519 1 . 1 1 94 94 ASP H H 94 8.259 8.259 8.666 -0.407 26021 520 1 . 1 1 95 95 ASN N N 95 118.728 118.728 118.792 -0.064 26021 521 1 . 1 1 95 95 ASN HA H 95 4.694 4.694 4.586 0.108 26021 522 1 . 1 1 95 95 ASN C C 95 176.272 176.272 177.439 -1.167 26021 523 1 . 1 1 95 95 ASN CA C 95 53.986 53.986 55.742 -1.756 26021 524 1 . 1 1 95 95 ASN CB C 95 38.729 38.729 38.500 0.229 26021 525 1 . 1 1 95 95 ASN H H 95 8.474 8.474 8.494 -0.020 26021 526 1 . 1 1 96 96 THR N N 96 113.868 113.868 114.044 -0.176 26021 527 1 . 1 1 96 96 THR HA H 96 4.220 4.220 4.083 0.137 26021 528 1 . 1 1 96 96 THR C C 96 175.107 175.107 175.911 -0.804 26021 529 1 . 1 1 96 96 THR CA C 96 63.200 63.200 65.010 -1.810 26021 530 1 . 1 1 96 96 THR CB C 96 69.475 69.475 68.447 1.028 26021 531 1 . 1 1 96 96 THR H H 96 8.263 8.263 8.189 0.074 26021 532 1 . 1 1 97 97 ASN N N 97 119.954 119.954 119.031 0.923 26021 533 1 . 1 1 97 97 ASN HA H 97 4.616 4.616 4.535 0.081 26021 534 1 . 1 1 97 97 ASN C C 97 176.275 176.275 176.455 -0.180 26021 535 1 . 1 1 97 97 ASN CA C 97 53.956 53.956 54.735 -0.779 26021 536 1 . 1 1 97 97 ASN CB C 97 38.692 38.692 38.555 0.137 26021 537 1 . 1 1 97 97 ASN H H 97 8.431 8.431 7.867 0.564 26021 538 1 . 1 1 98 98 GLY N N 98 108.847 108.847 107.073 1.774 26021 539 1 . 1 1 98 98 GLY C C 98 175.533 175.533 175.253 0.280 26021 540 1 . 1 1 98 98 GLY CA C 98 46.011 46.011 46.115 -0.104 26021 541 1 . 1 1 98 98 GLY H H 98 8.338 8.338 7.894 0.444 26021 542 1 . 1 1 99 99 PHE N N 99 118.492 118.492 119.887 -1.395 26021 543 1 . 1 1 99 99 PHE HA H 99 4.248 4.248 4.115 0.133 26021 544 1 . 1 1 99 99 PHE CA C 99 60.959 60.959 60.032 0.927 26021 545 1 . 1 1 99 99 PHE CB C 99 38.159 38.159 39.212 -1.053 26021 546 1 . 1 1 99 99 PHE H H 99 8.370 8.370 8.500 -0.130 26021 547 1 . 1 1 100 100 LYS N N 100 120.987 120.987 119.623 1.364 26021 548 1 . 1 1 100 100 LYS H H 100 8.256 8.256 8.419 -0.163 26021 549 1 . 1 1 101 101 GLY N N 101 108.186 108.186 106.640 1.546 26021 550 1 . 1 1 101 101 GLY C C 101 177.075 177.075 175.896 1.179 26021 551 1 . 1 1 101 101 GLY CA C 101 46.902 46.902 46.198 0.704 26021 552 1 . 1 1 101 101 GLY H H 101 8.300 8.300 7.739 0.561 26021 553 1 . 1 1 102 102 LEU N N 102 121.439 121.439 123.431 -1.992 26021 554 1 . 1 1 102 102 LEU HA H 102 4.097 4.097 4.040 0.057 26021 555 1 . 1 1 102 102 LEU C C 102 179.836 179.836 178.181 1.655 26021 556 1 . 1 1 102 102 LEU CA C 102 57.358 57.358 57.468 -0.110 26021 557 1 . 1 1 102 102 LEU CB C 102 41.770 41.770 41.882 -0.112 26021 558 1 . 1 1 102 102 LEU H H 102 7.777 7.777 7.747 0.030 26021 559 1 . 1 1 103 103 MET N N 103 122.290 122.290 118.093 4.197 26021 560 1 . 1 1 103 103 MET HA H 103 4.220 4.220 3.925 0.295 26021 561 1 . 1 1 103 103 MET C C 103 177.739 177.739 177.894 -0.155 26021 562 1 . 1 1 103 103 MET CA C 103 58.739 58.739 58.157 0.582 26021 563 1 . 1 1 103 103 MET CB C 103 31.895 31.895 31.837 0.058 26021 564 1 . 1 1 103 103 MET H H 103 8.409 8.409 8.140 0.269 26021 565 1 . 1 1 104 104 LYS N N 104 119.750 119.750 118.089 1.661 26021 566 1 . 1 1 104 104 LYS HA H 104 4.067 4.067 4.047 0.020 26021 567 1 . 1 1 104 104 LYS C C 104 179.301 179.301 179.298 0.003 26021 568 1 . 1 1 104 104 LYS CA C 104 59.764 59.764 58.794 0.969 26021 569 1 . 1 1 104 104 LYS CB C 104 32.047 32.047 31.778 0.269 26021 570 1 . 1 1 104 104 LYS H H 104 7.916 7.916 7.510 0.406 26021 571 1 . 1 1 105 105 ARG N N 105 117.967 117.967 119.066 -1.099 26021 572 1 . 1 1 105 105 ARG HA H 105 4.026 4.026 4.071 -0.045 26021 573 1 . 1 1 105 105 ARG C C 105 178.777 178.777 178.549 0.227 26021 574 1 . 1 1 105 105 ARG CA C 105 59.364 59.364 59.652 -0.288 26021 575 1 . 1 1 105 105 ARG CB C 105 30.997 30.997 30.286 0.711 26021 576 1 . 1 1 105 105 ARG H H 105 7.719 7.719 7.989 -0.270 26021 577 1 . 1 1 106 106 THR N N 106 117.211 117.211 112.313 4.898 26021 578 1 . 1 1 106 106 THR HA H 106 4.301 4.301 4.240 0.061 26021 579 1 . 1 1 106 106 THR C C 106 176.254 176.254 176.292 -0.038 26021 580 1 . 1 1 106 106 THR CA C 106 67.860 67.860 65.809 2.051 26021 581 1 . 1 1 106 106 THR CB C 106 67.860 67.860 68.598 -0.738 26021 582 1 . 1 1 106 106 THR H H 106 8.152 8.152 7.885 0.267 26021 583 1 . 1 1 107 107 THR N N 107 117.939 117.939 117.455 0.484 26021 584 1 . 1 1 107 107 THR HA H 107 3.971 3.971 3.930 0.041 26021 585 1 . 1 1 107 107 THR C C 107 176.780 176.780 176.283 0.497 26021 586 1 . 1 1 107 107 THR CA C 107 66.822 66.822 66.520 0.302 26021 587 1 . 1 1 107 107 THR CB C 107 68.818 68.818 68.479 0.339 26021 588 1 . 1 1 107 107 THR H H 107 8.651 8.651 7.935 0.716 26021 589 1 . 1 1 108 108 LYS N N 108 120.867 120.867 120.848 0.019 26021 590 1 . 1 1 108 108 LYS HA H 108 4.022 4.022 4.069 -0.046 26021 591 1 . 1 1 108 108 LYS C C 108 179.045 179.045 178.958 0.087 26021 592 1 . 1 1 108 108 LYS CA C 108 59.834 59.834 59.057 0.777 26021 593 1 . 1 1 108 108 LYS CB C 108 32.473 32.473 32.137 0.336 26021 594 1 . 1 1 108 108 LYS H H 108 7.694 7.694 7.740 -0.046 26021 595 1 . 1 1 109 109 LEU N N 109 119.472 119.472 119.138 0.334 26021 596 1 . 1 1 109 109 LEU HA H 109 4.321 4.321 4.245 0.076 26021 597 1 . 1 1 109 109 LEU C C 109 179.974 179.974 179.142 0.832 26021 598 1 . 1 1 109 109 LEU CA C 109 57.593 57.593 57.269 0.324 26021 599 1 . 1 1 109 109 LEU CB C 109 41.860 41.860 42.190 -0.330 26021 600 1 . 1 1 109 109 LEU H H 109 7.559 7.559 7.660 -0.101 26021 601 1 . 1 1 110 110 LEU N N 110 121.832 121.832 119.829 2.003 26021 602 1 . 1 1 110 110 LEU HA H 110 4.191 4.191 4.042 0.149 26021 603 1 . 1 1 110 110 LEU C C 110 178.101 178.101 178.715 -0.614 26021 604 1 . 1 1 110 110 LEU CA C 110 57.892 57.892 57.910 -0.018 26021 605 1 . 1 1 110 110 LEU CB C 110 41.884 41.884 41.095 0.789 26021 606 1 . 1 1 110 110 LEU H H 110 8.567 8.567 8.105 0.462 26021 607 1 . 1 1 111 111 LYS N N 111 117.972 117.972 117.677 0.295 26021 608 1 . 1 1 111 111 LYS HA H 111 3.979 3.979 4.037 -0.058 26021 609 1 . 1 1 111 111 LYS C C 111 177.677 177.677 178.385 -0.708 26021 610 1 . 1 1 111 111 LYS CA C 111 58.785 58.785 58.812 -0.027 26021 611 1 . 1 1 111 111 LYS CB C 111 32.209 32.209 31.921 0.287 26021 612 1 . 1 1 111 111 LYS H H 111 7.965 7.965 8.039 -0.074 26021 613 1 . 1 1 112 112 LYS N N 112 115.433 115.433 118.240 -2.807 26021 614 1 . 1 1 112 112 LYS HA H 112 4.110 4.110 4.063 0.047 26021 615 1 . 1 1 112 112 LYS C C 112 178.270 178.270 178.175 0.095 26021 616 1 . 1 1 112 112 LYS CA C 112 58.951 58.951 58.408 0.543 26021 617 1 . 1 1 112 112 LYS CB C 112 32.791 32.791 32.334 0.457 26021 618 1 . 1 1 112 112 LYS H H 112 7.334 7.334 7.656 -0.322 26021 619 1 . 1 1 113 113 VAL N N 113 114.861 114.861 118.441 -3.580 26021 620 1 . 1 1 113 113 VAL HA H 113 3.831 3.831 3.833 -0.002 26021 621 1 . 1 1 113 113 VAL C C 113 176.999 176.999 177.381 -0.382 26021 622 1 . 1 1 113 113 VAL CA C 113 63.505 63.505 65.302 -1.797 26021 623 1 . 1 1 113 113 VAL CB C 113 32.287 32.287 31.909 0.378 26021 624 1 . 1 1 113 113 VAL H H 113 7.298 7.298 7.471 -0.173 26021 625 1 . 1 1 114 114 VAL N N 114 121.457 121.457 119.422 2.035 26021 626 1 . 1 1 114 114 VAL HA H 114 3.722 3.722 3.752 -0.030 26021 627 1 . 1 1 114 114 VAL C C 114 177.737 177.737 177.447 0.290 26021 628 1 . 1 1 114 114 VAL CA C 114 65.224 65.224 65.811 -0.587 26021 629 1 . 1 1 114 114 VAL CB C 114 31.753 31.753 31.336 0.417 26021 630 1 . 1 1 114 114 VAL H H 114 7.855 7.855 8.056 -0.201 26021 631 1 . 1 1 115 115 ASP N N 115 120.804 120.804 119.658 1.146 26021 632 1 . 1 1 115 115 ASP HA H 115 4.455 4.455 4.453 0.002 26021 633 1 . 1 1 115 115 ASP C C 115 177.380 177.380 177.201 0.179 26021 634 1 . 1 1 115 115 ASP CA C 115 55.921 55.921 56.438 -0.517 26021 635 1 . 1 1 115 115 ASP CB C 115 40.372 40.372 40.831 -0.459 26021 636 1 . 1 1 115 115 ASP H H 115 8.311 8.311 8.067 0.243 26021 637 1 . 1 1 116 116 LYS N N 116 119.582 119.582 118.057 1.525 26021 638 1 . 1 1 116 116 LYS HA H 116 4.095 4.095 4.197 -0.102 26021 639 1 . 1 1 116 116 LYS C C 116 177.077 177.077 178.293 -1.216 26021 640 1 . 1 1 116 116 LYS CA C 116 57.711 57.711 57.827 -0.116 26021 641 1 . 1 1 116 116 LYS CB C 116 33.488 33.488 33.290 0.198 26021 642 1 . 1 1 116 116 LYS H H 116 7.639 7.639 7.786 -0.147 26021 643 1 . 1 1 117 117 HIS N N 117 115.246 115.246 114.414 0.832 26021 644 1 . 1 1 117 117 HIS HA H 117 4.625 4.625 4.628 -0.003 26021 645 1 . 1 1 117 117 HIS C C 117 175.497 175.497 176.185 -0.688 26021 646 1 . 1 1 117 117 HIS CA C 117 56.175 56.175 56.805 -0.630 26021 647 1 . 1 1 117 117 HIS CB C 117 30.475 30.475 31.434 -0.959 26021 648 1 . 1 1 117 117 HIS H H 117 8.108 8.108 8.016 0.092 26021 649 1 . 1 1 118 118 GLY N N 118 109.944 109.944 108.219 1.725 26021 650 1 . 1 1 118 118 GLY C C 118 174.093 174.093 174.417 -0.324 26021 651 1 . 1 1 118 118 GLY CA C 118 46.064 46.064 45.237 0.827 26021 652 1 . 1 1 118 118 GLY H H 118 8.153 8.153 7.825 0.328 26021 653 1 . 1 1 119 119 ILE N N 119 118.468 118.468 122.302 -3.834 26021 654 1 . 1 1 119 119 ILE HA H 119 4.122 4.122 3.893 0.229 26021 655 1 . 1 1 119 119 ILE C C 119 174.777 174.777 175.644 -0.867 26021 656 1 . 1 1 119 119 ILE CA C 119 61.101 61.101 61.404 -0.303 26021 657 1 . 1 1 119 119 ILE CB C 119 38.631 38.631 36.304 2.327 26021 658 1 . 1 1 119 119 ILE H H 119 7.828 7.828 7.699 0.129 26021 stop_ save_