data_17915 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17915 _Entry.PDB_ID 2LJ3 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 17915 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 ASP N N 2 123.220 123.220 119.999 3.221 17915 2 1 1 . 1 1 2 2 ASP C C 2 175.703 175.703 175.205 0.498 17915 3 1 1 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.733 -0.692 17915 4 1 1 . 1 1 2 2 ASP H H 2 8.738 8.738 8.468 0.270 17915 5 1 1 . 1 1 3 3 GLU N N 3 121.895 121.895 119.645 2.250 17915 6 1 1 . 1 1 3 3 GLU C C 3 176.480 176.480 175.847 0.633 17915 7 1 1 . 1 1 3 3 GLU CA C 3 56.128 56.128 55.093 1.036 17915 8 1 1 . 1 1 3 3 GLU H H 3 8.570 8.570 8.241 0.329 17915 9 1 1 . 1 1 4 4 THR N N 4 114.607 114.607 113.355 1.252 17915 10 1 1 . 1 1 4 4 THR C C 4 175.417 175.417 174.071 1.346 17915 11 1 1 . 1 1 4 4 THR CA C 4 62.685 62.685 61.489 1.196 17915 12 1 1 . 1 1 4 4 THR H H 4 8.176 8.176 8.273 -0.097 17915 13 1 1 . 1 1 5 5 GLY N N 5 111.430 111.430 112.263 -0.833 17915 14 1 1 . 1 1 5 5 GLY C C 5 173.777 173.777 172.699 1.078 17915 15 1 1 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.679 -0.119 17915 16 1 1 . 1 1 5 5 GLY H H 5 8.344 8.344 7.751 0.593 17915 17 1 1 . 1 1 6 6 LYS N N 6 119.850 119.850 125.512 -5.662 17915 18 1 1 . 1 1 6 6 LYS C C 6 176.049 176.049 176.542 -0.493 17915 19 1 1 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.453 -1.539 17915 20 1 1 . 1 1 6 6 LYS H H 6 7.903 7.903 8.226 -0.323 17915 21 1 1 . 1 1 7 7 GLU N N 7 123.025 123.025 120.528 2.497 17915 22 1 1 . 1 1 7 7 GLU C C 7 174.172 174.172 175.049 -0.877 17915 23 1 1 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.885 -2.426 17915 24 1 1 . 1 1 7 7 GLU H H 7 8.562 8.562 8.895 -0.333 17915 25 1 1 . 1 1 8 8 LEU N N 8 123.147 123.147 117.994 5.153 17915 26 1 1 . 1 1 8 8 LEU C C 8 177.495 177.495 174.721 2.774 17915 27 1 1 . 1 1 8 8 LEU CA C 8 53.425 53.425 54.187 -0.762 17915 28 1 1 . 1 1 8 8 LEU H H 8 8.292 8.292 7.333 0.959 17915 29 1 1 . 1 1 9 9 VAL N N 9 111.799 111.799 120.303 -8.504 17915 30 1 1 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.150 -2.256 17915 31 1 1 . 1 1 9 9 VAL H H 9 9.051 9.051 8.175 0.876 17915 32 1 1 . 1 1 10 10 LEU N N 10 123.127 123.127 128.414 -5.287 17915 33 1 1 . 1 1 10 10 LEU C C 10 176.729 176.729 174.802 1.927 17915 34 1 1 . 1 1 10 10 LEU CA C 10 52.489 52.489 53.243 -0.754 17915 35 1 1 . 1 1 10 10 LEU H H 10 8.864 8.864 8.659 0.205 17915 36 1 1 . 1 1 11 11 ALA N N 11 126.907 126.907 125.908 0.999 17915 37 1 1 . 1 1 11 11 ALA C C 11 178.406 178.406 176.823 1.583 17915 38 1 1 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.230 1.285 17915 39 1 1 . 1 1 11 11 ALA H H 11 8.988 8.988 8.292 0.696 17915 40 1 1 . 1 1 12 12 LEU N N 12 127.694 127.694 125.957 1.737 17915 41 1 1 . 1 1 12 12 LEU C C 12 175.046 175.046 175.280 -0.234 17915 42 1 1 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.033 -0.306 17915 43 1 1 . 1 1 12 12 LEU H H 12 9.136 9.136 8.411 0.725 17915 44 1 1 . 1 1 13 13 TYR N N 13 111.415 111.415 115.771 -4.356 17915 45 1 1 . 1 1 13 13 TYR C C 13 173.844 173.844 173.544 0.300 17915 46 1 1 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.965 -2.309 17915 47 1 1 . 1 1 13 13 TYR H H 13 6.979 6.979 7.543 -0.564 17915 48 1 1 . 1 1 14 14 ASP N N 14 117.591 117.591 122.802 -5.211 17915 49 1 1 . 1 1 14 14 ASP C C 14 176.140 176.140 174.367 1.773 17915 50 1 1 . 1 1 14 14 ASP CA C 14 54.522 54.522 54.825 -0.303 17915 51 1 1 . 1 1 14 14 ASP H H 14 8.260 8.260 8.216 0.044 17915 52 1 1 . 1 1 15 15 TYR N N 15 119.917 119.917 118.316 1.601 17915 53 1 1 . 1 1 15 15 TYR C C 15 172.859 172.859 174.621 -1.762 17915 54 1 1 . 1 1 15 15 TYR CA C 15 59.661 59.661 56.403 3.258 17915 55 1 1 . 1 1 15 15 TYR H H 15 8.580 8.580 8.473 0.107 17915 56 1 1 . 1 1 16 16 GLN N N 16 127.024 127.024 118.738 8.286 17915 57 1 1 . 1 1 16 16 GLN C C 16 176.377 176.377 174.014 2.363 17915 58 1 1 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.267 -1.601 17915 59 1 1 . 1 1 16 16 GLN H H 16 7.450 7.450 8.158 -0.708 17915 60 1 1 . 1 1 17 17 GLU N N 17 122.837 122.837 126.265 -3.428 17915 61 1 1 . 1 1 17 17 GLU C C 17 176.140 176.140 176.277 -0.137 17915 62 1 1 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.191 -0.116 17915 63 1 1 . 1 1 17 17 GLU H H 17 7.899 7.899 8.754 -0.855 17915 64 1 1 . 1 1 18 18 LYS N N 18 120.622 120.622 124.734 -4.112 17915 65 1 1 . 1 1 18 18 LYS C C 18 176.267 176.267 175.113 1.154 17915 66 1 1 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.635 -1.390 17915 67 1 1 . 1 1 18 18 LYS H H 18 8.649 8.649 8.418 0.231 17915 68 1 1 . 1 1 19 19 SER N N 19 115.184 115.184 112.451 2.733 17915 69 1 1 . 1 1 19 19 SER CA C 19 56.824 56.824 55.856 0.968 17915 70 1 1 . 1 1 19 19 SER H H 19 7.552 7.552 7.523 0.029 17915 71 1 1 . 1 1 21 21 ARG N N 21 113.440 113.440 115.531 -2.091 17915 72 1 1 . 1 1 21 21 ARG C C 21 176.638 176.638 176.516 0.122 17915 73 1 1 . 1 1 21 21 ARG CA C 21 56.208 56.208 57.035 -0.827 17915 74 1 1 . 1 1 21 21 ARG H H 21 7.596 7.596 8.117 -0.521 17915 75 1 1 . 1 1 22 22 GLU N N 22 121.392 121.392 119.203 2.189 17915 76 1 1 . 1 1 22 22 GLU C C 22 174.500 174.500 176.685 -2.185 17915 77 1 1 . 1 1 22 22 GLU CA C 22 55.352 55.352 57.261 -1.909 17915 78 1 1 . 1 1 22 22 GLU H H 22 7.746 7.746 7.790 -0.044 17915 79 1 1 . 1 1 23 23 VAL N N 23 114.115 114.115 117.863 -3.748 17915 80 1 1 . 1 1 23 23 VAL C C 23 172.337 172.337 174.936 -2.599 17915 81 1 1 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.670 -0.795 17915 82 1 1 . 1 1 23 23 VAL H H 23 7.318 7.318 8.494 -1.176 17915 83 1 1 . 1 1 24 24 THR N N 24 118.996 118.996 119.864 -0.868 17915 84 1 1 . 1 1 24 24 THR C C 24 174.451 174.451 173.191 1.260 17915 85 1 1 . 1 1 24 24 THR CA C 24 61.641 61.641 61.539 0.102 17915 86 1 1 . 1 1 24 24 THR H H 24 7.324 7.324 8.387 -1.063 17915 87 1 1 . 1 1 25 25 MET N N 25 121.901 121.901 126.926 -5.025 17915 88 1 1 . 1 1 25 25 MET C C 25 173.931 173.931 174.206 -0.275 17915 89 1 1 . 1 1 25 25 MET CA C 25 54.389 54.389 54.776 -0.387 17915 90 1 1 . 1 1 25 25 MET H H 25 9.432 9.432 8.688 0.744 17915 91 1 1 . 1 1 26 26 LYS N N 26 124.169 124.169 122.120 2.049 17915 92 1 1 . 1 1 26 26 LYS C C 26 175.002 175.002 175.228 -0.226 17915 93 1 1 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.167 -1.501 17915 94 1 1 . 1 1 26 26 LYS H H 26 8.634 8.634 8.567 0.067 17915 95 1 1 . 1 1 27 27 LYS N N 27 122.603 122.603 126.417 -3.814 17915 96 1 1 . 1 1 27 27 LYS C C 27 177.318 177.318 177.024 0.294 17915 97 1 1 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.629 0.015 17915 98 1 1 . 1 1 27 27 LYS H H 27 8.919 8.919 8.970 -0.051 17915 99 1 1 . 1 1 28 28 GLY N N 28 115.585 115.585 115.716 -0.131 17915 100 1 1 . 1 1 28 28 GLY C C 28 174.193 174.193 174.669 -0.476 17915 101 1 1 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.608 0.280 17915 102 1 1 . 1 1 28 28 GLY H H 28 8.732 8.732 8.503 0.229 17915 103 1 1 . 1 1 29 29 ASP N N 29 121.770 121.770 122.662 -0.892 17915 104 1 1 . 1 1 29 29 ASP C C 29 174.281 174.281 175.672 -1.391 17915 105 1 1 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.092 1.394 17915 106 1 1 . 1 1 29 29 ASP H H 29 8.388 8.388 8.196 0.192 17915 107 1 1 . 1 1 30 30 ILE N N 30 120.469 120.469 114.303 6.166 17915 108 1 1 . 1 1 30 30 ILE C C 30 176.356 176.356 175.154 1.202 17915 109 1 1 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.769 0.480 17915 110 1 1 . 1 1 30 30 ILE H H 30 8.033 8.033 7.986 0.047 17915 111 1 1 . 1 1 31 31 LEU N N 31 127.129 127.129 128.759 -1.630 17915 112 1 1 . 1 1 31 31 LEU C C 31 175.745 175.745 176.384 -0.639 17915 113 1 1 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.424 0.483 17915 114 1 1 . 1 1 31 31 LEU H H 31 9.223 9.223 8.149 1.074 17915 115 1 1 . 1 1 32 32 THR N N 32 117.055 117.055 120.722 -3.667 17915 116 1 1 . 1 1 32 32 THR C C 32 173.844 173.844 174.605 -0.761 17915 117 1 1 . 1 1 32 32 THR CA C 32 63.247 63.247 61.769 1.478 17915 118 1 1 . 1 1 32 32 THR H H 32 8.360 8.360 8.508 -0.147 17915 119 1 1 . 1 1 33 33 LEU N N 33 128.815 128.815 125.138 3.677 17915 120 1 1 . 1 1 33 33 LEU C C 33 174.718 174.718 175.768 -1.050 17915 121 1 1 . 1 1 33 33 LEU CA C 33 54.870 54.870 55.255 -0.385 17915 122 1 1 . 1 1 33 33 LEU H H 33 8.937 8.937 8.725 0.212 17915 123 1 1 . 1 1 34 34 LEU N N 34 126.230 126.230 124.885 1.345 17915 124 1 1 . 1 1 34 34 LEU C C 34 177.689 177.689 176.670 1.019 17915 125 1 1 . 1 1 34 34 LEU CA C 34 55.218 55.218 54.447 0.771 17915 126 1 1 . 1 1 34 34 LEU H H 34 8.929 8.929 8.324 0.605 17915 127 1 1 . 1 1 35 35 ASN N N 35 113.879 113.879 116.576 -2.697 17915 128 1 1 . 1 1 35 35 ASN C C 35 174.565 174.565 173.003 1.562 17915 129 1 1 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.374 1.202 17915 130 1 1 . 1 1 35 35 ASN H H 35 7.489 7.489 7.575 -0.086 17915 131 1 1 . 1 1 36 36 SER N N 36 123.684 123.684 118.517 5.167 17915 132 1 1 . 1 1 36 36 SER C C 36 173.503 173.503 173.954 -0.451 17915 133 1 1 . 1 1 36 36 SER CA C 36 56.904 56.904 57.526 -0.622 17915 134 1 1 . 1 1 36 36 SER H H 36 9.086 9.086 8.359 0.727 17915 135 1 1 . 1 1 37 37 THR N N 37 115.012 115.012 117.718 -2.706 17915 136 1 1 . 1 1 37 37 THR C C 37 175.417 175.417 175.214 0.203 17915 137 1 1 . 1 1 37 37 THR CA C 37 65.521 65.521 62.449 3.072 17915 138 1 1 . 1 1 37 37 THR H H 37 8.071 8.071 8.404 -0.333 17915 139 1 1 . 1 1 38 38 ASN N N 38 122.517 122.517 120.272 2.245 17915 140 1 1 . 1 1 38 38 ASN C C 38 174.696 174.696 174.567 0.129 17915 141 1 1 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.460 1.019 17915 142 1 1 . 1 1 38 38 ASN H H 38 8.595 8.595 8.170 0.425 17915 143 1 1 . 1 1 39 39 LYS N N 39 120.851 120.851 120.112 0.739 17915 144 1 1 . 1 1 39 39 LYS C C 39 176.444 176.444 177.066 -0.622 17915 145 1 1 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.434 -0.031 17915 146 1 1 . 1 1 39 39 LYS H H 39 8.416 8.416 8.493 -0.077 17915 147 1 1 . 1 1 40 40 ASP N N 40 114.427 114.427 118.983 -4.556 17915 148 1 1 . 1 1 40 40 ASP C C 40 176.960 176.960 175.835 1.125 17915 149 1 1 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.387 -0.035 17915 150 1 1 . 1 1 40 40 ASP H H 40 8.085 8.085 8.551 -0.466 17915 151 1 1 . 1 1 41 41 TRP N N 41 122.708 122.708 121.229 1.479 17915 152 1 1 . 1 1 41 41 TRP C C 41 174.303 174.303 175.093 -0.790 17915 153 1 1 . 1 1 41 41 TRP CA C 41 56.208 56.208 57.085 -0.877 17915 154 1 1 . 1 1 41 41 TRP H H 41 8.096 8.096 7.965 0.131 17915 155 1 1 . 1 1 42 42 TRP N N 42 124.707 124.707 125.238 -0.531 17915 156 1 1 . 1 1 42 42 TRP C C 42 174.303 174.303 174.894 -0.591 17915 157 1 1 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.850 -2.863 17915 158 1 1 . 1 1 42 42 TRP H H 42 9.245 9.245 9.087 0.158 17915 159 1 1 . 1 1 43 43 LYS N N 43 124.005 124.005 123.235 0.770 17915 160 1 1 . 1 1 43 43 LYS C C 43 175.482 175.482 175.520 -0.038 17915 161 1 1 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.519 -0.140 17915 162 1 1 . 1 1 43 43 LYS H H 43 8.783 8.783 8.160 0.623 17915 163 1 1 . 1 1 44 44 VAL N N 44 122.139 122.139 119.773 2.366 17915 164 1 1 . 1 1 44 44 VAL C C 44 173.472 173.472 173.929 -0.457 17915 165 1 1 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.181 -0.109 17915 166 1 1 . 1 1 44 44 VAL H H 44 9.287 9.287 8.299 0.988 17915 167 1 1 . 1 1 45 45 GLU N N 45 118.524 118.524 121.602 -3.078 17915 168 1 1 . 1 1 45 45 GLU C C 45 174.827 174.827 175.778 -0.951 17915 169 1 1 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.688 -0.513 17915 170 1 1 . 1 1 45 45 GLU H H 45 8.566 8.566 7.951 0.615 17915 171 1 1 . 1 1 46 46 VAL N N 46 124.904 124.904 127.085 -2.181 17915 172 1 1 . 1 1 46 46 VAL C C 46 174.608 174.608 175.719 -1.111 17915 173 1 1 . 1 1 46 46 VAL CA C 46 60.651 60.651 60.577 0.074 17915 174 1 1 . 1 1 46 46 VAL H H 46 8.774 8.774 8.939 -0.165 17915 175 1 1 . 1 1 47 47 ASN N N 47 126.530 126.530 127.905 -1.375 17915 176 1 1 . 1 1 47 47 ASN C C 47 174.259 174.259 174.683 -0.424 17915 177 1 1 . 1 1 47 47 ASN CA C 47 55.245 55.245 53.744 1.501 17915 178 1 1 . 1 1 47 47 ASN H H 47 9.356 9.356 8.922 0.434 17915 179 1 1 . 1 1 48 48 ASP N N 48 112.420 112.420 113.351 -0.931 17915 180 1 1 . 1 1 48 48 ASP C C 48 174.521 174.521 175.219 -0.698 17915 181 1 1 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.095 -0.412 17915 182 1 1 . 1 1 48 48 ASP H H 48 8.628 8.628 8.592 0.036 17915 183 1 1 . 1 1 49 49 ARG N N 49 120.379 120.379 118.716 1.663 17915 184 1 1 . 1 1 49 49 ARG C C 49 174.477 174.477 174.497 -0.020 17915 185 1 1 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.240 0.058 17915 186 1 1 . 1 1 49 49 ARG H H 49 8.069 8.069 7.674 0.395 17915 187 1 1 . 1 1 50 50 GLN N N 50 118.647 118.647 121.993 -3.346 17915 188 1 1 . 1 1 50 50 GLN C C 50 175.963 175.963 175.407 0.556 17915 189 1 1 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.387 -0.962 17915 190 1 1 . 1 1 50 50 GLN H H 50 8.432 8.432 8.585 -0.153 17915 191 1 1 . 1 1 51 51 GLY N N 51 107.028 107.028 108.362 -1.334 17915 192 1 1 . 1 1 51 51 GLY C C 51 170.479 170.479 171.735 -1.256 17915 193 1 1 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.617 0.021 17915 194 1 1 . 1 1 51 51 GLY H H 51 8.534 8.534 8.195 0.339 17915 195 1 1 . 1 1 52 52 PHE N N 52 119.030 119.030 121.716 -2.686 17915 196 1 1 . 1 1 52 52 PHE C C 52 175.635 175.635 174.323 1.312 17915 197 1 1 . 1 1 52 52 PHE CA C 52 58.724 58.724 55.944 2.780 17915 198 1 1 . 1 1 52 52 PHE H H 52 9.098 9.098 7.979 1.119 17915 199 1 1 . 1 1 53 53 VAL N N 53 110.897 110.897 122.880 -11.983 17915 200 1 1 . 1 1 53 53 VAL CA C 53 58.108 58.108 56.863 1.245 17915 201 1 1 . 1 1 53 53 VAL H H 53 8.942 8.942 7.954 0.988 17915 202 1 1 . 1 1 55 55 ALA N N 55 129.055 129.055 129.059 -0.004 17915 203 1 1 . 1 1 55 55 ALA C C 55 178.565 178.565 178.597 -0.032 17915 204 1 1 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.829 -0.200 17915 205 1 1 . 1 1 55 55 ALA H H 55 7.355 7.355 7.925 -0.570 17915 206 1 1 . 1 1 56 56 ALA N N 56 113.282 113.282 119.354 -6.072 17915 207 1 1 . 1 1 56 56 ALA C C 56 178.214 178.214 177.819 0.395 17915 208 1 1 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.629 -0.686 17915 209 1 1 . 1 1 56 56 ALA H H 56 7.750 7.750 8.313 -0.563 17915 210 1 1 . 1 1 57 57 TYR N N 57 116.083 116.083 116.539 -0.456 17915 211 1 1 . 1 1 57 57 TYR C C 57 174.565 174.565 174.188 0.377 17915 212 1 1 . 1 1 57 57 TYR CA C 57 56.422 56.422 57.420 -0.998 17915 213 1 1 . 1 1 57 57 TYR H H 57 7.611 7.611 7.861 -0.250 17915 214 1 1 . 1 1 58 58 VAL N N 58 110.965 110.965 112.592 -1.627 17915 215 1 1 . 1 1 58 58 VAL C C 58 173.647 173.647 173.922 -0.275 17915 216 1 1 . 1 1 58 58 VAL CA C 58 58.242 58.242 58.905 -0.663 17915 217 1 1 . 1 1 58 58 VAL H H 58 7.301 7.301 7.255 0.046 17915 218 1 1 . 1 1 59 59 LYS N N 59 118.586 118.586 120.843 -2.257 17915 219 1 1 . 1 1 59 59 LYS C C 59 176.160 176.160 175.104 1.056 17915 220 1 1 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.416 -1.375 17915 221 1 1 . 1 1 59 59 LYS H H 59 8.515 8.515 8.155 0.360 17915 222 1 1 . 1 1 60 60 LYS N N 60 125.734 125.734 123.525 2.209 17915 223 1 1 . 1 1 60 60 LYS C C 60 176.793 176.793 176.856 -0.063 17915 224 1 1 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.607 3.010 17915 225 1 1 . 1 1 60 60 LYS H H 60 9.135 9.135 8.534 0.601 17915 226 1 1 . 1 1 61 61 LEU N N 61 125.061 125.061 122.718 2.343 17915 227 1 1 . 1 1 61 61 LEU C C 61 174.106 174.106 175.853 -1.747 17915 228 1 1 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.780 -0.803 17915 229 1 1 . 1 1 61 61 LEU H H 61 8.384 8.384 8.640 -0.256 17915 230 1 2 . 1 1 2 2 ASP N N 2 123.220 123.220 121.793 1.427 17915 231 1 2 . 1 1 2 2 ASP C C 2 175.703 175.703 175.098 0.605 17915 232 1 2 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.091 -0.050 17915 233 1 2 . 1 1 2 2 ASP H H 2 8.738 8.738 8.497 0.241 17915 234 1 2 . 1 1 3 3 GLU N N 3 121.895 121.895 122.726 -0.831 17915 235 1 2 . 1 1 3 3 GLU C C 3 176.480 176.480 175.193 1.287 17915 236 1 2 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.917 -0.789 17915 237 1 2 . 1 1 3 3 GLU H H 3 8.570 8.570 8.489 0.081 17915 238 1 2 . 1 1 4 4 THR N N 4 114.607 114.607 121.181 -6.574 17915 239 1 2 . 1 1 4 4 THR C C 4 175.417 175.417 174.677 0.740 17915 240 1 2 . 1 1 4 4 THR CA C 4 62.685 62.685 64.490 -1.806 17915 241 1 2 . 1 1 4 4 THR H H 4 8.176 8.176 8.698 -0.522 17915 242 1 2 . 1 1 5 5 GLY N N 5 111.430 111.430 114.594 -3.164 17915 243 1 2 . 1 1 5 5 GLY C C 5 173.777 173.777 172.910 0.867 17915 244 1 2 . 1 1 5 5 GLY CA C 5 45.560 45.560 44.926 0.634 17915 245 1 2 . 1 1 5 5 GLY H H 5 8.344 8.344 7.992 0.352 17915 246 1 2 . 1 1 6 6 LYS N N 6 119.850 119.850 123.073 -3.223 17915 247 1 2 . 1 1 6 6 LYS C C 6 176.049 176.049 176.039 0.010 17915 248 1 2 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.631 0.283 17915 249 1 2 . 1 1 6 6 LYS H H 6 7.903 7.903 7.899 0.004 17915 250 1 2 . 1 1 7 7 GLU N N 7 123.025 123.025 120.808 2.217 17915 251 1 2 . 1 1 7 7 GLU C C 7 174.172 174.172 174.144 0.028 17915 252 1 2 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.294 -1.835 17915 253 1 2 . 1 1 7 7 GLU H H 7 8.562 8.562 8.776 -0.214 17915 254 1 2 . 1 1 8 8 LEU N N 8 123.147 123.147 115.878 7.269 17915 255 1 2 . 1 1 8 8 LEU C C 8 177.495 177.495 174.859 2.636 17915 256 1 2 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.361 0.064 17915 257 1 2 . 1 1 8 8 LEU H H 8 8.292 8.292 7.382 0.910 17915 258 1 2 . 1 1 9 9 VAL N N 9 111.799 111.799 116.598 -4.799 17915 259 1 2 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.680 -1.786 17915 260 1 2 . 1 1 9 9 VAL H H 9 9.051 9.051 8.197 0.854 17915 261 1 2 . 1 1 10 10 LEU N N 10 123.127 123.127 125.709 -2.582 17915 262 1 2 . 1 1 10 10 LEU C C 10 176.729 176.729 174.955 1.774 17915 263 1 2 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.361 0.128 17915 264 1 2 . 1 1 10 10 LEU H H 10 8.864 8.864 8.221 0.643 17915 265 1 2 . 1 1 11 11 ALA N N 11 126.907 126.907 124.324 2.583 17915 266 1 2 . 1 1 11 11 ALA C C 11 178.406 178.406 177.367 1.039 17915 267 1 2 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.829 0.686 17915 268 1 2 . 1 1 11 11 ALA H H 11 8.988 8.988 8.648 0.340 17915 269 1 2 . 1 1 12 12 LEU N N 12 127.694 127.694 126.206 1.488 17915 270 1 2 . 1 1 12 12 LEU C C 12 175.046 175.046 175.545 -0.499 17915 271 1 2 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.360 -0.633 17915 272 1 2 . 1 1 12 12 LEU H H 12 9.136 9.136 8.016 1.120 17915 273 1 2 . 1 1 13 13 TYR N N 13 111.415 111.415 116.087 -4.672 17915 274 1 2 . 1 1 13 13 TYR C C 13 173.844 173.844 173.215 0.629 17915 275 1 2 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.702 -2.046 17915 276 1 2 . 1 1 13 13 TYR H H 13 6.979 6.979 7.560 -0.581 17915 277 1 2 . 1 1 14 14 ASP N N 14 117.591 117.591 125.689 -8.098 17915 278 1 2 . 1 1 14 14 ASP C C 14 176.140 176.140 174.200 1.940 17915 279 1 2 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.434 -0.913 17915 280 1 2 . 1 1 14 14 ASP H H 14 8.260 8.260 7.900 0.360 17915 281 1 2 . 1 1 15 15 TYR N N 15 119.917 119.917 122.583 -2.666 17915 282 1 2 . 1 1 15 15 TYR C C 15 172.859 172.859 174.011 -1.152 17915 283 1 2 . 1 1 15 15 TYR CA C 15 59.661 59.661 56.836 2.825 17915 284 1 2 . 1 1 15 15 TYR H H 15 8.580 8.580 8.863 -0.283 17915 285 1 2 . 1 1 16 16 GLN N N 16 127.024 127.024 116.165 10.859 17915 286 1 2 . 1 1 16 16 GLN C C 16 176.377 176.377 174.322 2.055 17915 287 1 2 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.171 -0.505 17915 288 1 2 . 1 1 16 16 GLN H H 16 7.450 7.450 8.205 -0.755 17915 289 1 2 . 1 1 17 17 GLU N N 17 122.837 122.837 122.821 0.016 17915 290 1 2 . 1 1 17 17 GLU C C 17 176.140 176.140 176.035 0.105 17915 291 1 2 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.379 -0.304 17915 292 1 2 . 1 1 17 17 GLU H H 17 7.899 7.899 8.872 -0.973 17915 293 1 2 . 1 1 18 18 LYS N N 18 120.622 120.622 123.065 -2.443 17915 294 1 2 . 1 1 18 18 LYS C C 18 176.267 176.267 175.637 0.630 17915 295 1 2 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.011 -0.766 17915 296 1 2 . 1 1 18 18 LYS H H 18 8.649 8.649 8.180 0.469 17915 297 1 2 . 1 1 19 19 SER N N 19 115.184 115.184 113.714 1.470 17915 298 1 2 . 1 1 19 19 SER CA C 19 56.824 56.824 56.525 0.299 17915 299 1 2 . 1 1 19 19 SER H H 19 7.552 7.552 7.572 -0.020 17915 300 1 2 . 1 1 21 21 ARG N N 21 113.440 113.440 116.845 -3.405 17915 301 1 2 . 1 1 21 21 ARG C C 21 176.638 176.638 176.075 0.563 17915 302 1 2 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.553 -0.345 17915 303 1 2 . 1 1 21 21 ARG H H 21 7.596 7.596 8.014 -0.418 17915 304 1 2 . 1 1 22 22 GLU N N 22 121.392 121.392 118.144 3.248 17915 305 1 2 . 1 1 22 22 GLU C C 22 174.500 174.500 175.917 -1.417 17915 306 1 2 . 1 1 22 22 GLU CA C 22 55.352 55.352 57.321 -1.969 17915 307 1 2 . 1 1 22 22 GLU H H 22 7.746 7.746 7.890 -0.144 17915 308 1 2 . 1 1 23 23 VAL N N 23 114.115 114.115 111.980 2.135 17915 309 1 2 . 1 1 23 23 VAL C C 23 172.337 172.337 174.304 -1.967 17915 310 1 2 . 1 1 23 23 VAL CA C 23 59.875 59.875 59.401 0.474 17915 311 1 2 . 1 1 23 23 VAL H H 23 7.318 7.318 8.198 -0.880 17915 312 1 2 . 1 1 24 24 THR N N 24 118.996 118.996 119.373 -0.377 17915 313 1 2 . 1 1 24 24 THR C C 24 174.451 174.451 173.951 0.500 17915 314 1 2 . 1 1 24 24 THR CA C 24 61.641 61.641 62.019 -0.378 17915 315 1 2 . 1 1 24 24 THR H H 24 7.324 7.324 8.290 -0.966 17915 316 1 2 . 1 1 25 25 MET N N 25 121.901 121.901 122.328 -0.427 17915 317 1 2 . 1 1 25 25 MET C C 25 173.931 173.931 173.805 0.126 17915 318 1 2 . 1 1 25 25 MET CA C 25 54.389 54.389 54.246 0.143 17915 319 1 2 . 1 1 25 25 MET H H 25 9.432 9.432 8.362 1.070 17915 320 1 2 . 1 1 26 26 LYS N N 26 124.169 124.169 120.871 3.298 17915 321 1 2 . 1 1 26 26 LYS C C 26 175.002 175.002 176.170 -1.168 17915 322 1 2 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.179 -0.513 17915 323 1 2 . 1 1 26 26 LYS H H 26 8.634 8.634 8.571 0.063 17915 324 1 2 . 1 1 27 27 LYS N N 27 122.603 122.603 125.213 -2.610 17915 325 1 2 . 1 1 27 27 LYS C C 27 177.318 177.318 177.319 -0.001 17915 326 1 2 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.564 0.080 17915 327 1 2 . 1 1 27 27 LYS H H 27 8.919 8.919 8.905 0.014 17915 328 1 2 . 1 1 28 28 GLY N N 28 115.585 115.585 114.469 1.116 17915 329 1 2 . 1 1 28 28 GLY C C 28 174.193 174.193 174.551 -0.358 17915 330 1 2 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.903 -0.014 17915 331 1 2 . 1 1 28 28 GLY H H 28 8.732 8.732 8.633 0.099 17915 332 1 2 . 1 1 29 29 ASP N N 29 121.770 121.770 122.527 -0.757 17915 333 1 2 . 1 1 29 29 ASP C C 29 174.281 174.281 175.608 -1.327 17915 334 1 2 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.376 1.110 17915 335 1 2 . 1 1 29 29 ASP H H 29 8.388 8.388 7.971 0.417 17915 336 1 2 . 1 1 30 30 ILE N N 30 120.469 120.469 117.513 2.956 17915 337 1 2 . 1 1 30 30 ILE C C 30 176.356 176.356 174.993 1.363 17915 338 1 2 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.763 0.486 17915 339 1 2 . 1 1 30 30 ILE H H 30 8.033 8.033 8.087 -0.054 17915 340 1 2 . 1 1 31 31 LEU N N 31 127.129 127.129 126.643 0.486 17915 341 1 2 . 1 1 31 31 LEU C C 31 175.745 175.745 176.361 -0.616 17915 342 1 2 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.248 0.659 17915 343 1 2 . 1 1 31 31 LEU H H 31 9.223 9.223 8.982 0.241 17915 344 1 2 . 1 1 32 32 THR N N 32 117.055 117.055 113.855 3.200 17915 345 1 2 . 1 1 32 32 THR C C 32 173.844 173.844 173.565 0.279 17915 346 1 2 . 1 1 32 32 THR CA C 32 63.247 63.247 60.934 2.313 17915 347 1 2 . 1 1 32 32 THR H H 32 8.360 8.360 8.645 -0.285 17915 348 1 2 . 1 1 33 33 LEU N N 33 128.815 128.815 125.085 3.730 17915 349 1 2 . 1 1 33 33 LEU C C 33 174.718 174.718 175.753 -1.035 17915 350 1 2 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.690 0.180 17915 351 1 2 . 1 1 33 33 LEU H H 33 8.937 8.937 8.646 0.291 17915 352 1 2 . 1 1 34 34 LEU N N 34 126.230 126.230 128.504 -2.274 17915 353 1 2 . 1 1 34 34 LEU C C 34 177.689 177.689 176.615 1.074 17915 354 1 2 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.535 -0.317 17915 355 1 2 . 1 1 34 34 LEU H H 34 8.929 8.929 8.854 0.075 17915 356 1 2 . 1 1 35 35 ASN N N 35 113.879 113.879 114.524 -0.645 17915 357 1 2 . 1 1 35 35 ASN C C 35 174.565 174.565 173.121 1.444 17915 358 1 2 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.298 1.278 17915 359 1 2 . 1 1 35 35 ASN H H 35 7.489 7.489 7.650 -0.161 17915 360 1 2 . 1 1 36 36 SER N N 36 123.684 123.684 119.665 4.019 17915 361 1 2 . 1 1 36 36 SER C C 36 173.503 173.503 174.338 -0.835 17915 362 1 2 . 1 1 36 36 SER CA C 36 56.904 56.904 58.031 -1.127 17915 363 1 2 . 1 1 36 36 SER H H 36 9.086 9.086 8.766 0.320 17915 364 1 2 . 1 1 37 37 THR N N 37 115.012 115.012 121.426 -6.414 17915 365 1 2 . 1 1 37 37 THR C C 37 175.417 175.417 174.767 0.650 17915 366 1 2 . 1 1 37 37 THR CA C 37 65.521 65.521 64.562 0.959 17915 367 1 2 . 1 1 37 37 THR H H 37 8.071 8.071 8.839 -0.768 17915 368 1 2 . 1 1 38 38 ASN N N 38 122.517 122.517 117.080 5.437 17915 369 1 2 . 1 1 38 38 ASN C C 38 174.696 174.696 174.827 -0.131 17915 370 1 2 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.443 1.036 17915 371 1 2 . 1 1 38 38 ASN H H 38 8.595 8.595 7.952 0.643 17915 372 1 2 . 1 1 39 39 LYS N N 39 120.851 120.851 120.188 0.663 17915 373 1 2 . 1 1 39 39 LYS C C 39 176.444 176.444 176.393 0.051 17915 374 1 2 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.680 -0.277 17915 375 1 2 . 1 1 39 39 LYS H H 39 8.416 8.416 8.642 -0.226 17915 376 1 2 . 1 1 40 40 ASP N N 40 114.427 114.427 117.014 -2.587 17915 377 1 2 . 1 1 40 40 ASP C C 40 176.960 176.960 174.531 2.429 17915 378 1 2 . 1 1 40 40 ASP CA C 40 55.352 55.352 54.607 0.745 17915 379 1 2 . 1 1 40 40 ASP H H 40 8.085 8.085 8.155 -0.070 17915 380 1 2 . 1 1 41 41 TRP N N 41 122.708 122.708 120.917 1.791 17915 381 1 2 . 1 1 41 41 TRP C C 41 174.303 174.303 174.267 0.036 17915 382 1 2 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.145 0.063 17915 383 1 2 . 1 1 41 41 TRP H H 41 8.096 8.096 7.688 0.408 17915 384 1 2 . 1 1 42 42 TRP N N 42 124.707 124.707 123.997 0.710 17915 385 1 2 . 1 1 42 42 TRP C C 42 174.303 174.303 174.149 0.154 17915 386 1 2 . 1 1 42 42 TRP CA C 42 53.987 53.987 54.906 -0.918 17915 387 1 2 . 1 1 42 42 TRP H H 42 9.245 9.245 7.786 1.459 17915 388 1 2 . 1 1 43 43 LYS N N 43 124.005 124.005 122.209 1.796 17915 389 1 2 . 1 1 43 43 LYS C C 43 175.482 175.482 175.334 0.148 17915 390 1 2 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.582 -0.203 17915 391 1 2 . 1 1 43 43 LYS H H 43 8.783 8.783 8.273 0.510 17915 392 1 2 . 1 1 44 44 VAL N N 44 122.139 122.139 119.486 2.653 17915 393 1 2 . 1 1 44 44 VAL C C 44 173.472 173.472 174.268 -0.796 17915 394 1 2 . 1 1 44 44 VAL CA C 44 59.072 59.072 58.235 0.837 17915 395 1 2 . 1 1 44 44 VAL H H 44 9.287 9.287 8.368 0.919 17915 396 1 2 . 1 1 45 45 GLU N N 45 118.524 118.524 120.146 -1.622 17915 397 1 2 . 1 1 45 45 GLU C C 45 174.827 174.827 175.504 -0.677 17915 398 1 2 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.687 -0.513 17915 399 1 2 . 1 1 45 45 GLU H H 45 8.566 8.566 7.995 0.571 17915 400 1 2 . 1 1 46 46 VAL N N 46 124.904 124.904 123.573 1.331 17915 401 1 2 . 1 1 46 46 VAL C C 46 174.608 174.608 175.232 -0.624 17915 402 1 2 . 1 1 46 46 VAL CA C 46 60.651 60.651 60.203 0.448 17915 403 1 2 . 1 1 46 46 VAL H H 46 8.774 8.774 7.830 0.944 17915 404 1 2 . 1 1 47 47 ASN N N 47 126.530 126.530 124.983 1.547 17915 405 1 2 . 1 1 47 47 ASN C C 47 174.259 174.259 175.019 -0.760 17915 406 1 2 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.206 1.038 17915 407 1 2 . 1 1 47 47 ASN H H 47 9.356 9.356 9.063 0.293 17915 408 1 2 . 1 1 48 48 ASP N N 48 112.420 112.420 115.597 -3.177 17915 409 1 2 . 1 1 48 48 ASP C C 48 174.521 174.521 175.136 -0.615 17915 410 1 2 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.713 -1.030 17915 411 1 2 . 1 1 48 48 ASP H H 48 8.628 8.628 8.379 0.249 17915 412 1 2 . 1 1 49 49 ARG N N 49 120.379 120.379 118.342 2.037 17915 413 1 2 . 1 1 49 49 ARG C C 49 174.477 174.477 174.295 0.182 17915 414 1 2 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.310 -0.012 17915 415 1 2 . 1 1 49 49 ARG H H 49 8.069 8.069 7.656 0.413 17915 416 1 2 . 1 1 50 50 GLN N N 50 118.647 118.647 120.739 -2.092 17915 417 1 2 . 1 1 50 50 GLN C C 50 175.963 175.963 174.350 1.613 17915 418 1 2 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.236 -0.811 17915 419 1 2 . 1 1 50 50 GLN H H 50 8.432 8.432 8.495 -0.063 17915 420 1 2 . 1 1 51 51 GLY N N 51 107.028 107.028 108.509 -1.481 17915 421 1 2 . 1 1 51 51 GLY C C 51 170.479 170.479 172.792 -2.313 17915 422 1 2 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.650 -0.012 17915 423 1 2 . 1 1 51 51 GLY H H 51 8.534 8.534 8.416 0.118 17915 424 1 2 . 1 1 52 52 PHE N N 52 119.030 119.030 119.492 -0.462 17915 425 1 2 . 1 1 52 52 PHE C C 52 175.635 175.635 173.725 1.910 17915 426 1 2 . 1 1 52 52 PHE CA C 52 58.724 58.724 56.674 2.050 17915 427 1 2 . 1 1 52 52 PHE H H 52 9.098 9.098 7.633 1.465 17915 428 1 2 . 1 1 53 53 VAL N N 53 110.897 110.897 123.698 -12.801 17915 429 1 2 . 1 1 53 53 VAL CA C 53 58.108 58.108 59.214 -1.106 17915 430 1 2 . 1 1 53 53 VAL H H 53 8.942 8.942 8.505 0.437 17915 431 1 2 . 1 1 55 55 ALA N N 55 129.055 129.055 121.777 7.278 17915 432 1 2 . 1 1 55 55 ALA C C 55 178.565 178.565 179.357 -0.792 17915 433 1 2 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.753 -0.124 17915 434 1 2 . 1 1 55 55 ALA H H 55 7.355 7.355 8.076 -0.721 17915 435 1 2 . 1 1 56 56 ALA N N 56 113.282 113.282 119.519 -6.237 17915 436 1 2 . 1 1 56 56 ALA C C 56 178.214 178.214 178.269 -0.055 17915 437 1 2 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.989 -1.046 17915 438 1 2 . 1 1 56 56 ALA H H 56 7.750 7.750 7.882 -0.132 17915 439 1 2 . 1 1 57 57 TYR N N 57 116.083 116.083 116.173 -0.090 17915 440 1 2 . 1 1 57 57 TYR C C 57 174.565 174.565 175.590 -1.025 17915 441 1 2 . 1 1 57 57 TYR CA C 57 56.422 56.422 59.928 -3.506 17915 442 1 2 . 1 1 57 57 TYR H H 57 7.611 7.611 7.681 -0.070 17915 443 1 2 . 1 1 58 58 VAL N N 58 110.965 110.965 110.209 0.756 17915 444 1 2 . 1 1 58 58 VAL C C 58 173.647 173.647 173.998 -0.351 17915 445 1 2 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.895 -1.653 17915 446 1 2 . 1 1 58 58 VAL H H 58 7.301 7.301 7.851 -0.550 17915 447 1 2 . 1 1 59 59 LYS N N 59 118.586 118.586 119.478 -0.892 17915 448 1 2 . 1 1 59 59 LYS C C 59 176.160 176.160 174.900 1.260 17915 449 1 2 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.903 -0.862 17915 450 1 2 . 1 1 59 59 LYS H H 59 8.515 8.515 8.183 0.332 17915 451 1 2 . 1 1 60 60 LYS N N 60 125.734 125.734 122.178 3.556 17915 452 1 2 . 1 1 60 60 LYS C C 60 176.793 176.793 176.259 0.534 17915 453 1 2 . 1 1 60 60 LYS CA C 60 58.617 58.617 57.013 1.605 17915 454 1 2 . 1 1 60 60 LYS H H 60 9.135 9.135 8.539 0.596 17915 455 1 2 . 1 1 61 61 LEU N N 61 125.061 125.061 122.833 2.228 17915 456 1 2 . 1 1 61 61 LEU C C 61 174.106 174.106 175.966 -1.860 17915 457 1 2 . 1 1 61 61 LEU CA C 61 54.977 54.977 53.848 1.129 17915 458 1 2 . 1 1 61 61 LEU H H 61 8.384 8.384 8.570 -0.186 17915 459 1 3 . 1 1 2 2 ASP N N 2 123.220 123.220 119.296 3.924 17915 460 1 3 . 1 1 2 2 ASP C C 2 175.703 175.703 174.993 0.710 17915 461 1 3 . 1 1 2 2 ASP CA C 2 54.041 54.041 53.748 0.293 17915 462 1 3 . 1 1 2 2 ASP H H 2 8.738 8.738 8.199 0.539 17915 463 1 3 . 1 1 3 3 GLU N N 3 121.895 121.895 120.539 1.356 17915 464 1 3 . 1 1 3 3 GLU C C 3 176.480 176.480 175.313 1.167 17915 465 1 3 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.606 -0.478 17915 466 1 3 . 1 1 3 3 GLU H H 3 8.570 8.570 8.658 -0.088 17915 467 1 3 . 1 1 4 4 THR N N 4 114.607 114.607 113.939 0.668 17915 468 1 3 . 1 1 4 4 THR C C 4 175.417 175.417 173.536 1.881 17915 469 1 3 . 1 1 4 4 THR CA C 4 62.685 62.685 62.288 0.397 17915 470 1 3 . 1 1 4 4 THR H H 4 8.176 8.176 7.945 0.231 17915 471 1 3 . 1 1 5 5 GLY N N 5 111.430 111.430 111.455 -0.025 17915 472 1 3 . 1 1 5 5 GLY C C 5 173.777 173.777 172.777 1.000 17915 473 1 3 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.461 0.100 17915 474 1 3 . 1 1 5 5 GLY H H 5 8.344 8.344 8.375 -0.031 17915 475 1 3 . 1 1 6 6 LYS N N 6 119.850 119.850 122.110 -2.260 17915 476 1 3 . 1 1 6 6 LYS C C 6 176.049 176.049 176.455 -0.406 17915 477 1 3 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.491 0.423 17915 478 1 3 . 1 1 6 6 LYS H H 6 7.903 7.903 7.923 -0.020 17915 479 1 3 . 1 1 7 7 GLU N N 7 123.025 123.025 117.485 5.540 17915 480 1 3 . 1 1 7 7 GLU C C 7 174.172 174.172 174.541 -0.369 17915 481 1 3 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.600 -2.141 17915 482 1 3 . 1 1 7 7 GLU H H 7 8.562 8.562 8.744 -0.182 17915 483 1 3 . 1 1 8 8 LEU N N 8 123.147 123.147 115.349 7.798 17915 484 1 3 . 1 1 8 8 LEU C C 8 177.495 177.495 175.259 2.236 17915 485 1 3 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.603 -0.178 17915 486 1 3 . 1 1 8 8 LEU H H 8 8.292 8.292 7.374 0.918 17915 487 1 3 . 1 1 9 9 VAL N N 9 111.799 111.799 113.990 -2.191 17915 488 1 3 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.099 -2.205 17915 489 1 3 . 1 1 9 9 VAL H H 9 9.051 9.051 8.182 0.869 17915 490 1 3 . 1 1 10 10 LEU N N 10 123.127 123.127 121.594 1.533 17915 491 1 3 . 1 1 10 10 LEU C C 10 176.729 176.729 175.508 1.221 17915 492 1 3 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.478 0.011 17915 493 1 3 . 1 1 10 10 LEU H H 10 8.864 8.864 8.674 0.190 17915 494 1 3 . 1 1 11 11 ALA N N 11 126.907 126.907 124.290 2.617 17915 495 1 3 . 1 1 11 11 ALA C C 11 178.406 178.406 177.654 0.752 17915 496 1 3 . 1 1 11 11 ALA CA C 11 52.515 52.515 52.035 0.480 17915 497 1 3 . 1 1 11 11 ALA H H 11 8.988 8.988 9.028 -0.040 17915 498 1 3 . 1 1 12 12 LEU N N 12 127.694 127.694 125.912 1.782 17915 499 1 3 . 1 1 12 12 LEU C C 12 175.046 175.046 176.539 -1.493 17915 500 1 3 . 1 1 12 12 LEU CA C 12 55.727 55.727 55.815 -0.087 17915 501 1 3 . 1 1 12 12 LEU H H 12 9.136 9.136 8.155 0.981 17915 502 1 3 . 1 1 13 13 TYR N N 13 111.415 111.415 118.283 -6.868 17915 503 1 3 . 1 1 13 13 TYR C C 13 173.844 173.844 174.091 -0.247 17915 504 1 3 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.841 -2.185 17915 505 1 3 . 1 1 13 13 TYR H H 13 6.979 6.979 7.664 -0.685 17915 506 1 3 . 1 1 14 14 ASP N N 14 117.591 117.591 124.509 -6.918 17915 507 1 3 . 1 1 14 14 ASP C C 14 176.140 176.140 174.176 1.964 17915 508 1 3 . 1 1 14 14 ASP CA C 14 54.522 54.522 54.888 -0.366 17915 509 1 3 . 1 1 14 14 ASP H H 14 8.260 8.260 8.095 0.165 17915 510 1 3 . 1 1 15 15 TYR N N 15 119.917 119.917 123.543 -3.626 17915 511 1 3 . 1 1 15 15 TYR C C 15 172.859 172.859 174.144 -1.285 17915 512 1 3 . 1 1 15 15 TYR CA C 15 59.661 59.661 57.226 2.435 17915 513 1 3 . 1 1 15 15 TYR H H 15 8.580 8.580 8.599 -0.019 17915 514 1 3 . 1 1 16 16 GLN N N 16 127.024 127.024 121.459 5.565 17915 515 1 3 . 1 1 16 16 GLN C C 16 176.377 176.377 174.219 2.158 17915 516 1 3 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.890 -1.224 17915 517 1 3 . 1 1 16 16 GLN H H 16 7.450 7.450 8.219 -0.769 17915 518 1 3 . 1 1 17 17 GLU N N 17 122.837 122.837 120.771 2.066 17915 519 1 3 . 1 1 17 17 GLU C C 17 176.140 176.140 175.842 0.298 17915 520 1 3 . 1 1 17 17 GLU CA C 17 56.075 56.075 57.147 -1.072 17915 521 1 3 . 1 1 17 17 GLU H H 17 7.899 7.899 8.773 -0.874 17915 522 1 3 . 1 1 18 18 LYS N N 18 120.622 120.622 119.033 1.589 17915 523 1 3 . 1 1 18 18 LYS C C 18 176.267 176.267 174.951 1.316 17915 524 1 3 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.953 -1.708 17915 525 1 3 . 1 1 18 18 LYS H H 18 8.649 8.649 8.286 0.363 17915 526 1 3 . 1 1 19 19 SER N N 19 115.184 115.184 112.590 2.594 17915 527 1 3 . 1 1 19 19 SER CA C 19 56.824 56.824 55.095 1.729 17915 528 1 3 . 1 1 19 19 SER H H 19 7.552 7.552 7.655 -0.103 17915 529 1 3 . 1 1 21 21 ARG N N 21 113.440 113.440 117.551 -4.111 17915 530 1 3 . 1 1 21 21 ARG C C 21 176.638 176.638 177.036 -0.398 17915 531 1 3 . 1 1 21 21 ARG CA C 21 56.208 56.208 57.615 -1.407 17915 532 1 3 . 1 1 21 21 ARG H H 21 7.596 7.596 8.276 -0.680 17915 533 1 3 . 1 1 22 22 GLU N N 22 121.392 121.392 115.444 5.948 17915 534 1 3 . 1 1 22 22 GLU C C 22 174.500 174.500 173.840 0.660 17915 535 1 3 . 1 1 22 22 GLU CA C 22 55.352 55.352 54.477 0.875 17915 536 1 3 . 1 1 22 22 GLU H H 22 7.746 7.746 7.887 -0.141 17915 537 1 3 . 1 1 23 23 VAL N N 23 114.115 114.115 117.526 -3.411 17915 538 1 3 . 1 1 23 23 VAL C C 23 172.337 172.337 174.816 -2.479 17915 539 1 3 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.998 -1.123 17915 540 1 3 . 1 1 23 23 VAL H H 23 7.318 7.318 8.134 -0.816 17915 541 1 3 . 1 1 24 24 THR N N 24 118.996 118.996 118.955 0.041 17915 542 1 3 . 1 1 24 24 THR C C 24 174.451 174.451 173.663 0.788 17915 543 1 3 . 1 1 24 24 THR CA C 24 61.641 61.641 61.695 -0.054 17915 544 1 3 . 1 1 24 24 THR H H 24 7.324 7.324 8.287 -0.963 17915 545 1 3 . 1 1 25 25 MET N N 25 121.901 121.901 127.208 -5.307 17915 546 1 3 . 1 1 25 25 MET C C 25 173.931 173.931 173.995 -0.064 17915 547 1 3 . 1 1 25 25 MET CA C 25 54.389 54.389 53.731 0.658 17915 548 1 3 . 1 1 25 25 MET H H 25 9.432 9.432 8.464 0.968 17915 549 1 3 . 1 1 26 26 LYS N N 26 124.169 124.169 121.994 2.175 17915 550 1 3 . 1 1 26 26 LYS C C 26 175.002 175.002 175.802 -0.800 17915 551 1 3 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.737 -1.071 17915 552 1 3 . 1 1 26 26 LYS H H 26 8.634 8.634 8.628 0.006 17915 553 1 3 . 1 1 27 27 LYS N N 27 122.603 122.603 124.653 -2.050 17915 554 1 3 . 1 1 27 27 LYS C C 27 177.318 177.318 177.134 0.184 17915 555 1 3 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.723 0.921 17915 556 1 3 . 1 1 27 27 LYS H H 27 8.919 8.919 8.982 -0.063 17915 557 1 3 . 1 1 28 28 GLY N N 28 115.585 115.585 112.332 3.253 17915 558 1 3 . 1 1 28 28 GLY C C 28 174.193 174.193 174.509 -0.316 17915 559 1 3 . 1 1 28 28 GLY CA C 28 44.888 44.888 45.091 -0.203 17915 560 1 3 . 1 1 28 28 GLY H H 28 8.732 8.732 8.901 -0.169 17915 561 1 3 . 1 1 29 29 ASP N N 29 121.770 121.770 122.288 -0.518 17915 562 1 3 . 1 1 29 29 ASP C C 29 174.281 174.281 175.298 -1.017 17915 563 1 3 . 1 1 29 29 ASP CA C 29 55.486 55.486 53.989 1.497 17915 564 1 3 . 1 1 29 29 ASP H H 29 8.388 8.388 7.853 0.535 17915 565 1 3 . 1 1 30 30 ILE N N 30 120.469 120.469 120.355 0.114 17915 566 1 3 . 1 1 30 30 ILE C C 30 176.356 176.356 175.535 0.821 17915 567 1 3 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.417 -0.168 17915 568 1 3 . 1 1 30 30 ILE H H 30 8.033 8.033 8.194 -0.161 17915 569 1 3 . 1 1 31 31 LEU N N 31 127.129 127.129 129.039 -1.910 17915 570 1 3 . 1 1 31 31 LEU C C 31 175.745 175.745 176.259 -0.514 17915 571 1 3 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.899 0.008 17915 572 1 3 . 1 1 31 31 LEU H H 31 9.223 9.223 8.906 0.317 17915 573 1 3 . 1 1 32 32 THR N N 32 117.055 117.055 116.382 0.673 17915 574 1 3 . 1 1 32 32 THR C C 32 173.844 173.844 173.391 0.453 17915 575 1 3 . 1 1 32 32 THR CA C 32 63.247 63.247 61.800 1.447 17915 576 1 3 . 1 1 32 32 THR H H 32 8.360 8.360 8.324 0.036 17915 577 1 3 . 1 1 33 33 LEU N N 33 128.815 128.815 124.992 3.823 17915 578 1 3 . 1 1 33 33 LEU C C 33 174.718 174.718 176.071 -1.353 17915 579 1 3 . 1 1 33 33 LEU CA C 33 54.870 54.870 53.851 1.019 17915 580 1 3 . 1 1 33 33 LEU H H 33 8.937 8.937 8.513 0.424 17915 581 1 3 . 1 1 34 34 LEU N N 34 126.230 126.230 124.260 1.970 17915 582 1 3 . 1 1 34 34 LEU C C 34 177.689 177.689 176.288 1.401 17915 583 1 3 . 1 1 34 34 LEU CA C 34 55.218 55.218 54.815 0.403 17915 584 1 3 . 1 1 34 34 LEU H H 34 8.929 8.929 8.639 0.290 17915 585 1 3 . 1 1 35 35 ASN N N 35 113.879 113.879 117.482 -3.603 17915 586 1 3 . 1 1 35 35 ASN C C 35 174.565 174.565 173.679 0.886 17915 587 1 3 . 1 1 35 35 ASN CA C 35 54.576 54.576 52.703 1.873 17915 588 1 3 . 1 1 35 35 ASN H H 35 7.489 7.489 8.196 -0.707 17915 589 1 3 . 1 1 36 36 SER N N 36 123.684 123.684 118.186 5.498 17915 590 1 3 . 1 1 36 36 SER C C 36 173.503 173.503 174.148 -0.645 17915 591 1 3 . 1 1 36 36 SER CA C 36 56.904 56.904 57.797 -0.893 17915 592 1 3 . 1 1 36 36 SER H H 36 9.086 9.086 8.453 0.633 17915 593 1 3 . 1 1 37 37 THR N N 37 115.012 115.012 114.182 0.830 17915 594 1 3 . 1 1 37 37 THR C C 37 175.417 175.417 174.011 1.406 17915 595 1 3 . 1 1 37 37 THR CA C 37 65.521 65.521 61.986 3.535 17915 596 1 3 . 1 1 37 37 THR H H 37 8.071 8.071 8.573 -0.502 17915 597 1 3 . 1 1 38 38 ASN N N 38 122.517 122.517 119.244 3.273 17915 598 1 3 . 1 1 38 38 ASN C C 38 174.696 174.696 174.333 0.363 17915 599 1 3 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.395 0.084 17915 600 1 3 . 1 1 38 38 ASN H H 38 8.595 8.595 7.663 0.932 17915 601 1 3 . 1 1 39 39 LYS N N 39 120.851 120.851 121.350 -0.499 17915 602 1 3 . 1 1 39 39 LYS C C 39 176.444 176.444 176.750 -0.306 17915 603 1 3 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.343 0.060 17915 604 1 3 . 1 1 39 39 LYS H H 39 8.416 8.416 8.584 -0.168 17915 605 1 3 . 1 1 40 40 ASP N N 40 114.427 114.427 117.181 -2.754 17915 606 1 3 . 1 1 40 40 ASP C C 40 176.960 176.960 175.665 1.295 17915 607 1 3 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.562 -0.210 17915 608 1 3 . 1 1 40 40 ASP H H 40 8.085 8.085 8.451 -0.366 17915 609 1 3 . 1 1 41 41 TRP N N 41 122.708 122.708 120.954 1.754 17915 610 1 3 . 1 1 41 41 TRP C C 41 174.303 174.303 175.706 -1.403 17915 611 1 3 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.817 -0.609 17915 612 1 3 . 1 1 41 41 TRP H H 41 8.096 8.096 7.845 0.251 17915 613 1 3 . 1 1 42 42 TRP N N 42 124.707 124.707 127.158 -2.451 17915 614 1 3 . 1 1 42 42 TRP C C 42 174.303 174.303 174.854 -0.551 17915 615 1 3 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.077 -2.090 17915 616 1 3 . 1 1 42 42 TRP H H 42 9.245 9.245 8.301 0.944 17915 617 1 3 . 1 1 43 43 LYS N N 43 124.005 124.005 122.823 1.182 17915 618 1 3 . 1 1 43 43 LYS C C 43 175.482 175.482 174.391 1.091 17915 619 1 3 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.157 0.222 17915 620 1 3 . 1 1 43 43 LYS H H 43 8.783 8.783 8.156 0.627 17915 621 1 3 . 1 1 44 44 VAL N N 44 122.139 122.139 124.817 -2.678 17915 622 1 3 . 1 1 44 44 VAL C C 44 173.472 173.472 173.541 -0.069 17915 623 1 3 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.947 -0.875 17915 624 1 3 . 1 1 44 44 VAL H H 44 9.287 9.287 8.484 0.803 17915 625 1 3 . 1 1 45 45 GLU N N 45 118.524 118.524 126.485 -7.961 17915 626 1 3 . 1 1 45 45 GLU C C 45 174.827 174.827 175.547 -0.720 17915 627 1 3 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.775 -0.601 17915 628 1 3 . 1 1 45 45 GLU H H 45 8.566 8.566 8.216 0.350 17915 629 1 3 . 1 1 46 46 VAL N N 46 124.904 124.904 126.855 -1.951 17915 630 1 3 . 1 1 46 46 VAL C C 46 174.608 174.608 175.384 -0.776 17915 631 1 3 . 1 1 46 46 VAL CA C 46 60.651 60.651 60.402 0.249 17915 632 1 3 . 1 1 46 46 VAL H H 46 8.774 8.774 8.448 0.326 17915 633 1 3 . 1 1 47 47 ASN N N 47 126.530 126.530 125.442 1.088 17915 634 1 3 . 1 1 47 47 ASN C C 47 174.259 174.259 175.062 -0.803 17915 635 1 3 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.845 -0.600 17915 636 1 3 . 1 1 47 47 ASN H H 47 9.356 9.356 9.010 0.346 17915 637 1 3 . 1 1 48 48 ASP N N 48 112.420 112.420 121.145 -8.725 17915 638 1 3 . 1 1 48 48 ASP C C 48 174.521 174.521 174.908 -0.387 17915 639 1 3 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.479 0.204 17915 640 1 3 . 1 1 48 48 ASP H H 48 8.628 8.628 8.293 0.335 17915 641 1 3 . 1 1 49 49 ARG N N 49 120.379 120.379 119.821 0.558 17915 642 1 3 . 1 1 49 49 ARG C C 49 174.477 174.477 174.032 0.445 17915 643 1 3 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.131 0.167 17915 644 1 3 . 1 1 49 49 ARG H H 49 8.069 8.069 7.589 0.480 17915 645 1 3 . 1 1 50 50 GLN N N 50 118.647 118.647 119.123 -0.476 17915 646 1 3 . 1 1 50 50 GLN C C 50 175.963 175.963 174.236 1.727 17915 647 1 3 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.517 -1.092 17915 648 1 3 . 1 1 50 50 GLN H H 50 8.432 8.432 8.331 0.101 17915 649 1 3 . 1 1 51 51 GLY N N 51 107.028 107.028 108.617 -1.589 17915 650 1 3 . 1 1 51 51 GLY C C 51 170.479 170.479 171.854 -1.375 17915 651 1 3 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.263 0.375 17915 652 1 3 . 1 1 51 51 GLY H H 51 8.534 8.534 7.968 0.566 17915 653 1 3 . 1 1 52 52 PHE N N 52 119.030 119.030 119.359 -0.329 17915 654 1 3 . 1 1 52 52 PHE C C 52 175.635 175.635 174.867 0.768 17915 655 1 3 . 1 1 52 52 PHE CA C 52 58.724 58.724 55.928 2.796 17915 656 1 3 . 1 1 52 52 PHE H H 52 9.098 9.098 8.223 0.875 17915 657 1 3 . 1 1 53 53 VAL N N 53 110.897 110.897 117.623 -6.726 17915 658 1 3 . 1 1 53 53 VAL CA C 53 58.108 58.108 57.078 1.030 17915 659 1 3 . 1 1 53 53 VAL H H 53 8.942 8.942 8.333 0.609 17915 660 1 3 . 1 1 55 55 ALA N N 55 129.055 129.055 128.330 0.725 17915 661 1 3 . 1 1 55 55 ALA C C 55 178.565 178.565 178.406 0.159 17915 662 1 3 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.513 0.116 17915 663 1 3 . 1 1 55 55 ALA H H 55 7.355 7.355 7.976 -0.621 17915 664 1 3 . 1 1 56 56 ALA N N 56 113.282 113.282 118.565 -5.283 17915 665 1 3 . 1 1 56 56 ALA C C 56 178.214 178.214 178.116 0.098 17915 666 1 3 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.909 -0.966 17915 667 1 3 . 1 1 56 56 ALA H H 56 7.750 7.750 8.112 -0.362 17915 668 1 3 . 1 1 57 57 TYR N N 57 116.083 116.083 117.089 -1.006 17915 669 1 3 . 1 1 57 57 TYR C C 57 174.565 174.565 174.114 0.451 17915 670 1 3 . 1 1 57 57 TYR CA C 57 56.422 56.422 56.764 -0.342 17915 671 1 3 . 1 1 57 57 TYR H H 57 7.611 7.611 7.878 -0.267 17915 672 1 3 . 1 1 58 58 VAL N N 58 110.965 110.965 112.852 -1.887 17915 673 1 3 . 1 1 58 58 VAL C C 58 173.647 173.647 174.365 -0.718 17915 674 1 3 . 1 1 58 58 VAL CA C 58 58.242 58.242 58.768 -0.526 17915 675 1 3 . 1 1 58 58 VAL H H 58 7.301 7.301 7.249 0.052 17915 676 1 3 . 1 1 59 59 LYS N N 59 118.586 118.586 120.460 -1.874 17915 677 1 3 . 1 1 59 59 LYS C C 59 176.160 176.160 175.022 1.138 17915 678 1 3 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.989 -0.948 17915 679 1 3 . 1 1 59 59 LYS H H 59 8.515 8.515 8.024 0.491 17915 680 1 3 . 1 1 60 60 LYS N N 60 125.734 125.734 121.800 3.934 17915 681 1 3 . 1 1 60 60 LYS C C 60 176.793 176.793 176.258 0.535 17915 682 1 3 . 1 1 60 60 LYS CA C 60 58.617 58.617 56.983 1.634 17915 683 1 3 . 1 1 60 60 LYS H H 60 9.135 9.135 8.587 0.548 17915 684 1 3 . 1 1 61 61 LEU N N 61 125.061 125.061 122.901 2.160 17915 685 1 3 . 1 1 61 61 LEU C C 61 174.106 174.106 175.848 -1.742 17915 686 1 3 . 1 1 61 61 LEU CA C 61 54.977 54.977 53.913 1.064 17915 687 1 3 . 1 1 61 61 LEU H H 61 8.384 8.384 8.703 -0.319 17915 688 1 4 . 1 1 2 2 ASP N N 2 123.220 123.220 125.755 -2.535 17915 689 1 4 . 1 1 2 2 ASP C C 2 175.703 175.703 177.067 -1.364 17915 690 1 4 . 1 1 2 2 ASP CA C 2 54.041 54.041 56.305 -2.264 17915 691 1 4 . 1 1 2 2 ASP H H 2 8.738 8.738 8.432 0.306 17915 692 1 4 . 1 1 3 3 GLU N N 3 121.895 121.895 118.406 3.489 17915 693 1 4 . 1 1 3 3 GLU C C 3 176.480 176.480 174.811 1.669 17915 694 1 4 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.907 -0.779 17915 695 1 4 . 1 1 3 3 GLU H H 3 8.570 8.570 8.275 0.295 17915 696 1 4 . 1 1 4 4 THR N N 4 114.607 114.607 112.986 1.621 17915 697 1 4 . 1 1 4 4 THR C C 4 175.417 175.417 174.153 1.264 17915 698 1 4 . 1 1 4 4 THR CA C 4 62.685 62.685 62.916 -0.231 17915 699 1 4 . 1 1 4 4 THR H H 4 8.176 8.176 8.129 0.047 17915 700 1 4 . 1 1 5 5 GLY N N 5 111.430 111.430 111.498 -0.068 17915 701 1 4 . 1 1 5 5 GLY C C 5 173.777 173.777 173.290 0.487 17915 702 1 4 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.992 -0.432 17915 703 1 4 . 1 1 5 5 GLY H H 5 8.344 8.344 8.306 0.038 17915 704 1 4 . 1 1 6 6 LYS N N 6 119.850 119.850 122.064 -2.214 17915 705 1 4 . 1 1 6 6 LYS C C 6 176.049 176.049 176.103 -0.054 17915 706 1 4 . 1 1 6 6 LYS CA C 6 55.914 55.914 54.784 1.130 17915 707 1 4 . 1 1 6 6 LYS H H 6 7.903 7.903 7.926 -0.023 17915 708 1 4 . 1 1 7 7 GLU N N 7 123.025 123.025 126.501 -3.476 17915 709 1 4 . 1 1 7 7 GLU C C 7 174.172 174.172 175.631 -1.459 17915 710 1 4 . 1 1 7 7 GLU CA C 7 55.459 55.459 56.422 -0.963 17915 711 1 4 . 1 1 7 7 GLU H H 7 8.562 8.562 8.888 -0.326 17915 712 1 4 . 1 1 8 8 LEU N N 8 123.147 123.147 120.863 2.284 17915 713 1 4 . 1 1 8 8 LEU C C 8 177.495 177.495 174.964 2.531 17915 714 1 4 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.995 -0.570 17915 715 1 4 . 1 1 8 8 LEU H H 8 8.292 8.292 8.075 0.217 17915 716 1 4 . 1 1 9 9 VAL N N 9 111.799 111.799 114.402 -2.603 17915 717 1 4 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.703 -1.809 17915 718 1 4 . 1 1 9 9 VAL H H 9 9.051 9.051 8.181 0.870 17915 719 1 4 . 1 1 10 10 LEU N N 10 123.127 123.127 125.595 -2.468 17915 720 1 4 . 1 1 10 10 LEU C C 10 176.729 176.729 174.961 1.768 17915 721 1 4 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.661 -0.172 17915 722 1 4 . 1 1 10 10 LEU H H 10 8.864 8.864 8.034 0.830 17915 723 1 4 . 1 1 11 11 ALA N N 11 126.907 126.907 125.610 1.297 17915 724 1 4 . 1 1 11 11 ALA C C 11 178.406 178.406 175.967 2.439 17915 725 1 4 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.237 1.278 17915 726 1 4 . 1 1 11 11 ALA H H 11 8.988 8.988 8.473 0.515 17915 727 1 4 . 1 1 12 12 LEU N N 12 127.694 127.694 126.655 1.039 17915 728 1 4 . 1 1 12 12 LEU C C 12 175.046 175.046 176.486 -1.440 17915 729 1 4 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.354 -0.627 17915 730 1 4 . 1 1 12 12 LEU H H 12 9.136 9.136 8.829 0.307 17915 731 1 4 . 1 1 13 13 TYR N N 13 111.415 111.415 116.086 -4.671 17915 732 1 4 . 1 1 13 13 TYR C C 13 173.844 173.844 175.347 -1.503 17915 733 1 4 . 1 1 13 13 TYR CA C 13 54.656 54.656 58.358 -3.702 17915 734 1 4 . 1 1 13 13 TYR H H 13 6.979 6.979 7.771 -0.792 17915 735 1 4 . 1 1 14 14 ASP N N 14 117.591 117.591 121.344 -3.753 17915 736 1 4 . 1 1 14 14 ASP C C 14 176.140 176.140 176.668 -0.528 17915 737 1 4 . 1 1 14 14 ASP CA C 14 54.522 54.522 56.838 -2.316 17915 738 1 4 . 1 1 14 14 ASP H H 14 8.260 8.260 8.326 -0.066 17915 739 1 4 . 1 1 15 15 TYR N N 15 119.917 119.917 115.526 4.391 17915 740 1 4 . 1 1 15 15 TYR C C 15 172.859 172.859 175.482 -2.623 17915 741 1 4 . 1 1 15 15 TYR CA C 15 59.661 59.661 59.339 0.322 17915 742 1 4 . 1 1 15 15 TYR H H 15 8.580 8.580 7.918 0.662 17915 743 1 4 . 1 1 16 16 GLN N N 16 127.024 127.024 121.091 5.933 17915 744 1 4 . 1 1 16 16 GLN C C 16 176.377 176.377 174.875 1.502 17915 745 1 4 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.760 -2.094 17915 746 1 4 . 1 1 16 16 GLN H H 16 7.450 7.450 8.082 -0.632 17915 747 1 4 . 1 1 17 17 GLU N N 17 122.837 122.837 120.756 2.081 17915 748 1 4 . 1 1 17 17 GLU C C 17 176.140 176.140 175.292 0.848 17915 749 1 4 . 1 1 17 17 GLU CA C 17 56.075 56.075 57.766 -1.691 17915 750 1 4 . 1 1 17 17 GLU H H 17 7.899 7.899 8.648 -0.749 17915 751 1 4 . 1 1 18 18 LYS N N 18 120.622 120.622 121.972 -1.350 17915 752 1 4 . 1 1 18 18 LYS C C 18 176.267 176.267 174.370 1.897 17915 753 1 4 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.393 -1.148 17915 754 1 4 . 1 1 18 18 LYS H H 18 8.649 8.649 8.434 0.215 17915 755 1 4 . 1 1 19 19 SER N N 19 115.184 115.184 114.012 1.172 17915 756 1 4 . 1 1 19 19 SER CA C 19 56.824 56.824 57.786 -0.962 17915 757 1 4 . 1 1 19 19 SER H H 19 7.552 7.552 8.138 -0.586 17915 758 1 4 . 1 1 21 21 ARG N N 21 113.440 113.440 117.452 -4.012 17915 759 1 4 . 1 1 21 21 ARG C C 21 176.638 176.638 175.488 1.150 17915 760 1 4 . 1 1 21 21 ARG CA C 21 56.208 56.208 55.083 1.125 17915 761 1 4 . 1 1 21 21 ARG H H 21 7.596 7.596 7.993 -0.397 17915 762 1 4 . 1 1 22 22 GLU N N 22 121.392 121.392 119.297 2.095 17915 763 1 4 . 1 1 22 22 GLU C C 22 174.500 174.500 174.238 0.262 17915 764 1 4 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.982 -1.630 17915 765 1 4 . 1 1 22 22 GLU H H 22 7.746 7.746 7.804 -0.058 17915 766 1 4 . 1 1 23 23 VAL N N 23 114.115 114.115 120.952 -6.837 17915 767 1 4 . 1 1 23 23 VAL C C 23 172.337 172.337 174.123 -1.786 17915 768 1 4 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.693 -0.818 17915 769 1 4 . 1 1 23 23 VAL H H 23 7.318 7.318 7.826 -0.508 17915 770 1 4 . 1 1 24 24 THR N N 24 118.996 118.996 122.541 -3.545 17915 771 1 4 . 1 1 24 24 THR C C 24 174.451 174.451 173.127 1.324 17915 772 1 4 . 1 1 24 24 THR CA C 24 61.641 61.641 60.945 0.696 17915 773 1 4 . 1 1 24 24 THR H H 24 7.324 7.324 8.362 -1.038 17915 774 1 4 . 1 1 25 25 MET N N 25 121.901 121.901 125.286 -3.385 17915 775 1 4 . 1 1 25 25 MET C C 25 173.931 173.931 173.717 0.214 17915 776 1 4 . 1 1 25 25 MET CA C 25 54.389 54.389 54.157 0.232 17915 777 1 4 . 1 1 25 25 MET H H 25 9.432 9.432 8.500 0.932 17915 778 1 4 . 1 1 26 26 LYS N N 26 124.169 124.169 122.328 1.841 17915 779 1 4 . 1 1 26 26 LYS C C 26 175.002 175.002 176.056 -1.054 17915 780 1 4 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.095 -1.429 17915 781 1 4 . 1 1 26 26 LYS H H 26 8.634 8.634 8.670 -0.036 17915 782 1 4 . 1 1 27 27 LYS N N 27 122.603 122.603 124.669 -2.066 17915 783 1 4 . 1 1 27 27 LYS C C 27 177.318 177.318 177.559 -0.241 17915 784 1 4 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.346 1.298 17915 785 1 4 . 1 1 27 27 LYS H H 27 8.919 8.919 8.758 0.161 17915 786 1 4 . 1 1 28 28 GLY N N 28 115.585 115.585 112.937 2.648 17915 787 1 4 . 1 1 28 28 GLY C C 28 174.193 174.193 174.548 -0.355 17915 788 1 4 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.920 -0.032 17915 789 1 4 . 1 1 28 28 GLY H H 28 8.732 8.732 8.964 -0.232 17915 790 1 4 . 1 1 29 29 ASP N N 29 121.770 121.770 122.398 -0.628 17915 791 1 4 . 1 1 29 29 ASP C C 29 174.281 174.281 175.478 -1.197 17915 792 1 4 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.625 0.861 17915 793 1 4 . 1 1 29 29 ASP H H 29 8.388 8.388 7.914 0.474 17915 794 1 4 . 1 1 30 30 ILE N N 30 120.469 120.469 120.629 -0.160 17915 795 1 4 . 1 1 30 30 ILE C C 30 176.356 176.356 175.227 1.129 17915 796 1 4 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.507 -0.258 17915 797 1 4 . 1 1 30 30 ILE H H 30 8.033 8.033 8.051 -0.018 17915 798 1 4 . 1 1 31 31 LEU N N 31 127.129 127.129 128.127 -0.998 17915 799 1 4 . 1 1 31 31 LEU C C 31 175.745 175.745 175.717 0.028 17915 800 1 4 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.718 0.189 17915 801 1 4 . 1 1 31 31 LEU H H 31 9.223 9.223 9.007 0.216 17915 802 1 4 . 1 1 32 32 THR N N 32 117.055 117.055 118.192 -1.137 17915 803 1 4 . 1 1 32 32 THR C C 32 173.844 173.844 173.774 0.070 17915 804 1 4 . 1 1 32 32 THR CA C 32 63.247 63.247 60.752 2.495 17915 805 1 4 . 1 1 32 32 THR H H 32 8.360 8.360 8.446 -0.086 17915 806 1 4 . 1 1 33 33 LEU N N 33 128.815 128.815 123.753 5.062 17915 807 1 4 . 1 1 33 33 LEU C C 33 174.718 174.718 175.786 -1.068 17915 808 1 4 . 1 1 33 33 LEU CA C 33 54.870 54.870 55.108 -0.238 17915 809 1 4 . 1 1 33 33 LEU H H 33 8.937 8.937 8.673 0.264 17915 810 1 4 . 1 1 34 34 LEU N N 34 126.230 126.230 122.638 3.592 17915 811 1 4 . 1 1 34 34 LEU C C 34 177.689 177.689 176.830 0.859 17915 812 1 4 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.154 0.064 17915 813 1 4 . 1 1 34 34 LEU H H 34 8.929 8.929 8.663 0.266 17915 814 1 4 . 1 1 35 35 ASN N N 35 113.879 113.879 117.380 -3.501 17915 815 1 4 . 1 1 35 35 ASN C C 35 174.565 174.565 173.089 1.476 17915 816 1 4 . 1 1 35 35 ASN CA C 35 54.576 54.576 52.507 2.069 17915 817 1 4 . 1 1 35 35 ASN H H 35 7.489 7.489 7.732 -0.243 17915 818 1 4 . 1 1 36 36 SER N N 36 123.684 123.684 114.643 9.041 17915 819 1 4 . 1 1 36 36 SER C C 36 173.503 173.503 173.537 -0.034 17915 820 1 4 . 1 1 36 36 SER CA C 36 56.904 56.904 58.218 -1.314 17915 821 1 4 . 1 1 36 36 SER H H 36 9.086 9.086 8.397 0.689 17915 822 1 4 . 1 1 37 37 THR N N 37 115.012 115.012 118.339 -3.327 17915 823 1 4 . 1 1 37 37 THR C C 37 175.417 175.417 174.993 0.424 17915 824 1 4 . 1 1 37 37 THR CA C 37 65.521 65.521 62.924 2.597 17915 825 1 4 . 1 1 37 37 THR H H 37 8.071 8.071 8.238 -0.167 17915 826 1 4 . 1 1 38 38 ASN N N 38 122.517 122.517 120.951 1.566 17915 827 1 4 . 1 1 38 38 ASN C C 38 174.696 174.696 175.326 -0.630 17915 828 1 4 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.165 0.314 17915 829 1 4 . 1 1 38 38 ASN H H 38 8.595 8.595 8.302 0.293 17915 830 1 4 . 1 1 39 39 LYS N N 39 120.851 120.851 121.866 -1.015 17915 831 1 4 . 1 1 39 39 LYS C C 39 176.444 176.444 177.869 -1.425 17915 832 1 4 . 1 1 39 39 LYS CA C 39 58.403 58.403 59.135 -0.732 17915 833 1 4 . 1 1 39 39 LYS H H 39 8.416 8.416 8.589 -0.173 17915 834 1 4 . 1 1 40 40 ASP N N 40 114.427 114.427 117.825 -3.398 17915 835 1 4 . 1 1 40 40 ASP C C 40 176.960 176.960 176.682 0.278 17915 836 1 4 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.794 -0.442 17915 837 1 4 . 1 1 40 40 ASP H H 40 8.085 8.085 8.356 -0.271 17915 838 1 4 . 1 1 41 41 TRP N N 41 122.708 122.708 120.707 2.001 17915 839 1 4 . 1 1 41 41 TRP C C 41 174.303 174.303 174.756 -0.453 17915 840 1 4 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.456 -0.248 17915 841 1 4 . 1 1 41 41 TRP H H 41 8.096 8.096 7.761 0.335 17915 842 1 4 . 1 1 42 42 TRP N N 42 124.707 124.707 124.499 0.208 17915 843 1 4 . 1 1 42 42 TRP C C 42 174.303 174.303 175.000 -0.697 17915 844 1 4 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.271 -2.284 17915 845 1 4 . 1 1 42 42 TRP H H 42 9.245 9.245 8.182 1.063 17915 846 1 4 . 1 1 43 43 LYS N N 43 124.005 124.005 120.809 3.196 17915 847 1 4 . 1 1 43 43 LYS C C 43 175.482 175.482 174.654 0.828 17915 848 1 4 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.626 -0.247 17915 849 1 4 . 1 1 43 43 LYS H H 43 8.783 8.783 8.118 0.665 17915 850 1 4 . 1 1 44 44 VAL N N 44 122.139 122.139 120.456 1.683 17915 851 1 4 . 1 1 44 44 VAL C C 44 173.472 173.472 173.855 -0.383 17915 852 1 4 . 1 1 44 44 VAL CA C 44 59.072 59.072 60.002 -0.930 17915 853 1 4 . 1 1 44 44 VAL H H 44 9.287 9.287 7.895 1.392 17915 854 1 4 . 1 1 45 45 GLU N N 45 118.524 118.524 123.916 -5.392 17915 855 1 4 . 1 1 45 45 GLU C C 45 174.827 174.827 175.225 -0.398 17915 856 1 4 . 1 1 45 45 GLU CA C 45 54.174 54.174 55.845 -1.671 17915 857 1 4 . 1 1 45 45 GLU H H 45 8.566 8.566 7.941 0.625 17915 858 1 4 . 1 1 46 46 VAL N N 46 124.904 124.904 122.658 2.246 17915 859 1 4 . 1 1 46 46 VAL C C 46 174.608 174.608 175.834 -1.226 17915 860 1 4 . 1 1 46 46 VAL CA C 46 60.651 60.651 60.863 -0.212 17915 861 1 4 . 1 1 46 46 VAL H H 46 8.774 8.774 8.278 0.496 17915 862 1 4 . 1 1 47 47 ASN N N 47 126.530 126.530 126.923 -0.393 17915 863 1 4 . 1 1 47 47 ASN C C 47 174.259 174.259 174.507 -0.248 17915 864 1 4 . 1 1 47 47 ASN CA C 47 55.245 55.245 53.580 1.665 17915 865 1 4 . 1 1 47 47 ASN H H 47 9.356 9.356 8.837 0.519 17915 866 1 4 . 1 1 48 48 ASP N N 48 112.420 112.420 116.766 -4.346 17915 867 1 4 . 1 1 48 48 ASP C C 48 174.521 174.521 174.814 -0.293 17915 868 1 4 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.901 -0.218 17915 869 1 4 . 1 1 48 48 ASP H H 48 8.628 8.628 8.289 0.339 17915 870 1 4 . 1 1 49 49 ARG N N 49 120.379 120.379 118.682 1.697 17915 871 1 4 . 1 1 49 49 ARG C C 49 174.477 174.477 174.148 0.329 17915 872 1 4 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.548 -0.250 17915 873 1 4 . 1 1 49 49 ARG H H 49 8.069 8.069 7.795 0.274 17915 874 1 4 . 1 1 50 50 GLN N N 50 118.647 118.647 120.186 -1.539 17915 875 1 4 . 1 1 50 50 GLN C C 50 175.963 175.963 173.836 2.127 17915 876 1 4 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.286 -0.862 17915 877 1 4 . 1 1 50 50 GLN H H 50 8.432 8.432 8.443 -0.011 17915 878 1 4 . 1 1 51 51 GLY N N 51 107.028 107.028 108.243 -1.215 17915 879 1 4 . 1 1 51 51 GLY C C 51 170.479 170.479 171.633 -1.154 17915 880 1 4 . 1 1 51 51 GLY CA C 51 45.638 45.638 46.009 -0.371 17915 881 1 4 . 1 1 51 51 GLY H H 51 8.534 8.534 8.203 0.331 17915 882 1 4 . 1 1 52 52 PHE N N 52 119.030 119.030 122.033 -3.003 17915 883 1 4 . 1 1 52 52 PHE C C 52 175.635 175.635 174.388 1.247 17915 884 1 4 . 1 1 52 52 PHE CA C 52 58.724 58.724 56.148 2.576 17915 885 1 4 . 1 1 52 52 PHE H H 52 9.098 9.098 8.559 0.539 17915 886 1 4 . 1 1 53 53 VAL N N 53 110.897 110.897 118.884 -7.987 17915 887 1 4 . 1 1 53 53 VAL CA C 53 58.108 58.108 57.427 0.681 17915 888 1 4 . 1 1 53 53 VAL H H 53 8.942 8.942 8.183 0.759 17915 889 1 4 . 1 1 55 55 ALA N N 55 129.055 129.055 124.123 4.932 17915 890 1 4 . 1 1 55 55 ALA C C 55 178.565 178.565 178.072 0.493 17915 891 1 4 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.442 0.187 17915 892 1 4 . 1 1 55 55 ALA H H 55 7.355 7.355 8.795 -1.440 17915 893 1 4 . 1 1 56 56 ALA N N 56 113.282 113.282 117.711 -4.429 17915 894 1 4 . 1 1 56 56 ALA C C 56 178.214 178.214 178.493 -0.279 17915 895 1 4 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.893 -0.950 17915 896 1 4 . 1 1 56 56 ALA H H 56 7.750 7.750 8.132 -0.382 17915 897 1 4 . 1 1 57 57 TYR N N 57 116.083 116.083 116.487 -0.404 17915 898 1 4 . 1 1 57 57 TYR C C 57 174.565 174.565 174.986 -0.421 17915 899 1 4 . 1 1 57 57 TYR CA C 57 56.422 56.422 58.596 -2.174 17915 900 1 4 . 1 1 57 57 TYR H H 57 7.611 7.611 7.881 -0.270 17915 901 1 4 . 1 1 58 58 VAL N N 58 110.965 110.965 110.130 0.835 17915 902 1 4 . 1 1 58 58 VAL C C 58 173.647 173.647 175.188 -1.541 17915 903 1 4 . 1 1 58 58 VAL CA C 58 58.242 58.242 57.976 0.266 17915 904 1 4 . 1 1 58 58 VAL H H 58 7.301 7.301 6.941 0.360 17915 905 1 4 . 1 1 59 59 LYS N N 59 118.586 118.586 121.337 -2.751 17915 906 1 4 . 1 1 59 59 LYS C C 59 176.160 176.160 175.998 0.162 17915 907 1 4 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.372 -0.331 17915 908 1 4 . 1 1 59 59 LYS H H 59 8.515 8.515 8.246 0.269 17915 909 1 4 . 1 1 60 60 LYS N N 60 125.734 125.734 124.762 0.972 17915 910 1 4 . 1 1 60 60 LYS C C 60 176.793 176.793 177.936 -1.143 17915 911 1 4 . 1 1 60 60 LYS CA C 60 58.617 58.617 57.908 0.709 17915 912 1 4 . 1 1 60 60 LYS H H 60 9.135 9.135 8.745 0.390 17915 913 1 4 . 1 1 61 61 LEU N N 61 125.061 125.061 122.181 2.880 17915 914 1 4 . 1 1 61 61 LEU C C 61 174.106 174.106 175.744 -1.638 17915 915 1 4 . 1 1 61 61 LEU CA C 61 54.977 54.977 57.792 -2.815 17915 916 1 4 . 1 1 61 61 LEU H H 61 8.384 8.384 8.631 -0.247 17915 917 1 5 . 1 1 2 2 ASP N N 2 123.220 123.220 123.187 0.033 17915 918 1 5 . 1 1 2 2 ASP C C 2 175.703 175.703 174.538 1.165 17915 919 1 5 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.352 -0.311 17915 920 1 5 . 1 1 2 2 ASP H H 2 8.738 8.738 8.431 0.307 17915 921 1 5 . 1 1 3 3 GLU N N 3 121.895 121.895 123.981 -2.086 17915 922 1 5 . 1 1 3 3 GLU C C 3 176.480 176.480 174.556 1.924 17915 923 1 5 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.803 -0.675 17915 924 1 5 . 1 1 3 3 GLU H H 3 8.570 8.570 8.538 0.032 17915 925 1 5 . 1 1 4 4 THR N N 4 114.607 114.607 116.573 -1.966 17915 926 1 5 . 1 1 4 4 THR C C 4 175.417 175.417 173.904 1.513 17915 927 1 5 . 1 1 4 4 THR CA C 4 62.685 62.685 63.310 -0.625 17915 928 1 5 . 1 1 4 4 THR H H 4 8.176 8.176 8.384 -0.208 17915 929 1 5 . 1 1 5 5 GLY N N 5 111.430 111.430 110.757 0.673 17915 930 1 5 . 1 1 5 5 GLY C C 5 173.777 173.777 173.082 0.695 17915 931 1 5 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.972 -0.412 17915 932 1 5 . 1 1 5 5 GLY H H 5 8.344 8.344 8.646 -0.302 17915 933 1 5 . 1 1 6 6 LYS N N 6 119.850 119.850 123.045 -3.195 17915 934 1 5 . 1 1 6 6 LYS C C 6 176.049 176.049 176.190 -0.141 17915 935 1 5 . 1 1 6 6 LYS CA C 6 55.914 55.914 54.831 1.083 17915 936 1 5 . 1 1 6 6 LYS H H 6 7.903 7.903 7.670 0.233 17915 937 1 5 . 1 1 7 7 GLU N N 7 123.025 123.025 126.481 -3.456 17915 938 1 5 . 1 1 7 7 GLU C C 7 174.172 174.172 174.719 -0.547 17915 939 1 5 . 1 1 7 7 GLU CA C 7 55.459 55.459 55.964 -0.505 17915 940 1 5 . 1 1 7 7 GLU H H 7 8.562 8.562 8.907 -0.345 17915 941 1 5 . 1 1 8 8 LEU N N 8 123.147 123.147 121.168 1.979 17915 942 1 5 . 1 1 8 8 LEU C C 8 177.495 177.495 174.926 2.569 17915 943 1 5 . 1 1 8 8 LEU CA C 8 53.425 53.425 54.453 -1.028 17915 944 1 5 . 1 1 8 8 LEU H H 8 8.292 8.292 8.214 0.078 17915 945 1 5 . 1 1 9 9 VAL N N 9 111.799 111.799 114.921 -3.122 17915 946 1 5 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.287 -2.393 17915 947 1 5 . 1 1 9 9 VAL H H 9 9.051 9.051 8.773 0.278 17915 948 1 5 . 1 1 10 10 LEU N N 10 123.127 123.127 125.911 -2.784 17915 949 1 5 . 1 1 10 10 LEU C C 10 176.729 176.729 175.504 1.225 17915 950 1 5 . 1 1 10 10 LEU CA C 10 52.489 52.489 53.328 -0.839 17915 951 1 5 . 1 1 10 10 LEU H H 10 8.864 8.864 8.223 0.641 17915 952 1 5 . 1 1 11 11 ALA N N 11 126.907 126.907 123.285 3.622 17915 953 1 5 . 1 1 11 11 ALA C C 11 178.406 178.406 177.368 1.038 17915 954 1 5 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.848 0.667 17915 955 1 5 . 1 1 11 11 ALA H H 11 8.988 8.988 8.746 0.242 17915 956 1 5 . 1 1 12 12 LEU N N 12 127.694 127.694 125.902 1.792 17915 957 1 5 . 1 1 12 12 LEU C C 12 175.046 175.046 176.415 -1.369 17915 958 1 5 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.640 -0.913 17915 959 1 5 . 1 1 12 12 LEU H H 12 9.136 9.136 8.917 0.219 17915 960 1 5 . 1 1 13 13 TYR N N 13 111.415 111.415 115.710 -4.295 17915 961 1 5 . 1 1 13 13 TYR C C 13 173.844 173.844 173.616 0.228 17915 962 1 5 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.739 -2.083 17915 963 1 5 . 1 1 13 13 TYR H H 13 6.979 6.979 7.691 -0.712 17915 964 1 5 . 1 1 14 14 ASP N N 14 117.591 117.591 120.506 -2.915 17915 965 1 5 . 1 1 14 14 ASP C C 14 176.140 176.140 174.690 1.450 17915 966 1 5 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.078 -0.556 17915 967 1 5 . 1 1 14 14 ASP H H 14 8.260 8.260 8.130 0.130 17915 968 1 5 . 1 1 15 15 TYR N N 15 119.917 119.917 122.911 -2.994 17915 969 1 5 . 1 1 15 15 TYR C C 15 172.859 172.859 174.234 -1.375 17915 970 1 5 . 1 1 15 15 TYR CA C 15 59.661 59.661 56.479 3.182 17915 971 1 5 . 1 1 15 15 TYR H H 15 8.580 8.580 7.967 0.613 17915 972 1 5 . 1 1 16 16 GLN N N 16 127.024 127.024 119.113 7.911 17915 973 1 5 . 1 1 16 16 GLN C C 16 176.377 176.377 174.320 2.057 17915 974 1 5 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.390 -1.724 17915 975 1 5 . 1 1 16 16 GLN H H 16 7.450 7.450 8.780 -1.330 17915 976 1 5 . 1 1 17 17 GLU N N 17 122.837 122.837 123.924 -1.087 17915 977 1 5 . 1 1 17 17 GLU C C 17 176.140 176.140 175.370 0.770 17915 978 1 5 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.585 -0.510 17915 979 1 5 . 1 1 17 17 GLU H H 17 7.899 7.899 8.550 -0.651 17915 980 1 5 . 1 1 18 18 LYS N N 18 120.622 120.622 118.587 2.035 17915 981 1 5 . 1 1 18 18 LYS C C 18 176.267 176.267 175.262 1.005 17915 982 1 5 . 1 1 18 18 LYS CA C 18 55.245 55.245 57.298 -2.053 17915 983 1 5 . 1 1 18 18 LYS H H 18 8.649 8.649 8.487 0.162 17915 984 1 5 . 1 1 19 19 SER N N 19 115.184 115.184 114.278 0.906 17915 985 1 5 . 1 1 19 19 SER CA C 19 56.824 56.824 55.184 1.640 17915 986 1 5 . 1 1 19 19 SER H H 19 7.552 7.552 8.278 -0.726 17915 987 1 5 . 1 1 21 21 ARG N N 21 113.440 113.440 117.025 -3.585 17915 988 1 5 . 1 1 21 21 ARG C C 21 176.638 176.638 176.246 0.392 17915 989 1 5 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.676 -0.468 17915 990 1 5 . 1 1 21 21 ARG H H 21 7.596 7.596 7.991 -0.395 17915 991 1 5 . 1 1 22 22 GLU N N 22 121.392 121.392 115.944 5.448 17915 992 1 5 . 1 1 22 22 GLU C C 22 174.500 174.500 173.990 0.510 17915 993 1 5 . 1 1 22 22 GLU CA C 22 55.352 55.352 55.344 0.008 17915 994 1 5 . 1 1 22 22 GLU H H 22 7.746 7.746 7.742 0.004 17915 995 1 5 . 1 1 23 23 VAL N N 23 114.115 114.115 115.479 -1.364 17915 996 1 5 . 1 1 23 23 VAL C C 23 172.337 172.337 174.402 -2.065 17915 997 1 5 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.294 -0.419 17915 998 1 5 . 1 1 23 23 VAL H H 23 7.318 7.318 8.065 -0.747 17915 999 1 5 . 1 1 24 24 THR N N 24 118.996 118.996 114.844 4.152 17915 1000 1 5 . 1 1 24 24 THR C C 24 174.451 174.451 174.090 0.361 17915 1001 1 5 . 1 1 24 24 THR CA C 24 61.641 61.641 60.676 0.965 17915 1002 1 5 . 1 1 24 24 THR H H 24 7.324 7.324 8.193 -0.869 17915 1003 1 5 . 1 1 25 25 MET N N 25 121.901 121.901 123.322 -1.421 17915 1004 1 5 . 1 1 25 25 MET C C 25 173.931 173.931 174.684 -0.753 17915 1005 1 5 . 1 1 25 25 MET CA C 25 54.389 54.389 54.522 -0.133 17915 1006 1 5 . 1 1 25 25 MET H H 25 9.432 9.432 8.704 0.728 17915 1007 1 5 . 1 1 26 26 LYS N N 26 124.169 124.169 123.314 0.855 17915 1008 1 5 . 1 1 26 26 LYS C C 26 175.002 175.002 176.198 -1.196 17915 1009 1 5 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.541 -1.875 17915 1010 1 5 . 1 1 26 26 LYS H H 26 8.634 8.634 8.306 0.328 17915 1011 1 5 . 1 1 27 27 LYS N N 27 122.603 122.603 124.723 -2.120 17915 1012 1 5 . 1 1 27 27 LYS C C 27 177.318 177.318 177.423 -0.105 17915 1013 1 5 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.387 0.257 17915 1014 1 5 . 1 1 27 27 LYS H H 27 8.919 8.919 8.689 0.230 17915 1015 1 5 . 1 1 28 28 GLY N N 28 115.585 115.585 114.907 0.678 17915 1016 1 5 . 1 1 28 28 GLY C C 28 174.193 174.193 174.815 -0.622 17915 1017 1 5 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.974 -0.086 17915 1018 1 5 . 1 1 28 28 GLY H H 28 8.732 8.732 8.371 0.361 17915 1019 1 5 . 1 1 29 29 ASP N N 29 121.770 121.770 123.394 -1.624 17915 1020 1 5 . 1 1 29 29 ASP C C 29 174.281 174.281 175.378 -1.097 17915 1021 1 5 . 1 1 29 29 ASP CA C 29 55.486 55.486 55.516 -0.030 17915 1022 1 5 . 1 1 29 29 ASP H H 29 8.388 8.388 7.918 0.470 17915 1023 1 5 . 1 1 30 30 ILE N N 30 120.469 120.469 119.125 1.344 17915 1024 1 5 . 1 1 30 30 ILE C C 30 176.356 176.356 175.265 1.091 17915 1025 1 5 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.691 -0.442 17915 1026 1 5 . 1 1 30 30 ILE H H 30 8.033 8.033 8.168 -0.135 17915 1027 1 5 . 1 1 31 31 LEU N N 31 127.129 127.129 128.878 -1.749 17915 1028 1 5 . 1 1 31 31 LEU C C 31 175.745 175.745 175.440 0.305 17915 1029 1 5 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.639 0.268 17915 1030 1 5 . 1 1 31 31 LEU H H 31 9.223 9.223 9.289 -0.066 17915 1031 1 5 . 1 1 32 32 THR N N 32 117.055 117.055 115.318 1.737 17915 1032 1 5 . 1 1 32 32 THR C C 32 173.844 173.844 173.731 0.113 17915 1033 1 5 . 1 1 32 32 THR CA C 32 63.247 63.247 61.193 2.054 17915 1034 1 5 . 1 1 32 32 THR H H 32 8.360 8.360 8.538 -0.178 17915 1035 1 5 . 1 1 33 33 LEU N N 33 128.815 128.815 124.731 4.084 17915 1036 1 5 . 1 1 33 33 LEU C C 33 174.718 174.718 175.580 -0.862 17915 1037 1 5 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.444 0.426 17915 1038 1 5 . 1 1 33 33 LEU H H 33 8.937 8.937 8.448 0.489 17915 1039 1 5 . 1 1 34 34 LEU N N 34 126.230 126.230 122.686 3.544 17915 1040 1 5 . 1 1 34 34 LEU C C 34 177.689 177.689 176.717 0.972 17915 1041 1 5 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.084 0.134 17915 1042 1 5 . 1 1 34 34 LEU H H 34 8.929 8.929 8.643 0.286 17915 1043 1 5 . 1 1 35 35 ASN N N 35 113.879 113.879 117.192 -3.313 17915 1044 1 5 . 1 1 35 35 ASN C C 35 174.565 174.565 173.116 1.449 17915 1045 1 5 . 1 1 35 35 ASN CA C 35 54.576 54.576 52.591 1.985 17915 1046 1 5 . 1 1 35 35 ASN H H 35 7.489 7.489 7.535 -0.046 17915 1047 1 5 . 1 1 36 36 SER N N 36 123.684 123.684 115.385 8.299 17915 1048 1 5 . 1 1 36 36 SER C C 36 173.503 173.503 173.591 -0.088 17915 1049 1 5 . 1 1 36 36 SER CA C 36 56.904 56.904 57.513 -0.609 17915 1050 1 5 . 1 1 36 36 SER H H 36 9.086 9.086 8.399 0.687 17915 1051 1 5 . 1 1 37 37 THR N N 37 115.012 115.012 115.928 -0.916 17915 1052 1 5 . 1 1 37 37 THR C C 37 175.417 175.417 175.238 0.179 17915 1053 1 5 . 1 1 37 37 THR CA C 37 65.521 65.521 61.254 4.267 17915 1054 1 5 . 1 1 37 37 THR H H 37 8.071 8.071 7.944 0.127 17915 1055 1 5 . 1 1 38 38 ASN N N 38 122.517 122.517 121.415 1.102 17915 1056 1 5 . 1 1 38 38 ASN C C 38 174.696 174.696 175.910 -1.214 17915 1057 1 5 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.507 -0.028 17915 1058 1 5 . 1 1 38 38 ASN H H 38 8.595 8.595 8.211 0.384 17915 1059 1 5 . 1 1 39 39 LYS N N 39 120.851 120.851 122.147 -1.296 17915 1060 1 5 . 1 1 39 39 LYS C C 39 176.444 176.444 177.246 -0.802 17915 1061 1 5 . 1 1 39 39 LYS CA C 39 58.403 58.403 59.233 -0.829 17915 1062 1 5 . 1 1 39 39 LYS H H 39 8.416 8.416 8.594 -0.178 17915 1063 1 5 . 1 1 40 40 ASP N N 40 114.427 114.427 117.971 -3.544 17915 1064 1 5 . 1 1 40 40 ASP C C 40 176.960 176.960 175.902 1.058 17915 1065 1 5 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.377 -0.025 17915 1066 1 5 . 1 1 40 40 ASP H H 40 8.085 8.085 8.561 -0.476 17915 1067 1 5 . 1 1 41 41 TRP N N 41 122.708 122.708 119.398 3.310 17915 1068 1 5 . 1 1 41 41 TRP C C 41 174.303 174.303 175.654 -1.351 17915 1069 1 5 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.419 -0.211 17915 1070 1 5 . 1 1 41 41 TRP H H 41 8.096 8.096 7.708 0.388 17915 1071 1 5 . 1 1 42 42 TRP N N 42 124.707 124.707 126.880 -2.173 17915 1072 1 5 . 1 1 42 42 TRP C C 42 174.303 174.303 174.865 -0.562 17915 1073 1 5 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.957 -1.970 17915 1074 1 5 . 1 1 42 42 TRP H H 42 9.245 9.245 8.137 1.108 17915 1075 1 5 . 1 1 43 43 LYS N N 43 124.005 124.005 124.749 -0.744 17915 1076 1 5 . 1 1 43 43 LYS C C 43 175.482 175.482 175.676 -0.194 17915 1077 1 5 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.502 -0.123 17915 1078 1 5 . 1 1 43 43 LYS H H 43 8.783 8.783 7.967 0.816 17915 1079 1 5 . 1 1 44 44 VAL N N 44 122.139 122.139 121.509 0.630 17915 1080 1 5 . 1 1 44 44 VAL C C 44 173.472 173.472 173.568 -0.096 17915 1081 1 5 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.427 -0.355 17915 1082 1 5 . 1 1 44 44 VAL H H 44 9.287 9.287 8.349 0.938 17915 1083 1 5 . 1 1 45 45 GLU N N 45 118.524 118.524 121.995 -3.471 17915 1084 1 5 . 1 1 45 45 GLU C C 45 174.827 174.827 174.614 0.213 17915 1085 1 5 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.975 -0.801 17915 1086 1 5 . 1 1 45 45 GLU H H 45 8.566 8.566 7.962 0.604 17915 1087 1 5 . 1 1 46 46 VAL N N 46 124.904 124.904 123.309 1.595 17915 1088 1 5 . 1 1 46 46 VAL C C 46 174.608 174.608 174.657 -0.049 17915 1089 1 5 . 1 1 46 46 VAL CA C 46 60.651 60.651 60.530 0.121 17915 1090 1 5 . 1 1 46 46 VAL H H 46 8.774 8.774 7.811 0.963 17915 1091 1 5 . 1 1 47 47 ASN N N 47 126.530 126.530 125.633 0.897 17915 1092 1 5 . 1 1 47 47 ASN C C 47 174.259 174.259 174.672 -0.413 17915 1093 1 5 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.270 0.974 17915 1094 1 5 . 1 1 47 47 ASN H H 47 9.356 9.356 8.882 0.474 17915 1095 1 5 . 1 1 48 48 ASP N N 48 112.420 112.420 114.616 -2.196 17915 1096 1 5 . 1 1 48 48 ASP C C 48 174.521 174.521 175.065 -0.544 17915 1097 1 5 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.528 -0.845 17915 1098 1 5 . 1 1 48 48 ASP H H 48 8.628 8.628 8.570 0.058 17915 1099 1 5 . 1 1 49 49 ARG N N 49 120.379 120.379 118.053 2.326 17915 1100 1 5 . 1 1 49 49 ARG C C 49 174.477 174.477 174.981 -0.504 17915 1101 1 5 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.120 0.178 17915 1102 1 5 . 1 1 49 49 ARG H H 49 8.069 8.069 7.912 0.157 17915 1103 1 5 . 1 1 50 50 GLN N N 50 118.647 118.647 118.364 0.283 17915 1104 1 5 . 1 1 50 50 GLN C C 50 175.963 175.963 175.291 0.672 17915 1105 1 5 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.290 -0.865 17915 1106 1 5 . 1 1 50 50 GLN H H 50 8.432 8.432 8.342 0.090 17915 1107 1 5 . 1 1 51 51 GLY N N 51 107.028 107.028 108.010 -0.982 17915 1108 1 5 . 1 1 51 51 GLY C C 51 170.479 170.479 171.622 -1.143 17915 1109 1 5 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.484 0.154 17915 1110 1 5 . 1 1 51 51 GLY H H 51 8.534 8.534 7.754 0.780 17915 1111 1 5 . 1 1 52 52 PHE N N 52 119.030 119.030 119.861 -0.831 17915 1112 1 5 . 1 1 52 52 PHE C C 52 175.635 175.635 174.950 0.685 17915 1113 1 5 . 1 1 52 52 PHE CA C 52 58.724 58.724 55.534 3.190 17915 1114 1 5 . 1 1 52 52 PHE H H 52 9.098 9.098 7.979 1.119 17915 1115 1 5 . 1 1 53 53 VAL N N 53 110.897 110.897 115.799 -4.902 17915 1116 1 5 . 1 1 53 53 VAL CA C 53 58.108 58.108 57.532 0.576 17915 1117 1 5 . 1 1 53 53 VAL H H 53 8.942 8.942 8.138 0.804 17915 1118 1 5 . 1 1 55 55 ALA N N 55 129.055 129.055 123.620 5.435 17915 1119 1 5 . 1 1 55 55 ALA C C 55 178.565 178.565 177.992 0.573 17915 1120 1 5 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.630 -0.001 17915 1121 1 5 . 1 1 55 55 ALA H H 55 7.355 7.355 8.645 -1.290 17915 1122 1 5 . 1 1 56 56 ALA N N 56 113.282 113.282 118.235 -4.953 17915 1123 1 5 . 1 1 56 56 ALA C C 56 178.214 178.214 178.307 -0.093 17915 1124 1 5 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.556 -0.613 17915 1125 1 5 . 1 1 56 56 ALA H H 56 7.750 7.750 7.803 -0.053 17915 1126 1 5 . 1 1 57 57 TYR N N 57 116.083 116.083 118.419 -2.336 17915 1127 1 5 . 1 1 57 57 TYR C C 57 174.565 174.565 175.149 -0.584 17915 1128 1 5 . 1 1 57 57 TYR CA C 57 56.422 56.422 61.305 -4.883 17915 1129 1 5 . 1 1 57 57 TYR H H 57 7.611 7.611 7.527 0.084 17915 1130 1 5 . 1 1 58 58 VAL N N 58 110.965 110.965 107.486 3.479 17915 1131 1 5 . 1 1 58 58 VAL C C 58 173.647 173.647 173.821 -0.174 17915 1132 1 5 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.008 -0.766 17915 1133 1 5 . 1 1 58 58 VAL H H 58 7.301 7.301 7.107 0.194 17915 1134 1 5 . 1 1 59 59 LYS N N 59 118.586 118.586 123.002 -4.416 17915 1135 1 5 . 1 1 59 59 LYS C C 59 176.160 176.160 175.690 0.470 17915 1136 1 5 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.273 -1.232 17915 1137 1 5 . 1 1 59 59 LYS H H 59 8.515 8.515 8.150 0.365 17915 1138 1 5 . 1 1 60 60 LYS N N 60 125.734 125.734 125.478 0.256 17915 1139 1 5 . 1 1 60 60 LYS C C 60 176.793 176.793 176.740 0.053 17915 1140 1 5 . 1 1 60 60 LYS CA C 60 58.617 58.617 53.779 4.838 17915 1141 1 5 . 1 1 60 60 LYS H H 60 9.135 9.135 8.498 0.637 17915 1142 1 5 . 1 1 61 61 LEU N N 61 125.061 125.061 124.580 0.481 17915 1143 1 5 . 1 1 61 61 LEU C C 61 174.106 174.106 175.668 -1.562 17915 1144 1 5 . 1 1 61 61 LEU CA C 61 54.977 54.977 54.385 0.592 17915 1145 1 5 . 1 1 61 61 LEU H H 61 8.384 8.384 8.435 -0.051 17915 1146 1 6 . 1 1 2 2 ASP N N 2 123.220 123.220 118.300 4.920 17915 1147 1 6 . 1 1 2 2 ASP C C 2 175.703 175.703 174.703 1.000 17915 1148 1 6 . 1 1 2 2 ASP CA C 2 54.041 54.041 55.020 -0.979 17915 1149 1 6 . 1 1 2 2 ASP H H 2 8.738 8.738 7.843 0.895 17915 1150 1 6 . 1 1 3 3 GLU N N 3 121.895 121.895 118.439 3.456 17915 1151 1 6 . 1 1 3 3 GLU C C 3 176.480 176.480 175.602 0.878 17915 1152 1 6 . 1 1 3 3 GLU CA C 3 56.128 56.128 57.323 -1.195 17915 1153 1 6 . 1 1 3 3 GLU H H 3 8.570 8.570 8.942 -0.372 17915 1154 1 6 . 1 1 4 4 THR N N 4 114.607 114.607 109.708 4.899 17915 1155 1 6 . 1 1 4 4 THR C C 4 175.417 175.417 173.545 1.872 17915 1156 1 6 . 1 1 4 4 THR CA C 4 62.685 62.685 61.360 1.325 17915 1157 1 6 . 1 1 4 4 THR H H 4 8.176 8.176 7.993 0.183 17915 1158 1 6 . 1 1 5 5 GLY N N 5 111.430 111.430 108.618 2.812 17915 1159 1 6 . 1 1 5 5 GLY C C 5 173.777 173.777 172.680 1.097 17915 1160 1 6 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.410 0.150 17915 1161 1 6 . 1 1 5 5 GLY H H 5 8.344 8.344 7.885 0.459 17915 1162 1 6 . 1 1 6 6 LYS N N 6 119.850 119.850 121.558 -1.708 17915 1163 1 6 . 1 1 6 6 LYS C C 6 176.049 176.049 175.937 0.112 17915 1164 1 6 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.555 0.359 17915 1165 1 6 . 1 1 6 6 LYS H H 6 7.903 7.903 7.816 0.087 17915 1166 1 6 . 1 1 7 7 GLU N N 7 123.025 123.025 117.875 5.150 17915 1167 1 6 . 1 1 7 7 GLU C C 7 174.172 174.172 174.156 0.016 17915 1168 1 6 . 1 1 7 7 GLU CA C 7 55.459 55.459 56.745 -1.286 17915 1169 1 6 . 1 1 7 7 GLU H H 7 8.562 8.562 8.876 -0.314 17915 1170 1 6 . 1 1 8 8 LEU N N 8 123.147 123.147 118.051 5.096 17915 1171 1 6 . 1 1 8 8 LEU C C 8 177.495 177.495 174.917 2.578 17915 1172 1 6 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.608 -0.183 17915 1173 1 6 . 1 1 8 8 LEU H H 8 8.292 8.292 7.378 0.914 17915 1174 1 6 . 1 1 9 9 VAL N N 9 111.799 111.799 116.587 -4.788 17915 1175 1 6 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.414 -2.520 17915 1176 1 6 . 1 1 9 9 VAL H H 9 9.051 9.051 8.084 0.967 17915 1177 1 6 . 1 1 10 10 LEU N N 10 123.127 123.127 126.059 -2.932 17915 1178 1 6 . 1 1 10 10 LEU C C 10 176.729 176.729 174.754 1.975 17915 1179 1 6 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.431 0.058 17915 1180 1 6 . 1 1 10 10 LEU H H 10 8.864 8.864 8.473 0.391 17915 1181 1 6 . 1 1 11 11 ALA N N 11 126.907 126.907 125.775 1.132 17915 1182 1 6 . 1 1 11 11 ALA C C 11 178.406 178.406 177.010 1.396 17915 1183 1 6 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.680 0.835 17915 1184 1 6 . 1 1 11 11 ALA H H 11 8.988 8.988 8.929 0.059 17915 1185 1 6 . 1 1 12 12 LEU N N 12 127.694 127.694 125.728 1.966 17915 1186 1 6 . 1 1 12 12 LEU C C 12 175.046 175.046 176.153 -1.107 17915 1187 1 6 . 1 1 12 12 LEU CA C 12 55.727 55.727 55.882 -0.154 17915 1188 1 6 . 1 1 12 12 LEU H H 12 9.136 9.136 8.806 0.330 17915 1189 1 6 . 1 1 13 13 TYR N N 13 111.415 111.415 117.876 -6.461 17915 1190 1 6 . 1 1 13 13 TYR C C 13 173.844 173.844 174.475 -0.631 17915 1191 1 6 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.196 -1.540 17915 1192 1 6 . 1 1 13 13 TYR H H 13 6.979 6.979 7.807 -0.828 17915 1193 1 6 . 1 1 14 14 ASP N N 14 117.591 117.591 124.442 -6.851 17915 1194 1 6 . 1 1 14 14 ASP C C 14 176.140 176.140 174.436 1.704 17915 1195 1 6 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.299 -0.777 17915 1196 1 6 . 1 1 14 14 ASP H H 14 8.260 8.260 8.583 -0.323 17915 1197 1 6 . 1 1 15 15 TYR N N 15 119.917 119.917 123.103 -3.186 17915 1198 1 6 . 1 1 15 15 TYR C C 15 172.859 172.859 173.819 -0.960 17915 1199 1 6 . 1 1 15 15 TYR CA C 15 59.661 59.661 57.157 2.504 17915 1200 1 6 . 1 1 15 15 TYR H H 15 8.580 8.580 8.781 -0.201 17915 1201 1 6 . 1 1 16 16 GLN N N 16 127.024 127.024 118.087 8.937 17915 1202 1 6 . 1 1 16 16 GLN C C 16 176.377 176.377 174.340 2.037 17915 1203 1 6 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.116 -0.450 17915 1204 1 6 . 1 1 16 16 GLN H H 16 7.450 7.450 7.834 -0.384 17915 1205 1 6 . 1 1 17 17 GLU N N 17 122.837 122.837 122.840 -0.003 17915 1206 1 6 . 1 1 17 17 GLU C C 17 176.140 176.140 175.862 0.278 17915 1207 1 6 . 1 1 17 17 GLU CA C 17 56.075 56.075 57.001 -0.925 17915 1208 1 6 . 1 1 17 17 GLU H H 17 7.899 7.899 8.678 -0.779 17915 1209 1 6 . 1 1 18 18 LYS N N 18 120.622 120.622 124.307 -3.685 17915 1210 1 6 . 1 1 18 18 LYS C C 18 176.267 176.267 175.022 1.245 17915 1211 1 6 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.140 -0.895 17915 1212 1 6 . 1 1 18 18 LYS H H 18 8.649 8.649 8.495 0.154 17915 1213 1 6 . 1 1 19 19 SER N N 19 115.184 115.184 112.888 2.296 17915 1214 1 6 . 1 1 19 19 SER CA C 19 56.824 56.824 56.130 0.694 17915 1215 1 6 . 1 1 19 19 SER H H 19 7.552 7.552 7.483 0.069 17915 1216 1 6 . 1 1 21 21 ARG N N 21 113.440 113.440 117.678 -4.238 17915 1217 1 6 . 1 1 21 21 ARG C C 21 176.638 176.638 176.142 0.496 17915 1218 1 6 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.389 -0.181 17915 1219 1 6 . 1 1 21 21 ARG H H 21 7.596 7.596 8.066 -0.470 17915 1220 1 6 . 1 1 22 22 GLU N N 22 121.392 121.392 117.847 3.545 17915 1221 1 6 . 1 1 22 22 GLU C C 22 174.500 174.500 176.548 -2.048 17915 1222 1 6 . 1 1 22 22 GLU CA C 22 55.352 55.352 57.178 -1.827 17915 1223 1 6 . 1 1 22 22 GLU H H 22 7.746 7.746 7.690 0.056 17915 1224 1 6 . 1 1 23 23 VAL N N 23 114.115 114.115 120.122 -6.007 17915 1225 1 6 . 1 1 23 23 VAL C C 23 172.337 172.337 175.050 -2.713 17915 1226 1 6 . 1 1 23 23 VAL CA C 23 59.875 59.875 61.114 -1.239 17915 1227 1 6 . 1 1 23 23 VAL H H 23 7.318 7.318 8.468 -1.150 17915 1228 1 6 . 1 1 24 24 THR N N 24 118.996 118.996 119.248 -0.252 17915 1229 1 6 . 1 1 24 24 THR C C 24 174.451 174.451 173.331 1.120 17915 1230 1 6 . 1 1 24 24 THR CA C 24 61.641 61.641 61.485 0.156 17915 1231 1 6 . 1 1 24 24 THR H H 24 7.324 7.324 8.317 -0.993 17915 1232 1 6 . 1 1 25 25 MET N N 25 121.901 121.901 121.411 0.490 17915 1233 1 6 . 1 1 25 25 MET C C 25 173.931 173.931 173.991 -0.060 17915 1234 1 6 . 1 1 25 25 MET CA C 25 54.389 54.389 54.478 -0.089 17915 1235 1 6 . 1 1 25 25 MET H H 25 9.432 9.432 8.125 1.307 17915 1236 1 6 . 1 1 26 26 LYS N N 26 124.169 124.169 122.016 2.153 17915 1237 1 6 . 1 1 26 26 LYS C C 26 175.002 175.002 176.198 -1.196 17915 1238 1 6 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.892 -1.226 17915 1239 1 6 . 1 1 26 26 LYS H H 26 8.634 8.634 8.707 -0.073 17915 1240 1 6 . 1 1 27 27 LYS N N 27 122.603 122.603 124.353 -1.750 17915 1241 1 6 . 1 1 27 27 LYS C C 27 177.318 177.318 177.250 0.068 17915 1242 1 6 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.914 0.730 17915 1243 1 6 . 1 1 27 27 LYS H H 27 8.919 8.919 9.075 -0.156 17915 1244 1 6 . 1 1 28 28 GLY N N 28 115.585 115.585 112.794 2.791 17915 1245 1 6 . 1 1 28 28 GLY C C 28 174.193 174.193 174.628 -0.435 17915 1246 1 6 . 1 1 28 28 GLY CA C 28 44.888 44.888 45.208 -0.320 17915 1247 1 6 . 1 1 28 28 GLY H H 28 8.732 8.732 9.041 -0.309 17915 1248 1 6 . 1 1 29 29 ASP N N 29 121.770 121.770 122.930 -1.160 17915 1249 1 6 . 1 1 29 29 ASP C C 29 174.281 174.281 175.568 -1.287 17915 1250 1 6 . 1 1 29 29 ASP CA C 29 55.486 55.486 53.993 1.493 17915 1251 1 6 . 1 1 29 29 ASP H H 29 8.388 8.388 7.868 0.520 17915 1252 1 6 . 1 1 30 30 ILE N N 30 120.469 120.469 115.068 5.401 17915 1253 1 6 . 1 1 30 30 ILE C C 30 176.356 176.356 174.730 1.626 17915 1254 1 6 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.561 0.688 17915 1255 1 6 . 1 1 30 30 ILE H H 30 8.033 8.033 8.051 -0.018 17915 1256 1 6 . 1 1 31 31 LEU N N 31 127.129 127.129 124.654 2.475 17915 1257 1 6 . 1 1 31 31 LEU C C 31 175.745 175.745 176.051 -0.306 17915 1258 1 6 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.315 0.592 17915 1259 1 6 . 1 1 31 31 LEU H H 31 9.223 9.223 9.068 0.155 17915 1260 1 6 . 1 1 32 32 THR N N 32 117.055 117.055 114.607 2.448 17915 1261 1 6 . 1 1 32 32 THR C C 32 173.844 173.844 173.426 0.418 17915 1262 1 6 . 1 1 32 32 THR CA C 32 63.247 63.247 60.865 2.382 17915 1263 1 6 . 1 1 32 32 THR H H 32 8.360 8.360 8.593 -0.233 17915 1264 1 6 . 1 1 33 33 LEU N N 33 128.815 128.815 125.960 2.855 17915 1265 1 6 . 1 1 33 33 LEU C C 33 174.718 174.718 175.643 -0.925 17915 1266 1 6 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.917 -0.047 17915 1267 1 6 . 1 1 33 33 LEU H H 33 8.937 8.937 8.737 0.200 17915 1268 1 6 . 1 1 34 34 LEU N N 34 126.230 126.230 127.054 -0.824 17915 1269 1 6 . 1 1 34 34 LEU C C 34 177.689 177.689 176.129 1.560 17915 1270 1 6 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.559 -0.341 17915 1271 1 6 . 1 1 34 34 LEU H H 34 8.929 8.929 8.660 0.269 17915 1272 1 6 . 1 1 35 35 ASN N N 35 113.879 113.879 117.984 -4.105 17915 1273 1 6 . 1 1 35 35 ASN C C 35 174.565 174.565 174.394 0.171 17915 1274 1 6 . 1 1 35 35 ASN CA C 35 54.576 54.576 52.484 2.092 17915 1275 1 6 . 1 1 35 35 ASN H H 35 7.489 7.489 7.713 -0.224 17915 1276 1 6 . 1 1 36 36 SER N N 36 123.684 123.684 119.128 4.556 17915 1277 1 6 . 1 1 36 36 SER C C 36 173.503 173.503 175.238 -1.735 17915 1278 1 6 . 1 1 36 36 SER CA C 36 56.904 56.904 57.826 -0.922 17915 1279 1 6 . 1 1 36 36 SER H H 36 9.086 9.086 8.657 0.429 17915 1280 1 6 . 1 1 37 37 THR N N 37 115.012 115.012 117.675 -2.663 17915 1281 1 6 . 1 1 37 37 THR C C 37 175.417 175.417 175.257 0.160 17915 1282 1 6 . 1 1 37 37 THR CA C 37 65.521 65.521 64.400 1.121 17915 1283 1 6 . 1 1 37 37 THR H H 37 8.071 8.071 8.226 -0.155 17915 1284 1 6 . 1 1 38 38 ASN N N 38 122.517 122.517 116.554 5.963 17915 1285 1 6 . 1 1 38 38 ASN C C 38 174.696 174.696 173.864 0.832 17915 1286 1 6 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.332 1.147 17915 1287 1 6 . 1 1 38 38 ASN H H 38 8.595 8.595 7.863 0.732 17915 1288 1 6 . 1 1 39 39 LYS N N 39 120.851 120.851 119.540 1.311 17915 1289 1 6 . 1 1 39 39 LYS C C 39 176.444 176.444 176.948 -0.504 17915 1290 1 6 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.206 0.197 17915 1291 1 6 . 1 1 39 39 LYS H H 39 8.416 8.416 8.683 -0.267 17915 1292 1 6 . 1 1 40 40 ASP N N 40 114.427 114.427 118.120 -3.693 17915 1293 1 6 . 1 1 40 40 ASP C C 40 176.960 176.960 174.670 2.290 17915 1294 1 6 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.441 -0.089 17915 1295 1 6 . 1 1 40 40 ASP H H 40 8.085 8.085 8.110 -0.025 17915 1296 1 6 . 1 1 41 41 TRP N N 41 122.708 122.708 118.962 3.746 17915 1297 1 6 . 1 1 41 41 TRP C C 41 174.303 174.303 174.092 0.211 17915 1298 1 6 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.784 -0.576 17915 1299 1 6 . 1 1 41 41 TRP H H 41 8.096 8.096 7.486 0.610 17915 1300 1 6 . 1 1 42 42 TRP N N 42 124.707 124.707 123.427 1.280 17915 1301 1 6 . 1 1 42 42 TRP C C 42 174.303 174.303 174.229 0.074 17915 1302 1 6 . 1 1 42 42 TRP CA C 42 53.987 53.987 54.427 -0.440 17915 1303 1 6 . 1 1 42 42 TRP H H 42 9.245 9.245 7.983 1.262 17915 1304 1 6 . 1 1 43 43 LYS N N 43 124.005 124.005 120.406 3.599 17915 1305 1 6 . 1 1 43 43 LYS C C 43 175.482 175.482 175.872 -0.390 17915 1306 1 6 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.353 0.026 17915 1307 1 6 . 1 1 43 43 LYS H H 43 8.783 8.783 8.073 0.710 17915 1308 1 6 . 1 1 44 44 VAL N N 44 122.139 122.139 118.748 3.391 17915 1309 1 6 . 1 1 44 44 VAL C C 44 173.472 173.472 173.926 -0.454 17915 1310 1 6 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.587 -0.515 17915 1311 1 6 . 1 1 44 44 VAL H H 44 9.287 9.287 8.149 1.138 17915 1312 1 6 . 1 1 45 45 GLU N N 45 118.524 118.524 121.189 -2.665 17915 1313 1 6 . 1 1 45 45 GLU C C 45 174.827 174.827 175.668 -0.841 17915 1314 1 6 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.411 -0.237 17915 1315 1 6 . 1 1 45 45 GLU H H 45 8.566 8.566 7.971 0.595 17915 1316 1 6 . 1 1 46 46 VAL N N 46 124.904 124.904 126.294 -1.390 17915 1317 1 6 . 1 1 46 46 VAL C C 46 174.608 174.608 174.932 -0.324 17915 1318 1 6 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.490 -0.839 17915 1319 1 6 . 1 1 46 46 VAL H H 46 8.774 8.774 7.928 0.846 17915 1320 1 6 . 1 1 47 47 ASN N N 47 126.530 126.530 124.023 2.507 17915 1321 1 6 . 1 1 47 47 ASN C C 47 174.259 174.259 174.343 -0.084 17915 1322 1 6 . 1 1 47 47 ASN CA C 47 55.245 55.245 53.862 1.383 17915 1323 1 6 . 1 1 47 47 ASN H H 47 9.356 9.356 8.809 0.547 17915 1324 1 6 . 1 1 48 48 ASP N N 48 112.420 112.420 114.293 -1.873 17915 1325 1 6 . 1 1 48 48 ASP C C 48 174.521 174.521 175.959 -1.438 17915 1326 1 6 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.267 -0.584 17915 1327 1 6 . 1 1 48 48 ASP H H 48 8.628 8.628 8.540 0.088 17915 1328 1 6 . 1 1 49 49 ARG N N 49 120.379 120.379 118.024 2.355 17915 1329 1 6 . 1 1 49 49 ARG C C 49 174.477 174.477 173.993 0.484 17915 1330 1 6 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.120 0.178 17915 1331 1 6 . 1 1 49 49 ARG H H 49 8.069 8.069 7.807 0.262 17915 1332 1 6 . 1 1 50 50 GLN N N 50 118.647 118.647 120.220 -1.573 17915 1333 1 6 . 1 1 50 50 GLN C C 50 175.963 175.963 174.447 1.516 17915 1334 1 6 . 1 1 50 50 GLN CA C 50 53.425 53.425 53.998 -0.573 17915 1335 1 6 . 1 1 50 50 GLN H H 50 8.432 8.432 8.339 0.093 17915 1336 1 6 . 1 1 51 51 GLY N N 51 107.028 107.028 107.280 -0.252 17915 1337 1 6 . 1 1 51 51 GLY C C 51 170.479 170.479 172.024 -1.545 17915 1338 1 6 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.656 -0.018 17915 1339 1 6 . 1 1 51 51 GLY H H 51 8.534 8.534 8.238 0.296 17915 1340 1 6 . 1 1 52 52 PHE N N 52 119.030 119.030 120.786 -1.756 17915 1341 1 6 . 1 1 52 52 PHE C C 52 175.635 175.635 174.903 0.732 17915 1342 1 6 . 1 1 52 52 PHE CA C 52 58.724 58.724 59.053 -0.329 17915 1343 1 6 . 1 1 52 52 PHE H H 52 9.098 9.098 8.294 0.804 17915 1344 1 6 . 1 1 53 53 VAL N N 53 110.897 110.897 126.348 -15.451 17915 1345 1 6 . 1 1 53 53 VAL CA C 53 58.108 58.108 58.889 -0.781 17915 1346 1 6 . 1 1 53 53 VAL H H 53 8.942 8.942 8.628 0.314 17915 1347 1 6 . 1 1 55 55 ALA N N 55 129.055 129.055 127.822 1.233 17915 1348 1 6 . 1 1 55 55 ALA C C 55 178.565 178.565 178.576 -0.011 17915 1349 1 6 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.284 0.345 17915 1350 1 6 . 1 1 55 55 ALA H H 55 7.355 7.355 7.557 -0.202 17915 1351 1 6 . 1 1 56 56 ALA N N 56 113.282 113.282 118.611 -5.329 17915 1352 1 6 . 1 1 56 56 ALA C C 56 178.214 178.214 178.116 0.098 17915 1353 1 6 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.804 -0.862 17915 1354 1 6 . 1 1 56 56 ALA H H 56 7.750 7.750 7.690 0.060 17915 1355 1 6 . 1 1 57 57 TYR N N 57 116.083 116.083 117.182 -1.099 17915 1356 1 6 . 1 1 57 57 TYR C C 57 174.565 174.565 174.857 -0.292 17915 1357 1 6 . 1 1 57 57 TYR CA C 57 56.422 56.422 59.800 -3.378 17915 1358 1 6 . 1 1 57 57 TYR H H 57 7.611 7.611 7.477 0.134 17915 1359 1 6 . 1 1 58 58 VAL N N 58 110.965 110.965 110.428 0.537 17915 1360 1 6 . 1 1 58 58 VAL C C 58 173.647 173.647 174.541 -0.894 17915 1361 1 6 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.293 -1.051 17915 1362 1 6 . 1 1 58 58 VAL H H 58 7.301 7.301 7.184 0.117 17915 1363 1 6 . 1 1 59 59 LYS N N 59 118.586 118.586 118.288 0.298 17915 1364 1 6 . 1 1 59 59 LYS C C 59 176.160 176.160 175.078 1.082 17915 1365 1 6 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.921 -0.880 17915 1366 1 6 . 1 1 59 59 LYS H H 59 8.515 8.515 8.021 0.494 17915 1367 1 6 . 1 1 60 60 LYS N N 60 125.734 125.734 122.322 3.412 17915 1368 1 6 . 1 1 60 60 LYS C C 60 176.793 176.793 176.619 0.174 17915 1369 1 6 . 1 1 60 60 LYS CA C 60 58.617 58.617 57.244 1.373 17915 1370 1 6 . 1 1 60 60 LYS H H 60 9.135 9.135 8.476 0.659 17915 1371 1 6 . 1 1 61 61 LEU N N 61 125.061 125.061 122.211 2.850 17915 1372 1 6 . 1 1 61 61 LEU C C 61 174.106 174.106 177.319 -3.213 17915 1373 1 6 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.728 -1.751 17915 1374 1 6 . 1 1 61 61 LEU H H 61 8.384 8.384 8.641 -0.257 17915 1375 1 7 . 1 1 2 2 ASP N N 2 123.220 123.220 119.923 3.297 17915 1376 1 7 . 1 1 2 2 ASP C C 2 175.703 175.703 175.192 0.511 17915 1377 1 7 . 1 1 2 2 ASP CA C 2 54.041 54.041 53.669 0.372 17915 1378 1 7 . 1 1 2 2 ASP H H 2 8.738 8.738 8.419 0.319 17915 1379 1 7 . 1 1 3 3 GLU N N 3 121.895 121.895 119.038 2.857 17915 1380 1 7 . 1 1 3 3 GLU C C 3 176.480 176.480 175.002 1.478 17915 1381 1 7 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.871 -0.743 17915 1382 1 7 . 1 1 3 3 GLU H H 3 8.570 8.570 8.776 -0.206 17915 1383 1 7 . 1 1 4 4 THR N N 4 114.607 114.607 112.170 2.437 17915 1384 1 7 . 1 1 4 4 THR C C 4 175.417 175.417 172.917 2.500 17915 1385 1 7 . 1 1 4 4 THR CA C 4 62.685 62.685 61.937 0.748 17915 1386 1 7 . 1 1 4 4 THR H H 4 8.176 8.176 7.760 0.416 17915 1387 1 7 . 1 1 5 5 GLY N N 5 111.430 111.430 112.327 -0.897 17915 1388 1 7 . 1 1 5 5 GLY C C 5 173.777 173.777 172.577 1.200 17915 1389 1 7 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.106 0.454 17915 1390 1 7 . 1 1 5 5 GLY H H 5 8.344 8.344 8.282 0.062 17915 1391 1 7 . 1 1 6 6 LYS N N 6 119.850 119.850 121.638 -1.788 17915 1392 1 7 . 1 1 6 6 LYS C C 6 176.049 176.049 176.356 -0.307 17915 1393 1 7 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.436 0.478 17915 1394 1 7 . 1 1 6 6 LYS H H 6 7.903 7.903 7.711 0.192 17915 1395 1 7 . 1 1 7 7 GLU N N 7 123.025 123.025 117.219 5.806 17915 1396 1 7 . 1 1 7 7 GLU C C 7 174.172 174.172 174.662 -0.490 17915 1397 1 7 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.148 -1.689 17915 1398 1 7 . 1 1 7 7 GLU H H 7 8.562 8.562 8.785 -0.223 17915 1399 1 7 . 1 1 8 8 LEU N N 8 123.147 123.147 118.781 4.366 17915 1400 1 7 . 1 1 8 8 LEU C C 8 177.495 177.495 174.818 2.677 17915 1401 1 7 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.765 -0.340 17915 1402 1 7 . 1 1 8 8 LEU H H 8 8.292 8.292 7.470 0.822 17915 1403 1 7 . 1 1 9 9 VAL N N 9 111.799 111.799 118.823 -7.024 17915 1404 1 7 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.694 -1.800 17915 1405 1 7 . 1 1 9 9 VAL H H 9 9.051 9.051 8.287 0.764 17915 1406 1 7 . 1 1 10 10 LEU N N 10 123.127 123.127 125.121 -1.994 17915 1407 1 7 . 1 1 10 10 LEU C C 10 176.729 176.729 175.628 1.101 17915 1408 1 7 . 1 1 10 10 LEU CA C 10 52.489 52.489 53.148 -0.659 17915 1409 1 7 . 1 1 10 10 LEU H H 10 8.864 8.864 8.917 -0.053 17915 1410 1 7 . 1 1 11 11 ALA N N 11 126.907 126.907 123.227 3.680 17915 1411 1 7 . 1 1 11 11 ALA C C 11 178.406 178.406 177.943 0.463 17915 1412 1 7 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.684 0.831 17915 1413 1 7 . 1 1 11 11 ALA H H 11 8.988 8.988 8.576 0.412 17915 1414 1 7 . 1 1 12 12 LEU N N 12 127.694 127.694 126.850 0.844 17915 1415 1 7 . 1 1 12 12 LEU C C 12 175.046 175.046 176.539 -1.493 17915 1416 1 7 . 1 1 12 12 LEU CA C 12 55.727 55.727 57.585 -1.858 17915 1417 1 7 . 1 1 12 12 LEU H H 12 9.136 9.136 8.841 0.295 17915 1418 1 7 . 1 1 13 13 TYR N N 13 111.415 111.415 115.368 -3.953 17915 1419 1 7 . 1 1 13 13 TYR C C 13 173.844 173.844 174.294 -0.450 17915 1420 1 7 . 1 1 13 13 TYR CA C 13 54.656 54.656 58.869 -4.213 17915 1421 1 7 . 1 1 13 13 TYR H H 13 6.979 6.979 7.958 -0.979 17915 1422 1 7 . 1 1 14 14 ASP N N 14 117.591 117.591 116.414 1.177 17915 1423 1 7 . 1 1 14 14 ASP C C 14 176.140 176.140 174.831 1.309 17915 1424 1 7 . 1 1 14 14 ASP CA C 14 54.522 54.522 54.557 -0.035 17915 1425 1 7 . 1 1 14 14 ASP H H 14 8.260 8.260 7.623 0.637 17915 1426 1 7 . 1 1 15 15 TYR N N 15 119.917 119.917 124.016 -4.099 17915 1427 1 7 . 1 1 15 15 TYR C C 15 172.859 172.859 175.313 -2.454 17915 1428 1 7 . 1 1 15 15 TYR CA C 15 59.661 59.661 59.582 0.079 17915 1429 1 7 . 1 1 15 15 TYR H H 15 8.580 8.580 8.770 -0.190 17915 1430 1 7 . 1 1 16 16 GLN N N 16 127.024 127.024 116.192 10.832 17915 1431 1 7 . 1 1 16 16 GLN C C 16 176.377 176.377 174.215 2.162 17915 1432 1 7 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.940 -1.274 17915 1433 1 7 . 1 1 16 16 GLN H H 16 7.450 7.450 8.703 -1.253 17915 1434 1 7 . 1 1 17 17 GLU N N 17 122.837 122.837 120.620 2.217 17915 1435 1 7 . 1 1 17 17 GLU C C 17 176.140 176.140 176.334 -0.194 17915 1436 1 7 . 1 1 17 17 GLU CA C 17 56.075 56.075 54.994 1.081 17915 1437 1 7 . 1 1 17 17 GLU H H 17 7.899 7.899 8.639 -0.740 17915 1438 1 7 . 1 1 18 18 LYS N N 18 120.622 120.622 126.007 -5.385 17915 1439 1 7 . 1 1 18 18 LYS C C 18 176.267 176.267 175.472 0.795 17915 1440 1 7 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.008 -0.763 17915 1441 1 7 . 1 1 18 18 LYS H H 18 8.649 8.649 9.159 -0.510 17915 1442 1 7 . 1 1 19 19 SER N N 19 115.184 115.184 113.519 1.665 17915 1443 1 7 . 1 1 19 19 SER CA C 19 56.824 56.824 55.894 0.930 17915 1444 1 7 . 1 1 19 19 SER H H 19 7.552 7.552 7.530 0.022 17915 1445 1 7 . 1 1 21 21 ARG N N 21 113.440 113.440 118.185 -4.745 17915 1446 1 7 . 1 1 21 21 ARG C C 21 176.638 176.638 176.633 0.005 17915 1447 1 7 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.650 -0.442 17915 1448 1 7 . 1 1 21 21 ARG H H 21 7.596 7.596 8.365 -0.769 17915 1449 1 7 . 1 1 22 22 GLU N N 22 121.392 121.392 119.097 2.295 17915 1450 1 7 . 1 1 22 22 GLU C C 22 174.500 174.500 175.173 -0.673 17915 1451 1 7 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.910 -1.558 17915 1452 1 7 . 1 1 22 22 GLU H H 22 7.746 7.746 7.769 -0.023 17915 1453 1 7 . 1 1 23 23 VAL N N 23 114.115 114.115 112.637 1.478 17915 1454 1 7 . 1 1 23 23 VAL C C 23 172.337 172.337 174.798 -2.461 17915 1455 1 7 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.482 -0.607 17915 1456 1 7 . 1 1 23 23 VAL H H 23 7.318 7.318 8.138 -0.820 17915 1457 1 7 . 1 1 24 24 THR N N 24 118.996 118.996 119.629 -0.633 17915 1458 1 7 . 1 1 24 24 THR C C 24 174.451 174.451 173.983 0.468 17915 1459 1 7 . 1 1 24 24 THR CA C 24 61.641 61.641 61.448 0.193 17915 1460 1 7 . 1 1 24 24 THR H H 24 7.324 7.324 8.330 -1.006 17915 1461 1 7 . 1 1 25 25 MET N N 25 121.901 121.901 124.550 -2.649 17915 1462 1 7 . 1 1 25 25 MET C C 25 173.931 173.931 174.826 -0.895 17915 1463 1 7 . 1 1 25 25 MET CA C 25 54.389 54.389 53.950 0.438 17915 1464 1 7 . 1 1 25 25 MET H H 25 9.432 9.432 8.424 1.008 17915 1465 1 7 . 1 1 26 26 LYS N N 26 124.169 124.169 120.046 4.123 17915 1466 1 7 . 1 1 26 26 LYS C C 26 175.002 175.002 176.669 -1.667 17915 1467 1 7 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.380 -1.714 17915 1468 1 7 . 1 1 26 26 LYS H H 26 8.634 8.634 8.493 0.141 17915 1469 1 7 . 1 1 27 27 LYS N N 27 122.603 122.603 122.362 0.241 17915 1470 1 7 . 1 1 27 27 LYS C C 27 177.318 177.318 177.221 0.097 17915 1471 1 7 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.454 0.190 17915 1472 1 7 . 1 1 27 27 LYS H H 27 8.919 8.919 8.251 0.668 17915 1473 1 7 . 1 1 28 28 GLY N N 28 115.585 115.585 115.099 0.486 17915 1474 1 7 . 1 1 28 28 GLY C C 28 174.193 174.193 174.474 -0.281 17915 1475 1 7 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.661 0.227 17915 1476 1 7 . 1 1 28 28 GLY H H 28 8.732 8.732 8.682 0.050 17915 1477 1 7 . 1 1 29 29 ASP N N 29 121.770 121.770 121.284 0.486 17915 1478 1 7 . 1 1 29 29 ASP C C 29 174.281 174.281 175.764 -1.483 17915 1479 1 7 . 1 1 29 29 ASP CA C 29 55.486 55.486 55.225 0.261 17915 1480 1 7 . 1 1 29 29 ASP H H 29 8.388 8.388 7.827 0.561 17915 1481 1 7 . 1 1 30 30 ILE N N 30 120.469 120.469 119.543 0.926 17915 1482 1 7 . 1 1 30 30 ILE C C 30 176.356 176.356 174.644 1.712 17915 1483 1 7 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.650 0.599 17915 1484 1 7 . 1 1 30 30 ILE H H 30 8.033 8.033 8.220 -0.187 17915 1485 1 7 . 1 1 31 31 LEU N N 31 127.129 127.129 126.625 0.504 17915 1486 1 7 . 1 1 31 31 LEU C C 31 175.745 175.745 175.957 -0.212 17915 1487 1 7 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.357 0.550 17915 1488 1 7 . 1 1 31 31 LEU H H 31 9.223 9.223 9.082 0.141 17915 1489 1 7 . 1 1 32 32 THR N N 32 117.055 117.055 116.355 0.700 17915 1490 1 7 . 1 1 32 32 THR C C 32 173.844 173.844 173.688 0.156 17915 1491 1 7 . 1 1 32 32 THR CA C 32 63.247 63.247 61.089 2.158 17915 1492 1 7 . 1 1 32 32 THR H H 32 8.360 8.360 8.351 0.009 17915 1493 1 7 . 1 1 33 33 LEU N N 33 128.815 128.815 128.027 0.788 17915 1494 1 7 . 1 1 33 33 LEU C C 33 174.718 174.718 175.965 -1.247 17915 1495 1 7 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.193 0.677 17915 1496 1 7 . 1 1 33 33 LEU H H 33 8.937 8.937 8.210 0.727 17915 1497 1 7 . 1 1 34 34 LEU N N 34 126.230 126.230 127.308 -1.078 17915 1498 1 7 . 1 1 34 34 LEU C C 34 177.689 177.689 176.221 1.468 17915 1499 1 7 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.409 -0.191 17915 1500 1 7 . 1 1 34 34 LEU H H 34 8.929 8.929 8.284 0.645 17915 1501 1 7 . 1 1 35 35 ASN N N 35 113.879 113.879 115.141 -1.262 17915 1502 1 7 . 1 1 35 35 ASN C C 35 174.565 174.565 173.481 1.084 17915 1503 1 7 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.077 1.499 17915 1504 1 7 . 1 1 35 35 ASN H H 35 7.489 7.489 7.557 -0.068 17915 1505 1 7 . 1 1 36 36 SER N N 36 123.684 123.684 120.929 2.755 17915 1506 1 7 . 1 1 36 36 SER C C 36 173.503 173.503 175.259 -1.756 17915 1507 1 7 . 1 1 36 36 SER CA C 36 56.904 56.904 57.233 -0.329 17915 1508 1 7 . 1 1 36 36 SER H H 36 9.086 9.086 8.706 0.380 17915 1509 1 7 . 1 1 37 37 THR N N 37 115.012 115.012 117.749 -2.737 17915 1510 1 7 . 1 1 37 37 THR C C 37 175.417 175.417 175.537 -0.120 17915 1511 1 7 . 1 1 37 37 THR CA C 37 65.521 65.521 64.565 0.956 17915 1512 1 7 . 1 1 37 37 THR H H 37 8.071 8.071 8.277 -0.206 17915 1513 1 7 . 1 1 38 38 ASN N N 38 122.517 122.517 121.047 1.470 17915 1514 1 7 . 1 1 38 38 ASN C C 38 174.696 174.696 175.408 -0.712 17915 1515 1 7 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.424 1.055 17915 1516 1 7 . 1 1 38 38 ASN H H 38 8.595 8.595 8.255 0.340 17915 1517 1 7 . 1 1 39 39 LYS N N 39 120.851 120.851 120.619 0.232 17915 1518 1 7 . 1 1 39 39 LYS C C 39 176.444 176.444 176.430 0.014 17915 1519 1 7 . 1 1 39 39 LYS CA C 39 58.403 58.403 57.661 0.742 17915 1520 1 7 . 1 1 39 39 LYS H H 39 8.416 8.416 8.577 -0.161 17915 1521 1 7 . 1 1 40 40 ASP N N 40 114.427 114.427 118.733 -4.306 17915 1522 1 7 . 1 1 40 40 ASP C C 40 176.960 176.960 175.067 1.893 17915 1523 1 7 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.683 -0.331 17915 1524 1 7 . 1 1 40 40 ASP H H 40 8.085 8.085 7.954 0.131 17915 1525 1 7 . 1 1 41 41 TRP N N 41 122.708 122.708 119.094 3.614 17915 1526 1 7 . 1 1 41 41 TRP C C 41 174.303 174.303 174.415 -0.112 17915 1527 1 7 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.452 -0.244 17915 1528 1 7 . 1 1 41 41 TRP H H 41 8.096 8.096 7.251 0.845 17915 1529 1 7 . 1 1 42 42 TRP N N 42 124.707 124.707 123.328 1.379 17915 1530 1 7 . 1 1 42 42 TRP C C 42 174.303 174.303 174.918 -0.615 17915 1531 1 7 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.144 -1.157 17915 1532 1 7 . 1 1 42 42 TRP H H 42 9.245 9.245 8.137 1.108 17915 1533 1 7 . 1 1 43 43 LYS N N 43 124.005 124.005 120.680 3.325 17915 1534 1 7 . 1 1 43 43 LYS C C 43 175.482 175.482 174.437 1.045 17915 1535 1 7 . 1 1 43 43 LYS CA C 43 55.379 55.379 54.911 0.468 17915 1536 1 7 . 1 1 43 43 LYS H H 43 8.783 8.783 8.356 0.427 17915 1537 1 7 . 1 1 44 44 VAL N N 44 122.139 122.139 118.963 3.176 17915 1538 1 7 . 1 1 44 44 VAL C C 44 173.472 173.472 174.275 -0.803 17915 1539 1 7 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.551 -0.479 17915 1540 1 7 . 1 1 44 44 VAL H H 44 9.287 9.287 8.513 0.774 17915 1541 1 7 . 1 1 45 45 GLU N N 45 118.524 118.524 120.484 -1.960 17915 1542 1 7 . 1 1 45 45 GLU C C 45 174.827 174.827 174.358 0.469 17915 1543 1 7 . 1 1 45 45 GLU CA C 45 54.174 54.174 55.333 -1.159 17915 1544 1 7 . 1 1 45 45 GLU H H 45 8.566 8.566 7.972 0.594 17915 1545 1 7 . 1 1 46 46 VAL N N 46 124.904 124.904 122.433 2.471 17915 1546 1 7 . 1 1 46 46 VAL C C 46 174.608 174.608 174.675 -0.067 17915 1547 1 7 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.270 -0.619 17915 1548 1 7 . 1 1 46 46 VAL H H 46 8.774 8.774 7.847 0.927 17915 1549 1 7 . 1 1 47 47 ASN N N 47 126.530 126.530 125.277 1.253 17915 1550 1 7 . 1 1 47 47 ASN C C 47 174.259 174.259 174.411 -0.152 17915 1551 1 7 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.111 1.134 17915 1552 1 7 . 1 1 47 47 ASN H H 47 9.356 9.356 8.608 0.748 17915 1553 1 7 . 1 1 48 48 ASP N N 48 112.420 112.420 115.255 -2.835 17915 1554 1 7 . 1 1 48 48 ASP C C 48 174.521 174.521 174.784 -0.263 17915 1555 1 7 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.143 -0.460 17915 1556 1 7 . 1 1 48 48 ASP H H 48 8.628 8.628 8.354 0.274 17915 1557 1 7 . 1 1 49 49 ARG N N 49 120.379 120.379 117.885 2.494 17915 1558 1 7 . 1 1 49 49 ARG C C 49 174.477 174.477 174.697 -0.220 17915 1559 1 7 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.885 0.414 17915 1560 1 7 . 1 1 49 49 ARG H H 49 8.069 8.069 8.042 0.027 17915 1561 1 7 . 1 1 50 50 GLN N N 50 118.647 118.647 118.456 0.191 17915 1562 1 7 . 1 1 50 50 GLN C C 50 175.963 175.963 174.567 1.396 17915 1563 1 7 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.207 -0.782 17915 1564 1 7 . 1 1 50 50 GLN H H 50 8.432 8.432 8.401 0.031 17915 1565 1 7 . 1 1 51 51 GLY N N 51 107.028 107.028 109.127 -2.099 17915 1566 1 7 . 1 1 51 51 GLY C C 51 170.479 170.479 172.751 -2.272 17915 1567 1 7 . 1 1 51 51 GLY CA C 51 45.638 45.638 44.517 1.121 17915 1568 1 7 . 1 1 51 51 GLY H H 51 8.534 8.534 8.145 0.389 17915 1569 1 7 . 1 1 52 52 PHE N N 52 119.030 119.030 119.653 -0.623 17915 1570 1 7 . 1 1 52 52 PHE C C 52 175.635 175.635 173.372 2.263 17915 1571 1 7 . 1 1 52 52 PHE CA C 52 58.724 58.724 58.487 0.237 17915 1572 1 7 . 1 1 52 52 PHE H H 52 9.098 9.098 8.719 0.379 17915 1573 1 7 . 1 1 53 53 VAL N N 53 110.897 110.897 125.574 -14.677 17915 1574 1 7 . 1 1 53 53 VAL CA C 53 58.108 58.108 59.029 -0.921 17915 1575 1 7 . 1 1 53 53 VAL H H 53 8.942 8.942 8.177 0.765 17915 1576 1 7 . 1 1 55 55 ALA N N 55 129.055 129.055 128.311 0.744 17915 1577 1 7 . 1 1 55 55 ALA C C 55 178.565 178.565 179.074 -0.509 17915 1578 1 7 . 1 1 55 55 ALA CA C 55 54.629 54.629 55.077 -0.448 17915 1579 1 7 . 1 1 55 55 ALA H H 55 7.355 7.355 8.142 -0.787 17915 1580 1 7 . 1 1 56 56 ALA N N 56 113.282 113.282 119.589 -6.307 17915 1581 1 7 . 1 1 56 56 ALA C C 56 178.214 178.214 178.231 -0.017 17915 1582 1 7 . 1 1 56 56 ALA CA C 56 52.943 52.943 54.173 -1.230 17915 1583 1 7 . 1 1 56 56 ALA H H 56 7.750 7.750 8.383 -0.633 17915 1584 1 7 . 1 1 57 57 TYR N N 57 116.083 116.083 115.427 0.656 17915 1585 1 7 . 1 1 57 57 TYR C C 57 174.565 174.565 173.926 0.639 17915 1586 1 7 . 1 1 57 57 TYR CA C 57 56.422 56.422 57.985 -1.563 17915 1587 1 7 . 1 1 57 57 TYR H H 57 7.611 7.611 7.924 -0.313 17915 1588 1 7 . 1 1 58 58 VAL N N 58 110.965 110.965 117.132 -6.167 17915 1589 1 7 . 1 1 58 58 VAL C C 58 173.647 173.647 174.798 -1.151 17915 1590 1 7 . 1 1 58 58 VAL CA C 58 58.242 58.242 60.711 -2.469 17915 1591 1 7 . 1 1 58 58 VAL H H 58 7.301 7.301 7.812 -0.511 17915 1592 1 7 . 1 1 59 59 LYS N N 59 118.586 118.586 123.589 -5.003 17915 1593 1 7 . 1 1 59 59 LYS C C 59 176.160 176.160 174.970 1.190 17915 1594 1 7 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.436 -0.395 17915 1595 1 7 . 1 1 59 59 LYS H H 59 8.515 8.515 8.393 0.122 17915 1596 1 7 . 1 1 60 60 LYS N N 60 125.734 125.734 125.201 0.533 17915 1597 1 7 . 1 1 60 60 LYS C C 60 176.793 176.793 177.055 -0.262 17915 1598 1 7 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.335 3.282 17915 1599 1 7 . 1 1 60 60 LYS H H 60 9.135 9.135 8.708 0.427 17915 1600 1 7 . 1 1 61 61 LEU N N 61 125.061 125.061 122.430 2.631 17915 1601 1 7 . 1 1 61 61 LEU C C 61 174.106 174.106 175.176 -1.070 17915 1602 1 7 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.592 -0.615 17915 1603 1 7 . 1 1 61 61 LEU H H 61 8.384 8.384 8.938 -0.554 17915 1604 1 8 . 1 1 2 2 ASP N N 2 123.220 123.220 121.521 1.699 17915 1605 1 8 . 1 1 2 2 ASP C C 2 175.703 175.703 175.166 0.537 17915 1606 1 8 . 1 1 2 2 ASP CA C 2 54.041 54.041 53.720 0.321 17915 1607 1 8 . 1 1 2 2 ASP H H 2 8.738 8.738 8.586 0.152 17915 1608 1 8 . 1 1 3 3 GLU N N 3 121.895 121.895 118.465 3.430 17915 1609 1 8 . 1 1 3 3 GLU C C 3 176.480 176.480 175.530 0.950 17915 1610 1 8 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.162 -0.034 17915 1611 1 8 . 1 1 3 3 GLU H H 3 8.570 8.570 8.564 0.006 17915 1612 1 8 . 1 1 4 4 THR N N 4 114.607 114.607 114.379 0.228 17915 1613 1 8 . 1 1 4 4 THR C C 4 175.417 175.417 174.215 1.202 17915 1614 1 8 . 1 1 4 4 THR CA C 4 62.685 62.685 62.089 0.596 17915 1615 1 8 . 1 1 4 4 THR H H 4 8.176 8.176 8.600 -0.424 17915 1616 1 8 . 1 1 5 5 GLY N N 5 111.430 111.430 112.277 -0.847 17915 1617 1 8 . 1 1 5 5 GLY C C 5 173.777 173.777 172.598 1.179 17915 1618 1 8 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.706 -0.145 17915 1619 1 8 . 1 1 5 5 GLY H H 5 8.344 8.344 7.861 0.483 17915 1620 1 8 . 1 1 6 6 LYS N N 6 119.850 119.850 124.678 -4.828 17915 1621 1 8 . 1 1 6 6 LYS C C 6 176.049 176.049 176.569 -0.520 17915 1622 1 8 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.504 -1.590 17915 1623 1 8 . 1 1 6 6 LYS H H 6 7.903 7.903 8.177 -0.274 17915 1624 1 8 . 1 1 7 7 GLU N N 7 123.025 123.025 120.753 2.272 17915 1625 1 8 . 1 1 7 7 GLU C C 7 174.172 174.172 174.250 -0.078 17915 1626 1 8 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.399 -1.940 17915 1627 1 8 . 1 1 7 7 GLU H H 7 8.562 8.562 8.801 -0.239 17915 1628 1 8 . 1 1 8 8 LEU N N 8 123.147 123.147 116.605 6.542 17915 1629 1 8 . 1 1 8 8 LEU C C 8 177.495 177.495 174.633 2.862 17915 1630 1 8 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.602 -0.177 17915 1631 1 8 . 1 1 8 8 LEU H H 8 8.292 8.292 7.332 0.960 17915 1632 1 8 . 1 1 9 9 VAL N N 9 111.799 111.799 116.689 -4.890 17915 1633 1 8 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.605 -1.711 17915 1634 1 8 . 1 1 9 9 VAL H H 9 9.051 9.051 8.013 1.038 17915 1635 1 8 . 1 1 10 10 LEU N N 10 123.127 123.127 126.187 -3.060 17915 1636 1 8 . 1 1 10 10 LEU C C 10 176.729 176.729 175.467 1.262 17915 1637 1 8 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.512 -0.023 17915 1638 1 8 . 1 1 10 10 LEU H H 10 8.864 8.864 8.542 0.322 17915 1639 1 8 . 1 1 11 11 ALA N N 11 126.907 126.907 124.719 2.188 17915 1640 1 8 . 1 1 11 11 ALA C C 11 178.406 178.406 177.249 1.157 17915 1641 1 8 . 1 1 11 11 ALA CA C 11 52.515 52.515 52.111 0.404 17915 1642 1 8 . 1 1 11 11 ALA H H 11 8.988 8.988 8.669 0.319 17915 1643 1 8 . 1 1 12 12 LEU N N 12 127.694 127.694 125.363 2.331 17915 1644 1 8 . 1 1 12 12 LEU C C 12 175.046 175.046 176.046 -1.000 17915 1645 1 8 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.346 -0.619 17915 1646 1 8 . 1 1 12 12 LEU H H 12 9.136 9.136 9.026 0.110 17915 1647 1 8 . 1 1 13 13 TYR N N 13 111.415 111.415 117.294 -5.879 17915 1648 1 8 . 1 1 13 13 TYR C C 13 173.844 173.844 173.304 0.540 17915 1649 1 8 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.378 -1.722 17915 1650 1 8 . 1 1 13 13 TYR H H 13 6.979 6.979 7.689 -0.710 17915 1651 1 8 . 1 1 14 14 ASP N N 14 117.591 117.591 123.811 -6.220 17915 1652 1 8 . 1 1 14 14 ASP C C 14 176.140 176.140 174.690 1.450 17915 1653 1 8 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.226 -0.704 17915 1654 1 8 . 1 1 14 14 ASP H H 14 8.260 8.260 8.199 0.061 17915 1655 1 8 . 1 1 15 15 TYR N N 15 119.917 119.917 123.641 -3.724 17915 1656 1 8 . 1 1 15 15 TYR C C 15 172.859 172.859 173.627 -0.768 17915 1657 1 8 . 1 1 15 15 TYR CA C 15 59.661 59.661 57.981 1.680 17915 1658 1 8 . 1 1 15 15 TYR H H 15 8.580 8.580 8.170 0.410 17915 1659 1 8 . 1 1 16 16 GLN N N 16 127.024 127.024 121.898 5.126 17915 1660 1 8 . 1 1 16 16 GLN C C 16 176.377 176.377 175.162 1.215 17915 1661 1 8 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.242 -1.576 17915 1662 1 8 . 1 1 16 16 GLN H H 16 7.450 7.450 8.417 -0.967 17915 1663 1 8 . 1 1 17 17 GLU N N 17 122.837 122.837 122.951 -0.114 17915 1664 1 8 . 1 1 17 17 GLU C C 17 176.140 176.140 176.682 -0.542 17915 1665 1 8 . 1 1 17 17 GLU CA C 17 56.075 56.075 55.987 0.088 17915 1666 1 8 . 1 1 17 17 GLU H H 17 7.899 7.899 8.676 -0.777 17915 1667 1 8 . 1 1 18 18 LYS N N 18 120.622 120.622 118.976 1.646 17915 1668 1 8 . 1 1 18 18 LYS C C 18 176.267 176.267 175.770 0.497 17915 1669 1 8 . 1 1 18 18 LYS CA C 18 55.245 55.245 55.810 -0.565 17915 1670 1 8 . 1 1 18 18 LYS H H 18 8.649 8.649 8.509 0.140 17915 1671 1 8 . 1 1 19 19 SER N N 19 115.184 115.184 116.071 -0.887 17915 1672 1 8 . 1 1 19 19 SER CA C 19 56.824 56.824 57.422 -0.598 17915 1673 1 8 . 1 1 19 19 SER H H 19 7.552 7.552 7.841 -0.289 17915 1674 1 8 . 1 1 21 21 ARG N N 21 113.440 113.440 117.219 -3.779 17915 1675 1 8 . 1 1 21 21 ARG C C 21 176.638 176.638 175.874 0.764 17915 1676 1 8 . 1 1 21 21 ARG CA C 21 56.208 56.208 55.448 0.760 17915 1677 1 8 . 1 1 21 21 ARG H H 21 7.596 7.596 7.827 -0.231 17915 1678 1 8 . 1 1 22 22 GLU N N 22 121.392 121.392 119.332 2.060 17915 1679 1 8 . 1 1 22 22 GLU C C 22 174.500 174.500 174.546 -0.046 17915 1680 1 8 . 1 1 22 22 GLU CA C 22 55.352 55.352 57.028 -1.676 17915 1681 1 8 . 1 1 22 22 GLU H H 22 7.746 7.746 7.890 -0.144 17915 1682 1 8 . 1 1 23 23 VAL N N 23 114.115 114.115 118.767 -4.652 17915 1683 1 8 . 1 1 23 23 VAL C C 23 172.337 172.337 174.394 -2.057 17915 1684 1 8 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.486 -0.611 17915 1685 1 8 . 1 1 23 23 VAL H H 23 7.318 7.318 8.164 -0.846 17915 1686 1 8 . 1 1 24 24 THR N N 24 118.996 118.996 117.890 1.106 17915 1687 1 8 . 1 1 24 24 THR C C 24 174.451 174.451 173.402 1.049 17915 1688 1 8 . 1 1 24 24 THR CA C 24 61.641 61.641 61.542 0.098 17915 1689 1 8 . 1 1 24 24 THR H H 24 7.324 7.324 8.305 -0.981 17915 1690 1 8 . 1 1 25 25 MET N N 25 121.901 121.901 123.937 -2.036 17915 1691 1 8 . 1 1 25 25 MET C C 25 173.931 173.931 173.983 -0.052 17915 1692 1 8 . 1 1 25 25 MET CA C 25 54.389 54.389 55.268 -0.879 17915 1693 1 8 . 1 1 25 25 MET H H 25 9.432 9.432 8.227 1.205 17915 1694 1 8 . 1 1 26 26 LYS N N 26 124.169 124.169 123.626 0.543 17915 1695 1 8 . 1 1 26 26 LYS C C 26 175.002 175.002 175.949 -0.947 17915 1696 1 8 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.877 -1.211 17915 1697 1 8 . 1 1 26 26 LYS H H 26 8.634 8.634 8.567 0.067 17915 1698 1 8 . 1 1 27 27 LYS N N 27 122.603 122.603 123.519 -0.916 17915 1699 1 8 . 1 1 27 27 LYS C C 27 177.318 177.318 177.141 0.177 17915 1700 1 8 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.891 0.753 17915 1701 1 8 . 1 1 27 27 LYS H H 27 8.919 8.919 8.902 0.017 17915 1702 1 8 . 1 1 28 28 GLY N N 28 115.585 115.585 113.311 2.274 17915 1703 1 8 . 1 1 28 28 GLY C C 28 174.193 174.193 174.708 -0.515 17915 1704 1 8 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.860 0.028 17915 1705 1 8 . 1 1 28 28 GLY H H 28 8.732 8.732 8.852 -0.120 17915 1706 1 8 . 1 1 29 29 ASP N N 29 121.770 121.770 122.270 -0.500 17915 1707 1 8 . 1 1 29 29 ASP C C 29 174.281 174.281 175.609 -1.328 17915 1708 1 8 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.897 0.589 17915 1709 1 8 . 1 1 29 29 ASP H H 29 8.388 8.388 7.876 0.512 17915 1710 1 8 . 1 1 30 30 ILE N N 30 120.469 120.469 116.298 4.171 17915 1711 1 8 . 1 1 30 30 ILE C C 30 176.356 176.356 174.704 1.652 17915 1712 1 8 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.263 0.986 17915 1713 1 8 . 1 1 30 30 ILE H H 30 8.033 8.033 8.030 0.003 17915 1714 1 8 . 1 1 31 31 LEU N N 31 127.129 127.129 125.619 1.510 17915 1715 1 8 . 1 1 31 31 LEU C C 31 175.745 175.745 176.476 -0.731 17915 1716 1 8 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.277 0.630 17915 1717 1 8 . 1 1 31 31 LEU H H 31 9.223 9.223 8.924 0.299 17915 1718 1 8 . 1 1 32 32 THR N N 32 117.055 117.055 119.762 -2.707 17915 1719 1 8 . 1 1 32 32 THR C C 32 173.844 173.844 173.805 0.039 17915 1720 1 8 . 1 1 32 32 THR CA C 32 63.247 63.247 61.929 1.318 17915 1721 1 8 . 1 1 32 32 THR H H 32 8.360 8.360 8.637 -0.277 17915 1722 1 8 . 1 1 33 33 LEU N N 33 128.815 128.815 127.884 0.931 17915 1723 1 8 . 1 1 33 33 LEU C C 33 174.718 174.718 176.681 -1.963 17915 1724 1 8 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.602 0.268 17915 1725 1 8 . 1 1 33 33 LEU H H 33 8.937 8.937 8.375 0.562 17915 1726 1 8 . 1 1 34 34 LEU N N 34 126.230 126.230 126.765 -0.535 17915 1727 1 8 . 1 1 34 34 LEU C C 34 177.689 177.689 176.056 1.633 17915 1728 1 8 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.429 -0.211 17915 1729 1 8 . 1 1 34 34 LEU H H 34 8.929 8.929 8.463 0.466 17915 1730 1 8 . 1 1 35 35 ASN N N 35 113.879 113.879 115.892 -2.013 17915 1731 1 8 . 1 1 35 35 ASN C C 35 174.565 174.565 172.371 2.194 17915 1732 1 8 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.533 1.043 17915 1733 1 8 . 1 1 35 35 ASN H H 35 7.489 7.489 7.624 -0.135 17915 1734 1 8 . 1 1 36 36 SER N N 36 123.684 123.684 118.405 5.279 17915 1735 1 8 . 1 1 36 36 SER C C 36 173.503 173.503 173.680 -0.177 17915 1736 1 8 . 1 1 36 36 SER CA C 36 56.904 56.904 57.104 -0.200 17915 1737 1 8 . 1 1 36 36 SER H H 36 9.086 9.086 8.439 0.647 17915 1738 1 8 . 1 1 37 37 THR N N 37 115.012 115.012 120.096 -5.084 17915 1739 1 8 . 1 1 37 37 THR C C 37 175.417 175.417 174.464 0.953 17915 1740 1 8 . 1 1 37 37 THR CA C 37 65.521 65.521 62.495 3.026 17915 1741 1 8 . 1 1 37 37 THR H H 37 8.071 8.071 8.383 -0.312 17915 1742 1 8 . 1 1 38 38 ASN N N 38 122.517 122.517 118.943 3.574 17915 1743 1 8 . 1 1 38 38 ASN C C 38 174.696 174.696 174.105 0.591 17915 1744 1 8 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.398 1.081 17915 1745 1 8 . 1 1 38 38 ASN H H 38 8.595 8.595 7.731 0.864 17915 1746 1 8 . 1 1 39 39 LYS N N 39 120.851 120.851 119.717 1.134 17915 1747 1 8 . 1 1 39 39 LYS C C 39 176.444 176.444 177.977 -1.533 17915 1748 1 8 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.881 -0.478 17915 1749 1 8 . 1 1 39 39 LYS H H 39 8.416 8.416 8.631 -0.215 17915 1750 1 8 . 1 1 40 40 ASP N N 40 114.427 114.427 117.214 -2.787 17915 1751 1 8 . 1 1 40 40 ASP C C 40 176.960 176.960 176.379 0.581 17915 1752 1 8 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.761 -0.409 17915 1753 1 8 . 1 1 40 40 ASP H H 40 8.085 8.085 8.354 -0.269 17915 1754 1 8 . 1 1 41 41 TRP N N 41 122.708 122.708 121.875 0.833 17915 1755 1 8 . 1 1 41 41 TRP C C 41 174.303 174.303 174.585 -0.282 17915 1756 1 8 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.401 -0.193 17915 1757 1 8 . 1 1 41 41 TRP H H 41 8.096 8.096 7.760 0.336 17915 1758 1 8 . 1 1 42 42 TRP N N 42 124.707 124.707 127.252 -2.545 17915 1759 1 8 . 1 1 42 42 TRP C C 42 174.303 174.303 174.578 -0.275 17915 1760 1 8 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.699 -1.712 17915 1761 1 8 . 1 1 42 42 TRP H H 42 9.245 9.245 7.887 1.358 17915 1762 1 8 . 1 1 43 43 LYS N N 43 124.005 124.005 122.860 1.145 17915 1763 1 8 . 1 1 43 43 LYS C C 43 175.482 175.482 174.218 1.264 17915 1764 1 8 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.422 -0.043 17915 1765 1 8 . 1 1 43 43 LYS H H 43 8.783 8.783 8.012 0.771 17915 1766 1 8 . 1 1 44 44 VAL N N 44 122.139 122.139 124.653 -2.514 17915 1767 1 8 . 1 1 44 44 VAL C C 44 173.472 173.472 173.611 -0.139 17915 1768 1 8 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.730 -0.658 17915 1769 1 8 . 1 1 44 44 VAL H H 44 9.287 9.287 8.594 0.693 17915 1770 1 8 . 1 1 45 45 GLU N N 45 118.524 118.524 126.768 -8.244 17915 1771 1 8 . 1 1 45 45 GLU C C 45 174.827 174.827 174.635 0.192 17915 1772 1 8 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.892 -0.718 17915 1773 1 8 . 1 1 45 45 GLU H H 45 8.566 8.566 8.048 0.518 17915 1774 1 8 . 1 1 46 46 VAL N N 46 124.904 124.904 124.724 0.180 17915 1775 1 8 . 1 1 46 46 VAL C C 46 174.608 174.608 175.363 -0.755 17915 1776 1 8 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.770 -1.119 17915 1777 1 8 . 1 1 46 46 VAL H H 46 8.774 8.774 8.360 0.414 17915 1778 1 8 . 1 1 47 47 ASN N N 47 126.530 126.530 127.785 -1.255 17915 1779 1 8 . 1 1 47 47 ASN C C 47 174.259 174.259 174.309 -0.050 17915 1780 1 8 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.118 1.127 17915 1781 1 8 . 1 1 47 47 ASN H H 47 9.356 9.356 9.219 0.137 17915 1782 1 8 . 1 1 48 48 ASP N N 48 112.420 112.420 114.586 -2.166 17915 1783 1 8 . 1 1 48 48 ASP C C 48 174.521 174.521 175.429 -0.908 17915 1784 1 8 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.530 -0.847 17915 1785 1 8 . 1 1 48 48 ASP H H 48 8.628 8.628 8.312 0.316 17915 1786 1 8 . 1 1 49 49 ARG N N 49 120.379 120.379 118.325 2.054 17915 1787 1 8 . 1 1 49 49 ARG C C 49 174.477 174.477 175.254 -0.777 17915 1788 1 8 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.883 0.415 17915 1789 1 8 . 1 1 49 49 ARG H H 49 8.069 8.069 7.845 0.224 17915 1790 1 8 . 1 1 50 50 GLN N N 50 118.647 118.647 119.400 -0.753 17915 1791 1 8 . 1 1 50 50 GLN C C 50 175.963 175.963 175.299 0.664 17915 1792 1 8 . 1 1 50 50 GLN CA C 50 53.425 53.425 55.031 -1.606 17915 1793 1 8 . 1 1 50 50 GLN H H 50 8.432 8.432 8.494 -0.062 17915 1794 1 8 . 1 1 51 51 GLY N N 51 107.028 107.028 108.595 -1.567 17915 1795 1 8 . 1 1 51 51 GLY C C 51 170.479 170.479 171.991 -1.512 17915 1796 1 8 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.505 0.133 17915 1797 1 8 . 1 1 51 51 GLY H H 51 8.534 8.534 8.490 0.044 17915 1798 1 8 . 1 1 52 52 PHE N N 52 119.030 119.030 119.434 -0.404 17915 1799 1 8 . 1 1 52 52 PHE C C 52 175.635 175.635 174.344 1.291 17915 1800 1 8 . 1 1 52 52 PHE CA C 52 58.724 58.724 56.876 1.848 17915 1801 1 8 . 1 1 52 52 PHE H H 52 9.098 9.098 8.130 0.968 17915 1802 1 8 . 1 1 53 53 VAL N N 53 110.897 110.897 124.743 -13.846 17915 1803 1 8 . 1 1 53 53 VAL CA C 53 58.108 58.108 58.263 -0.155 17915 1804 1 8 . 1 1 53 53 VAL H H 53 8.942 8.942 7.845 1.097 17915 1805 1 8 . 1 1 55 55 ALA N N 55 129.055 129.055 128.454 0.601 17915 1806 1 8 . 1 1 55 55 ALA C C 55 178.565 178.565 178.549 0.016 17915 1807 1 8 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.688 -0.059 17915 1808 1 8 . 1 1 55 55 ALA H H 55 7.355 7.355 8.313 -0.958 17915 1809 1 8 . 1 1 56 56 ALA N N 56 113.282 113.282 118.943 -5.661 17915 1810 1 8 . 1 1 56 56 ALA C C 56 178.214 178.214 178.095 0.119 17915 1811 1 8 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.987 -1.044 17915 1812 1 8 . 1 1 56 56 ALA H H 56 7.750 7.750 8.126 -0.376 17915 1813 1 8 . 1 1 57 57 TYR N N 57 116.083 116.083 117.335 -1.252 17915 1814 1 8 . 1 1 57 57 TYR C C 57 174.565 174.565 173.915 0.650 17915 1815 1 8 . 1 1 57 57 TYR CA C 57 56.422 56.422 57.384 -0.962 17915 1816 1 8 . 1 1 57 57 TYR H H 57 7.611 7.611 7.677 -0.066 17915 1817 1 8 . 1 1 58 58 VAL N N 58 110.965 110.965 116.880 -5.915 17915 1818 1 8 . 1 1 58 58 VAL C C 58 173.647 173.647 173.693 -0.046 17915 1819 1 8 . 1 1 58 58 VAL CA C 58 58.242 58.242 60.274 -2.032 17915 1820 1 8 . 1 1 58 58 VAL H H 58 7.301 7.301 7.001 0.300 17915 1821 1 8 . 1 1 59 59 LYS N N 59 118.586 118.586 124.967 -6.381 17915 1822 1 8 . 1 1 59 59 LYS C C 59 176.160 176.160 175.009 1.151 17915 1823 1 8 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.030 -0.989 17915 1824 1 8 . 1 1 59 59 LYS H H 59 8.515 8.515 8.104 0.411 17915 1825 1 8 . 1 1 60 60 LYS N N 60 125.734 125.734 124.370 1.364 17915 1826 1 8 . 1 1 60 60 LYS C C 60 176.793 176.793 176.460 0.333 17915 1827 1 8 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.197 3.421 17915 1828 1 8 . 1 1 60 60 LYS H H 60 9.135 9.135 8.662 0.473 17915 1829 1 8 . 1 1 61 61 LEU N N 61 125.061 125.061 122.053 3.008 17915 1830 1 8 . 1 1 61 61 LEU C C 61 174.106 174.106 175.606 -1.500 17915 1831 1 8 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.470 -0.493 17915 1832 1 8 . 1 1 61 61 LEU H H 61 8.384 8.384 8.906 -0.522 17915 1833 1 9 . 1 1 2 2 ASP N N 2 123.220 123.220 121.277 1.943 17915 1834 1 9 . 1 1 2 2 ASP C C 2 175.703 175.703 174.792 0.911 17915 1835 1 9 . 1 1 2 2 ASP CA C 2 54.041 54.041 53.772 0.269 17915 1836 1 9 . 1 1 2 2 ASP H H 2 8.738 8.738 8.430 0.308 17915 1837 1 9 . 1 1 3 3 GLU N N 3 121.895 121.895 117.673 4.222 17915 1838 1 9 . 1 1 3 3 GLU C C 3 176.480 176.480 174.439 2.041 17915 1839 1 9 . 1 1 3 3 GLU CA C 3 56.128 56.128 57.324 -1.196 17915 1840 1 9 . 1 1 3 3 GLU H H 3 8.570 8.570 8.647 -0.077 17915 1841 1 9 . 1 1 4 4 THR N N 4 114.607 114.607 110.404 4.203 17915 1842 1 9 . 1 1 4 4 THR C C 4 175.417 175.417 174.030 1.387 17915 1843 1 9 . 1 1 4 4 THR CA C 4 62.685 62.685 60.986 1.699 17915 1844 1 9 . 1 1 4 4 THR H H 4 8.176 8.176 7.703 0.473 17915 1845 1 9 . 1 1 5 5 GLY N N 5 111.430 111.430 108.703 2.727 17915 1846 1 9 . 1 1 5 5 GLY C C 5 173.777 173.777 173.097 0.680 17915 1847 1 9 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.338 0.222 17915 1848 1 9 . 1 1 5 5 GLY H H 5 8.344 8.344 8.175 0.169 17915 1849 1 9 . 1 1 6 6 LYS N N 6 119.850 119.850 121.916 -2.066 17915 1850 1 9 . 1 1 6 6 LYS C C 6 176.049 176.049 176.295 -0.246 17915 1851 1 9 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.492 0.422 17915 1852 1 9 . 1 1 6 6 LYS H H 6 7.903 7.903 7.833 0.070 17915 1853 1 9 . 1 1 7 7 GLU N N 7 123.025 123.025 119.567 3.458 17915 1854 1 9 . 1 1 7 7 GLU C C 7 174.172 174.172 174.588 -0.416 17915 1855 1 9 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.830 -2.371 17915 1856 1 9 . 1 1 7 7 GLU H H 7 8.562 8.562 8.768 -0.206 17915 1857 1 9 . 1 1 8 8 LEU N N 8 123.147 123.147 116.446 6.701 17915 1858 1 9 . 1 1 8 8 LEU C C 8 177.495 177.495 175.517 1.978 17915 1859 1 9 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.486 -0.061 17915 1860 1 9 . 1 1 8 8 LEU H H 8 8.292 8.292 7.379 0.913 17915 1861 1 9 . 1 1 9 9 VAL N N 9 111.799 111.799 115.435 -3.636 17915 1862 1 9 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.718 -1.823 17915 1863 1 9 . 1 1 9 9 VAL H H 9 9.051 9.051 8.308 0.743 17915 1864 1 9 . 1 1 10 10 LEU N N 10 123.127 123.127 123.340 -0.213 17915 1865 1 9 . 1 1 10 10 LEU C C 10 176.729 176.729 175.470 1.259 17915 1866 1 9 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.654 -0.165 17915 1867 1 9 . 1 1 10 10 LEU H H 10 8.864 8.864 8.432 0.432 17915 1868 1 9 . 1 1 11 11 ALA N N 11 126.907 126.907 125.663 1.244 17915 1869 1 9 . 1 1 11 11 ALA C C 11 178.406 178.406 177.165 1.241 17915 1870 1 9 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.740 0.775 17915 1871 1 9 . 1 1 11 11 ALA H H 11 8.988 8.988 8.852 0.136 17915 1872 1 9 . 1 1 12 12 LEU N N 12 127.694 127.694 126.183 1.511 17915 1873 1 9 . 1 1 12 12 LEU C C 12 175.046 175.046 176.362 -1.316 17915 1874 1 9 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.868 -1.141 17915 1875 1 9 . 1 1 12 12 LEU H H 12 9.136 9.136 9.018 0.118 17915 1876 1 9 . 1 1 13 13 TYR N N 13 111.415 111.415 116.392 -4.977 17915 1877 1 9 . 1 1 13 13 TYR C C 13 173.844 173.844 174.239 -0.395 17915 1878 1 9 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.356 -1.700 17915 1879 1 9 . 1 1 13 13 TYR H H 13 6.979 6.979 7.666 -0.687 17915 1880 1 9 . 1 1 14 14 ASP N N 14 117.591 117.591 121.621 -4.030 17915 1881 1 9 . 1 1 14 14 ASP C C 14 176.140 176.140 174.756 1.384 17915 1882 1 9 . 1 1 14 14 ASP CA C 14 54.522 54.522 54.987 -0.465 17915 1883 1 9 . 1 1 14 14 ASP H H 14 8.260 8.260 8.547 -0.287 17915 1884 1 9 . 1 1 15 15 TYR N N 15 119.917 119.917 123.329 -3.412 17915 1885 1 9 . 1 1 15 15 TYR C C 15 172.859 172.859 174.992 -2.133 17915 1886 1 9 . 1 1 15 15 TYR CA C 15 59.661 59.661 56.909 2.752 17915 1887 1 9 . 1 1 15 15 TYR H H 15 8.580 8.580 8.081 0.499 17915 1888 1 9 . 1 1 16 16 GLN N N 16 127.024 127.024 117.306 9.718 17915 1889 1 9 . 1 1 16 16 GLN C C 16 176.377 176.377 174.230 2.147 17915 1890 1 9 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.724 -1.058 17915 1891 1 9 . 1 1 16 16 GLN H H 16 7.450 7.450 7.942 -0.492 17915 1892 1 9 . 1 1 17 17 GLU N N 17 122.837 122.837 122.589 0.248 17915 1893 1 9 . 1 1 17 17 GLU C C 17 176.140 176.140 175.918 0.222 17915 1894 1 9 . 1 1 17 17 GLU CA C 17 56.075 56.075 55.942 0.133 17915 1895 1 9 . 1 1 17 17 GLU H H 17 7.899 7.899 8.814 -0.915 17915 1896 1 9 . 1 1 18 18 LYS N N 18 120.622 120.622 125.628 -5.006 17915 1897 1 9 . 1 1 18 18 LYS C C 18 176.267 176.267 175.341 0.926 17915 1898 1 9 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.549 -1.304 17915 1899 1 9 . 1 1 18 18 LYS H H 18 8.649 8.649 8.608 0.041 17915 1900 1 9 . 1 1 19 19 SER N N 19 115.184 115.184 112.992 2.192 17915 1901 1 9 . 1 1 19 19 SER CA C 19 56.824 56.824 56.440 0.384 17915 1902 1 9 . 1 1 19 19 SER H H 19 7.552 7.552 7.614 -0.062 17915 1903 1 9 . 1 1 21 21 ARG N N 21 113.440 113.440 117.494 -4.054 17915 1904 1 9 . 1 1 21 21 ARG C C 21 176.638 176.638 175.782 0.856 17915 1905 1 9 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.578 -0.370 17915 1906 1 9 . 1 1 21 21 ARG H H 21 7.596 7.596 8.168 -0.572 17915 1907 1 9 . 1 1 22 22 GLU N N 22 121.392 121.392 115.914 5.478 17915 1908 1 9 . 1 1 22 22 GLU C C 22 174.500 174.500 175.585 -1.085 17915 1909 1 9 . 1 1 22 22 GLU CA C 22 55.352 55.352 55.799 -0.447 17915 1910 1 9 . 1 1 22 22 GLU H H 22 7.746 7.746 7.289 0.457 17915 1911 1 9 . 1 1 23 23 VAL N N 23 114.115 114.115 112.626 1.489 17915 1912 1 9 . 1 1 23 23 VAL C C 23 172.337 172.337 174.515 -2.178 17915 1913 1 9 . 1 1 23 23 VAL CA C 23 59.875 59.875 59.534 0.341 17915 1914 1 9 . 1 1 23 23 VAL H H 23 7.318 7.318 8.251 -0.933 17915 1915 1 9 . 1 1 24 24 THR N N 24 118.996 118.996 117.599 1.397 17915 1916 1 9 . 1 1 24 24 THR C C 24 174.451 174.451 173.776 0.675 17915 1917 1 9 . 1 1 24 24 THR CA C 24 61.641 61.641 61.347 0.294 17915 1918 1 9 . 1 1 24 24 THR H H 24 7.324 7.324 8.369 -1.045 17915 1919 1 9 . 1 1 25 25 MET N N 25 121.901 121.901 123.860 -1.959 17915 1920 1 9 . 1 1 25 25 MET C C 25 173.931 173.931 174.342 -0.411 17915 1921 1 9 . 1 1 25 25 MET CA C 25 54.389 54.389 54.077 0.312 17915 1922 1 9 . 1 1 25 25 MET H H 25 9.432 9.432 8.178 1.254 17915 1923 1 9 . 1 1 26 26 LYS N N 26 124.169 124.169 121.522 2.647 17915 1924 1 9 . 1 1 26 26 LYS C C 26 175.002 175.002 175.594 -0.592 17915 1925 1 9 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.486 -0.820 17915 1926 1 9 . 1 1 26 26 LYS H H 26 8.634 8.634 8.622 0.012 17915 1927 1 9 . 1 1 27 27 LYS N N 27 122.603 122.603 124.217 -1.614 17915 1928 1 9 . 1 1 27 27 LYS C C 27 177.318 177.318 177.096 0.222 17915 1929 1 9 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.851 0.793 17915 1930 1 9 . 1 1 27 27 LYS H H 27 8.919 8.919 9.029 -0.110 17915 1931 1 9 . 1 1 28 28 GLY N N 28 115.585 115.585 112.731 2.854 17915 1932 1 9 . 1 1 28 28 GLY C C 28 174.193 174.193 174.476 -0.283 17915 1933 1 9 . 1 1 28 28 GLY CA C 28 44.888 44.888 45.086 -0.198 17915 1934 1 9 . 1 1 28 28 GLY H H 28 8.732 8.732 8.816 -0.084 17915 1935 1 9 . 1 1 29 29 ASP N N 29 121.770 121.770 122.307 -0.537 17915 1936 1 9 . 1 1 29 29 ASP C C 29 174.281 174.281 175.518 -1.237 17915 1937 1 9 . 1 1 29 29 ASP CA C 29 55.486 55.486 53.401 2.084 17915 1938 1 9 . 1 1 29 29 ASP H H 29 8.388 8.388 7.893 0.495 17915 1939 1 9 . 1 1 30 30 ILE N N 30 120.469 120.469 116.852 3.617 17915 1940 1 9 . 1 1 30 30 ILE C C 30 176.356 176.356 174.782 1.574 17915 1941 1 9 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.411 0.838 17915 1942 1 9 . 1 1 30 30 ILE H H 30 8.033 8.033 8.114 -0.081 17915 1943 1 9 . 1 1 31 31 LEU N N 31 127.129 127.129 127.084 0.045 17915 1944 1 9 . 1 1 31 31 LEU C C 31 175.745 175.745 175.887 -0.142 17915 1945 1 9 . 1 1 31 31 LEU CA C 31 53.907 53.907 54.068 -0.161 17915 1946 1 9 . 1 1 31 31 LEU H H 31 9.223 9.223 8.737 0.486 17915 1947 1 9 . 1 1 32 32 THR N N 32 117.055 117.055 117.025 0.030 17915 1948 1 9 . 1 1 32 32 THR C C 32 173.844 173.844 173.742 0.102 17915 1949 1 9 . 1 1 32 32 THR CA C 32 63.247 63.247 61.604 1.643 17915 1950 1 9 . 1 1 32 32 THR H H 32 8.360 8.360 8.302 0.058 17915 1951 1 9 . 1 1 33 33 LEU N N 33 128.815 128.815 124.686 4.129 17915 1952 1 9 . 1 1 33 33 LEU C C 33 174.718 174.718 176.303 -1.585 17915 1953 1 9 . 1 1 33 33 LEU CA C 33 54.870 54.870 53.797 1.073 17915 1954 1 9 . 1 1 33 33 LEU H H 33 8.937 8.937 8.277 0.660 17915 1955 1 9 . 1 1 34 34 LEU N N 34 126.230 126.230 122.630 3.600 17915 1956 1 9 . 1 1 34 34 LEU C C 34 177.689 177.689 176.004 1.685 17915 1957 1 9 . 1 1 34 34 LEU CA C 34 55.218 55.218 56.286 -1.068 17915 1958 1 9 . 1 1 34 34 LEU H H 34 8.929 8.929 8.461 0.468 17915 1959 1 9 . 1 1 35 35 ASN N N 35 113.879 113.879 116.788 -2.909 17915 1960 1 9 . 1 1 35 35 ASN C C 35 174.565 174.565 174.986 -0.421 17915 1961 1 9 . 1 1 35 35 ASN CA C 35 54.576 54.576 52.645 1.931 17915 1962 1 9 . 1 1 35 35 ASN H H 35 7.489 7.489 8.093 -0.604 17915 1963 1 9 . 1 1 36 36 SER N N 36 123.684 123.684 118.171 5.513 17915 1964 1 9 . 1 1 36 36 SER C C 36 173.503 173.503 175.645 -2.142 17915 1965 1 9 . 1 1 36 36 SER CA C 36 56.904 56.904 60.184 -3.280 17915 1966 1 9 . 1 1 36 36 SER H H 36 9.086 9.086 8.834 0.252 17915 1967 1 9 . 1 1 37 37 THR N N 37 115.012 115.012 116.037 -1.025 17915 1968 1 9 . 1 1 37 37 THR C C 37 175.417 175.417 174.291 1.126 17915 1969 1 9 . 1 1 37 37 THR CA C 37 65.521 65.521 62.031 3.490 17915 1970 1 9 . 1 1 37 37 THR H H 37 8.071 8.071 8.019 0.052 17915 1971 1 9 . 1 1 38 38 ASN N N 38 122.517 122.517 120.883 1.634 17915 1972 1 9 . 1 1 38 38 ASN C C 38 174.696 174.696 175.459 -0.763 17915 1973 1 9 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.641 0.838 17915 1974 1 9 . 1 1 38 38 ASN H H 38 8.595 8.595 8.169 0.426 17915 1975 1 9 . 1 1 39 39 LYS N N 39 120.851 120.851 118.201 2.650 17915 1976 1 9 . 1 1 39 39 LYS C C 39 176.444 176.444 177.188 -0.744 17915 1977 1 9 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.601 -0.198 17915 1978 1 9 . 1 1 39 39 LYS H H 39 8.416 8.416 7.826 0.590 17915 1979 1 9 . 1 1 40 40 ASP N N 40 114.427 114.427 117.532 -3.105 17915 1980 1 9 . 1 1 40 40 ASP C C 40 176.960 176.960 175.722 1.238 17915 1981 1 9 . 1 1 40 40 ASP CA C 40 55.352 55.352 54.893 0.459 17915 1982 1 9 . 1 1 40 40 ASP H H 40 8.085 8.085 8.392 -0.307 17915 1983 1 9 . 1 1 41 41 TRP N N 41 122.708 122.708 119.795 2.913 17915 1984 1 9 . 1 1 41 41 TRP C C 41 174.303 174.303 174.590 -0.287 17915 1985 1 9 . 1 1 41 41 TRP CA C 41 56.208 56.208 55.900 0.308 17915 1986 1 9 . 1 1 41 41 TRP H H 41 8.096 8.096 7.629 0.467 17915 1987 1 9 . 1 1 42 42 TRP N N 42 124.707 124.707 123.231 1.476 17915 1988 1 9 . 1 1 42 42 TRP C C 42 174.303 174.303 175.678 -1.375 17915 1989 1 9 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.257 -1.270 17915 1990 1 9 . 1 1 42 42 TRP H H 42 9.245 9.245 7.787 1.458 17915 1991 1 9 . 1 1 43 43 LYS N N 43 124.005 124.005 122.369 1.636 17915 1992 1 9 . 1 1 43 43 LYS C C 43 175.482 175.482 174.805 0.677 17915 1993 1 9 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.112 0.267 17915 1994 1 9 . 1 1 43 43 LYS H H 43 8.783 8.783 8.519 0.264 17915 1995 1 9 . 1 1 44 44 VAL N N 44 122.139 122.139 120.973 1.166 17915 1996 1 9 . 1 1 44 44 VAL C C 44 173.472 173.472 173.649 -0.177 17915 1997 1 9 . 1 1 44 44 VAL CA C 44 59.072 59.072 60.725 -1.653 17915 1998 1 9 . 1 1 44 44 VAL H H 44 9.287 9.287 8.352 0.935 17915 1999 1 9 . 1 1 45 45 GLU N N 45 118.524 118.524 124.894 -6.370 17915 2000 1 9 . 1 1 45 45 GLU C C 45 174.827 174.827 174.776 0.051 17915 2001 1 9 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.990 -0.816 17915 2002 1 9 . 1 1 45 45 GLU H H 45 8.566 8.566 8.621 -0.055 17915 2003 1 9 . 1 1 46 46 VAL N N 46 124.904 124.904 126.747 -1.843 17915 2004 1 9 . 1 1 46 46 VAL C C 46 174.608 174.608 175.340 -0.732 17915 2005 1 9 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.340 -0.689 17915 2006 1 9 . 1 1 46 46 VAL H H 46 8.774 8.774 8.918 -0.144 17915 2007 1 9 . 1 1 47 47 ASN N N 47 126.530 126.530 126.338 0.192 17915 2008 1 9 . 1 1 47 47 ASN C C 47 174.259 174.259 174.638 -0.379 17915 2009 1 9 . 1 1 47 47 ASN CA C 47 55.245 55.245 56.069 -0.824 17915 2010 1 9 . 1 1 47 47 ASN H H 47 9.356 9.356 9.111 0.245 17915 2011 1 9 . 1 1 48 48 ASP N N 48 112.420 112.420 120.124 -7.704 17915 2012 1 9 . 1 1 48 48 ASP C C 48 174.521 174.521 174.716 -0.195 17915 2013 1 9 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.379 0.304 17915 2014 1 9 . 1 1 48 48 ASP H H 48 8.628 8.628 8.239 0.390 17915 2015 1 9 . 1 1 49 49 ARG N N 49 120.379 120.379 119.104 1.275 17915 2016 1 9 . 1 1 49 49 ARG C C 49 174.477 174.477 174.510 -0.033 17915 2017 1 9 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.074 0.224 17915 2018 1 9 . 1 1 49 49 ARG H H 49 8.069 8.069 7.677 0.392 17915 2019 1 9 . 1 1 50 50 GLN N N 50 118.647 118.647 118.992 -0.345 17915 2020 1 9 . 1 1 50 50 GLN C C 50 175.963 175.963 175.361 0.602 17915 2021 1 9 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.004 -0.579 17915 2022 1 9 . 1 1 50 50 GLN H H 50 8.432 8.432 8.526 -0.094 17915 2023 1 9 . 1 1 51 51 GLY N N 51 107.028 107.028 105.982 1.046 17915 2024 1 9 . 1 1 51 51 GLY C C 51 170.479 170.479 172.134 -1.655 17915 2025 1 9 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.507 0.131 17915 2026 1 9 . 1 1 51 51 GLY H H 51 8.534 8.534 7.794 0.740 17915 2027 1 9 . 1 1 52 52 PHE N N 52 119.030 119.030 118.893 0.137 17915 2028 1 9 . 1 1 52 52 PHE C C 52 175.635 175.635 174.385 1.250 17915 2029 1 9 . 1 1 52 52 PHE CA C 52 58.724 58.724 56.925 1.799 17915 2030 1 9 . 1 1 52 52 PHE H H 52 9.098 9.098 8.484 0.614 17915 2031 1 9 . 1 1 53 53 VAL N N 53 110.897 110.897 123.061 -12.164 17915 2032 1 9 . 1 1 53 53 VAL CA C 53 58.108 58.108 57.252 0.856 17915 2033 1 9 . 1 1 53 53 VAL H H 53 8.942 8.942 8.513 0.429 17915 2034 1 9 . 1 1 55 55 ALA N N 55 129.055 129.055 129.474 -0.419 17915 2035 1 9 . 1 1 55 55 ALA C C 55 178.565 178.565 179.130 -0.565 17915 2036 1 9 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.851 -0.222 17915 2037 1 9 . 1 1 55 55 ALA H H 55 7.355 7.355 8.763 -1.408 17915 2038 1 9 . 1 1 56 56 ALA N N 56 113.282 113.282 118.124 -4.842 17915 2039 1 9 . 1 1 56 56 ALA C C 56 178.214 178.214 177.326 0.888 17915 2040 1 9 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.596 -0.653 17915 2041 1 9 . 1 1 56 56 ALA H H 56 7.750 7.750 8.558 -0.808 17915 2042 1 9 . 1 1 57 57 TYR N N 57 116.083 116.083 117.461 -1.378 17915 2043 1 9 . 1 1 57 57 TYR C C 57 174.565 174.565 173.745 0.820 17915 2044 1 9 . 1 1 57 57 TYR CA C 57 56.422 56.422 57.514 -1.092 17915 2045 1 9 . 1 1 57 57 TYR H H 57 7.611 7.611 7.508 0.103 17915 2046 1 9 . 1 1 58 58 VAL N N 58 110.965 110.965 118.342 -7.377 17915 2047 1 9 . 1 1 58 58 VAL C C 58 173.647 173.647 173.664 -0.017 17915 2048 1 9 . 1 1 58 58 VAL CA C 58 58.242 58.242 60.511 -2.269 17915 2049 1 9 . 1 1 58 58 VAL H H 58 7.301 7.301 7.266 0.035 17915 2050 1 9 . 1 1 59 59 LYS N N 59 118.586 118.586 124.051 -5.465 17915 2051 1 9 . 1 1 59 59 LYS C C 59 176.160 176.160 174.812 1.348 17915 2052 1 9 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.820 -0.779 17915 2053 1 9 . 1 1 59 59 LYS H H 59 8.515 8.515 8.359 0.156 17915 2054 1 9 . 1 1 60 60 LYS N N 60 125.734 125.734 122.491 3.243 17915 2055 1 9 . 1 1 60 60 LYS C C 60 176.793 176.793 177.411 -0.618 17915 2056 1 9 . 1 1 60 60 LYS CA C 60 58.617 58.617 57.360 1.257 17915 2057 1 9 . 1 1 60 60 LYS H H 60 9.135 9.135 8.631 0.504 17915 2058 1 9 . 1 1 61 61 LEU N N 61 125.061 125.061 123.945 1.116 17915 2059 1 9 . 1 1 61 61 LEU C C 61 174.106 174.106 177.319 -3.213 17915 2060 1 9 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.114 -1.137 17915 2061 1 9 . 1 1 61 61 LEU H H 61 8.384 8.384 8.271 0.113 17915 2062 1 10 . 1 1 2 2 ASP N N 2 123.220 123.220 123.574 -0.354 17915 2063 1 10 . 1 1 2 2 ASP C C 2 175.703 175.703 176.105 -0.402 17915 2064 1 10 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.715 -0.674 17915 2065 1 10 . 1 1 2 2 ASP H H 2 8.738 8.738 8.709 0.029 17915 2066 1 10 . 1 1 3 3 GLU N N 3 121.895 121.895 116.745 5.150 17915 2067 1 10 . 1 1 3 3 GLU C C 3 176.480 176.480 174.650 1.830 17915 2068 1 10 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.391 -0.263 17915 2069 1 10 . 1 1 3 3 GLU H H 3 8.570 8.570 7.830 0.740 17915 2070 1 10 . 1 1 4 4 THR N N 4 114.607 114.607 114.238 0.369 17915 2071 1 10 . 1 1 4 4 THR C C 4 175.417 175.417 173.303 2.114 17915 2072 1 10 . 1 1 4 4 THR CA C 4 62.685 62.685 61.926 0.759 17915 2073 1 10 . 1 1 4 4 THR H H 4 8.176 8.176 7.846 0.330 17915 2074 1 10 . 1 1 5 5 GLY N N 5 111.430 111.430 110.664 0.766 17915 2075 1 10 . 1 1 5 5 GLY C C 5 173.777 173.777 172.744 1.033 17915 2076 1 10 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.926 -0.366 17915 2077 1 10 . 1 1 5 5 GLY H H 5 8.344 8.344 7.794 0.550 17915 2078 1 10 . 1 1 6 6 LYS N N 6 119.850 119.850 124.410 -4.560 17915 2079 1 10 . 1 1 6 6 LYS C C 6 176.049 176.049 176.592 -0.543 17915 2080 1 10 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.529 -1.615 17915 2081 1 10 . 1 1 6 6 LYS H H 6 7.903 7.903 8.272 -0.369 17915 2082 1 10 . 1 1 7 7 GLU N N 7 123.025 123.025 118.971 4.054 17915 2083 1 10 . 1 1 7 7 GLU C C 7 174.172 174.172 174.672 -0.500 17915 2084 1 10 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.429 -1.970 17915 2085 1 10 . 1 1 7 7 GLU H H 7 8.562 8.562 8.688 -0.126 17915 2086 1 10 . 1 1 8 8 LEU N N 8 123.147 123.147 116.813 6.334 17915 2087 1 10 . 1 1 8 8 LEU C C 8 177.495 177.495 174.568 2.927 17915 2088 1 10 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.548 -0.123 17915 2089 1 10 . 1 1 8 8 LEU H H 8 8.292 8.292 7.297 0.995 17915 2090 1 10 . 1 1 9 9 VAL N N 9 111.799 111.799 116.427 -4.628 17915 2091 1 10 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.142 -1.248 17915 2092 1 10 . 1 1 9 9 VAL H H 9 9.051 9.051 7.974 1.077 17915 2093 1 10 . 1 1 10 10 LEU N N 10 123.127 123.127 124.363 -1.236 17915 2094 1 10 . 1 1 10 10 LEU C C 10 176.729 176.729 175.605 1.124 17915 2095 1 10 . 1 1 10 10 LEU CA C 10 52.489 52.489 53.422 -0.933 17915 2096 1 10 . 1 1 10 10 LEU H H 10 8.864 8.864 8.688 0.176 17915 2097 1 10 . 1 1 11 11 ALA N N 11 126.907 126.907 127.402 -0.495 17915 2098 1 10 . 1 1 11 11 ALA C C 11 178.406 178.406 177.108 1.298 17915 2099 1 10 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.951 0.564 17915 2100 1 10 . 1 1 11 11 ALA H H 11 8.988 8.988 8.499 0.489 17915 2101 1 10 . 1 1 12 12 LEU N N 12 127.694 127.694 125.861 1.833 17915 2102 1 10 . 1 1 12 12 LEU C C 12 175.046 175.046 176.200 -1.154 17915 2103 1 10 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.303 -0.576 17915 2104 1 10 . 1 1 12 12 LEU H H 12 9.136 9.136 8.590 0.546 17915 2105 1 10 . 1 1 13 13 TYR N N 13 111.415 111.415 115.197 -3.782 17915 2106 1 10 . 1 1 13 13 TYR C C 13 173.844 173.844 173.518 0.326 17915 2107 1 10 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.657 -2.001 17915 2108 1 10 . 1 1 13 13 TYR H H 13 6.979 6.979 7.435 -0.456 17915 2109 1 10 . 1 1 14 14 ASP N N 14 117.591 117.591 122.418 -4.827 17915 2110 1 10 . 1 1 14 14 ASP C C 14 176.140 176.140 174.924 1.216 17915 2111 1 10 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.403 -0.881 17915 2112 1 10 . 1 1 14 14 ASP H H 14 8.260 8.260 8.839 -0.579 17915 2113 1 10 . 1 1 15 15 TYR N N 15 119.917 119.917 120.762 -0.845 17915 2114 1 10 . 1 1 15 15 TYR C C 15 172.859 172.859 173.792 -0.933 17915 2115 1 10 . 1 1 15 15 TYR CA C 15 59.661 59.661 58.082 1.579 17915 2116 1 10 . 1 1 15 15 TYR H H 15 8.580 8.580 8.725 -0.145 17915 2117 1 10 . 1 1 16 16 GLN N N 16 127.024 127.024 119.329 7.695 17915 2118 1 10 . 1 1 16 16 GLN C C 16 176.377 176.377 176.182 0.195 17915 2119 1 10 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.205 -1.539 17915 2120 1 10 . 1 1 16 16 GLN H H 16 7.450 7.450 7.762 -0.312 17915 2121 1 10 . 1 1 17 17 GLU N N 17 122.837 122.837 124.791 -1.954 17915 2122 1 10 . 1 1 17 17 GLU C C 17 176.140 176.140 174.567 1.573 17915 2123 1 10 . 1 1 17 17 GLU CA C 17 56.075 56.075 57.425 -1.350 17915 2124 1 10 . 1 1 17 17 GLU H H 17 7.899 7.899 8.791 -0.892 17915 2125 1 10 . 1 1 18 18 LYS N N 18 120.622 120.622 121.877 -1.255 17915 2126 1 10 . 1 1 18 18 LYS C C 18 176.267 176.267 175.337 0.930 17915 2127 1 10 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.025 -0.780 17915 2128 1 10 . 1 1 18 18 LYS H H 18 8.649 8.649 8.374 0.275 17915 2129 1 10 . 1 1 19 19 SER N N 19 115.184 115.184 115.752 -0.568 17915 2130 1 10 . 1 1 19 19 SER CA C 19 56.824 56.824 55.984 0.840 17915 2131 1 10 . 1 1 19 19 SER H H 19 7.552 7.552 8.013 -0.461 17915 2132 1 10 . 1 1 21 21 ARG N N 21 113.440 113.440 118.013 -4.573 17915 2133 1 10 . 1 1 21 21 ARG C C 21 176.638 176.638 175.222 1.416 17915 2134 1 10 . 1 1 21 21 ARG CA C 21 56.208 56.208 55.381 0.827 17915 2135 1 10 . 1 1 21 21 ARG H H 21 7.596 7.596 7.899 -0.303 17915 2136 1 10 . 1 1 22 22 GLU N N 22 121.392 121.392 118.937 2.455 17915 2137 1 10 . 1 1 22 22 GLU C C 22 174.500 174.500 174.108 0.392 17915 2138 1 10 . 1 1 22 22 GLU CA C 22 55.352 55.352 57.045 -1.693 17915 2139 1 10 . 1 1 22 22 GLU H H 22 7.746 7.746 7.541 0.205 17915 2140 1 10 . 1 1 23 23 VAL N N 23 114.115 114.115 123.643 -9.528 17915 2141 1 10 . 1 1 23 23 VAL C C 23 172.337 172.337 174.348 -2.011 17915 2142 1 10 . 1 1 23 23 VAL CA C 23 59.875 59.875 61.014 -1.139 17915 2143 1 10 . 1 1 23 23 VAL H H 23 7.318 7.318 8.395 -1.077 17915 2144 1 10 . 1 1 24 24 THR N N 24 118.996 118.996 119.323 -0.327 17915 2145 1 10 . 1 1 24 24 THR C C 24 174.451 174.451 173.394 1.057 17915 2146 1 10 . 1 1 24 24 THR CA C 24 61.641 61.641 60.901 0.740 17915 2147 1 10 . 1 1 24 24 THR H H 24 7.324 7.324 8.592 -1.268 17915 2148 1 10 . 1 1 25 25 MET N N 25 121.901 121.901 125.775 -3.874 17915 2149 1 10 . 1 1 25 25 MET C C 25 173.931 173.931 174.164 -0.233 17915 2150 1 10 . 1 1 25 25 MET CA C 25 54.389 54.389 55.267 -0.878 17915 2151 1 10 . 1 1 25 25 MET H H 25 9.432 9.432 8.589 0.843 17915 2152 1 10 . 1 1 26 26 LYS N N 26 124.169 124.169 122.950 1.219 17915 2153 1 10 . 1 1 26 26 LYS C C 26 175.002 175.002 175.336 -0.334 17915 2154 1 10 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.994 -1.328 17915 2155 1 10 . 1 1 26 26 LYS H H 26 8.634 8.634 8.556 0.078 17915 2156 1 10 . 1 1 27 27 LYS N N 27 122.603 122.603 126.082 -3.479 17915 2157 1 10 . 1 1 27 27 LYS C C 27 177.318 177.318 177.398 -0.080 17915 2158 1 10 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.206 0.438 17915 2159 1 10 . 1 1 27 27 LYS H H 27 8.919 8.919 9.017 -0.098 17915 2160 1 10 . 1 1 28 28 GLY N N 28 115.585 115.585 114.534 1.051 17915 2161 1 10 . 1 1 28 28 GLY C C 28 174.193 174.193 174.343 -0.150 17915 2162 1 10 . 1 1 28 28 GLY CA C 28 44.888 44.888 45.028 -0.140 17915 2163 1 10 . 1 1 28 28 GLY H H 28 8.732 8.732 8.312 0.420 17915 2164 1 10 . 1 1 29 29 ASP N N 29 121.770 121.770 121.732 0.038 17915 2165 1 10 . 1 1 29 29 ASP C C 29 174.281 174.281 175.373 -1.092 17915 2166 1 10 . 1 1 29 29 ASP CA C 29 55.486 55.486 53.892 1.593 17915 2167 1 10 . 1 1 29 29 ASP H H 29 8.388 8.388 7.666 0.722 17915 2168 1 10 . 1 1 30 30 ILE N N 30 120.469 120.469 117.671 2.798 17915 2169 1 10 . 1 1 30 30 ILE C C 30 176.356 176.356 174.986 1.370 17915 2170 1 10 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.890 0.359 17915 2171 1 10 . 1 1 30 30 ILE H H 30 8.033 8.033 8.044 -0.011 17915 2172 1 10 . 1 1 31 31 LEU N N 31 127.129 127.129 128.304 -1.175 17915 2173 1 10 . 1 1 31 31 LEU C C 31 175.745 175.745 176.191 -0.446 17915 2174 1 10 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.644 0.263 17915 2175 1 10 . 1 1 31 31 LEU H H 31 9.223 9.223 8.030 1.193 17915 2176 1 10 . 1 1 32 32 THR N N 32 117.055 117.055 118.069 -1.014 17915 2177 1 10 . 1 1 32 32 THR C C 32 173.844 173.844 173.397 0.447 17915 2178 1 10 . 1 1 32 32 THR CA C 32 63.247 63.247 61.744 1.503 17915 2179 1 10 . 1 1 32 32 THR H H 32 8.360 8.360 8.416 -0.056 17915 2180 1 10 . 1 1 33 33 LEU N N 33 128.815 128.815 127.458 1.357 17915 2181 1 10 . 1 1 33 33 LEU C C 33 174.718 174.718 176.242 -1.524 17915 2182 1 10 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.688 0.182 17915 2183 1 10 . 1 1 33 33 LEU H H 33 8.937 8.937 8.553 0.384 17915 2184 1 10 . 1 1 34 34 LEU N N 34 126.230 126.230 127.403 -1.173 17915 2185 1 10 . 1 1 34 34 LEU C C 34 177.689 177.689 176.680 1.009 17915 2186 1 10 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.807 -0.589 17915 2187 1 10 . 1 1 34 34 LEU H H 34 8.929 8.929 8.448 0.481 17915 2188 1 10 . 1 1 35 35 ASN N N 35 113.879 113.879 114.128 -0.249 17915 2189 1 10 . 1 1 35 35 ASN C C 35 174.565 174.565 173.448 1.117 17915 2190 1 10 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.038 1.538 17915 2191 1 10 . 1 1 35 35 ASN H H 35 7.489 7.489 7.909 -0.420 17915 2192 1 10 . 1 1 36 36 SER N N 36 123.684 123.684 118.656 5.028 17915 2193 1 10 . 1 1 36 36 SER C C 36 173.503 173.503 174.781 -1.278 17915 2194 1 10 . 1 1 36 36 SER CA C 36 56.904 56.904 58.996 -2.092 17915 2195 1 10 . 1 1 36 36 SER H H 36 9.086 9.086 8.784 0.302 17915 2196 1 10 . 1 1 37 37 THR N N 37 115.012 115.012 119.177 -4.165 17915 2197 1 10 . 1 1 37 37 THR C C 37 175.417 175.417 174.995 0.422 17915 2198 1 10 . 1 1 37 37 THR CA C 37 65.521 65.521 64.445 1.076 17915 2199 1 10 . 1 1 37 37 THR H H 37 8.071 8.071 8.474 -0.403 17915 2200 1 10 . 1 1 38 38 ASN N N 38 122.517 122.517 114.496 8.021 17915 2201 1 10 . 1 1 38 38 ASN C C 38 174.696 174.696 172.706 1.990 17915 2202 1 10 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.458 1.021 17915 2203 1 10 . 1 1 38 38 ASN H H 38 8.595 8.595 7.196 1.399 17915 2204 1 10 . 1 1 39 39 LYS N N 39 120.851 120.851 118.535 2.316 17915 2205 1 10 . 1 1 39 39 LYS C C 39 176.444 176.444 177.136 -0.692 17915 2206 1 10 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.674 -0.271 17915 2207 1 10 . 1 1 39 39 LYS H H 39 8.416 8.416 8.363 0.053 17915 2208 1 10 . 1 1 40 40 ASP N N 40 114.427 114.427 118.098 -3.671 17915 2209 1 10 . 1 1 40 40 ASP C C 40 176.960 176.960 175.780 1.180 17915 2210 1 10 . 1 1 40 40 ASP CA C 40 55.352 55.352 56.340 -0.988 17915 2211 1 10 . 1 1 40 40 ASP H H 40 8.085 8.085 7.945 0.140 17915 2212 1 10 . 1 1 41 41 TRP N N 41 122.708 122.708 119.026 3.682 17915 2213 1 10 . 1 1 41 41 TRP C C 41 174.303 174.303 174.329 -0.026 17915 2214 1 10 . 1 1 41 41 TRP CA C 41 56.208 56.208 55.156 1.052 17915 2215 1 10 . 1 1 41 41 TRP H H 41 8.096 8.096 7.256 0.840 17915 2216 1 10 . 1 1 42 42 TRP N N 42 124.707 124.707 122.177 2.530 17915 2217 1 10 . 1 1 42 42 TRP C C 42 174.303 174.303 174.983 -0.680 17915 2218 1 10 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.112 -2.125 17915 2219 1 10 . 1 1 42 42 TRP H H 42 9.245 9.245 8.296 0.949 17915 2220 1 10 . 1 1 43 43 LYS N N 43 124.005 124.005 120.475 3.530 17915 2221 1 10 . 1 1 43 43 LYS C C 43 175.482 175.482 175.091 0.391 17915 2222 1 10 . 1 1 43 43 LYS CA C 43 55.379 55.379 54.890 0.489 17915 2223 1 10 . 1 1 43 43 LYS H H 43 8.783 8.783 9.022 -0.239 17915 2224 1 10 . 1 1 44 44 VAL N N 44 122.139 122.139 125.330 -3.191 17915 2225 1 10 . 1 1 44 44 VAL C C 44 173.472 173.472 173.779 -0.307 17915 2226 1 10 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.568 -0.496 17915 2227 1 10 . 1 1 44 44 VAL H H 44 9.287 9.287 8.783 0.504 17915 2228 1 10 . 1 1 45 45 GLU N N 45 118.524 118.524 127.003 -8.479 17915 2229 1 10 . 1 1 45 45 GLU C C 45 174.827 174.827 175.562 -0.735 17915 2230 1 10 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.748 -0.574 17915 2231 1 10 . 1 1 45 45 GLU H H 45 8.566 8.566 8.066 0.500 17915 2232 1 10 . 1 1 46 46 VAL N N 46 124.904 124.904 125.291 -0.387 17915 2233 1 10 . 1 1 46 46 VAL C C 46 174.608 174.608 175.544 -0.936 17915 2234 1 10 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.343 -0.692 17915 2235 1 10 . 1 1 46 46 VAL H H 46 8.774 8.774 8.025 0.749 17915 2236 1 10 . 1 1 47 47 ASN N N 47 126.530 126.530 126.731 -0.201 17915 2237 1 10 . 1 1 47 47 ASN C C 47 174.259 174.259 175.042 -0.783 17915 2238 1 10 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.735 -0.490 17915 2239 1 10 . 1 1 47 47 ASN H H 47 9.356 9.356 9.026 0.330 17915 2240 1 10 . 1 1 48 48 ASP N N 48 112.420 112.420 119.010 -6.590 17915 2241 1 10 . 1 1 48 48 ASP C C 48 174.521 174.521 174.657 -0.136 17915 2242 1 10 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.427 0.256 17915 2243 1 10 . 1 1 48 48 ASP H H 48 8.628 8.628 8.281 0.347 17915 2244 1 10 . 1 1 49 49 ARG N N 49 120.379 120.379 119.118 1.261 17915 2245 1 10 . 1 1 49 49 ARG C C 49 174.477 174.477 174.329 0.148 17915 2246 1 10 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.467 0.831 17915 2247 1 10 . 1 1 49 49 ARG H H 49 8.069 8.069 7.919 0.150 17915 2248 1 10 . 1 1 50 50 GLN N N 50 118.647 118.647 119.046 -0.399 17915 2249 1 10 . 1 1 50 50 GLN C C 50 175.963 175.963 174.183 1.780 17915 2250 1 10 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.790 -1.365 17915 2251 1 10 . 1 1 50 50 GLN H H 50 8.432 8.432 8.532 -0.100 17915 2252 1 10 . 1 1 51 51 GLY N N 51 107.028 107.028 108.614 -1.586 17915 2253 1 10 . 1 1 51 51 GLY C C 51 170.479 170.479 172.249 -1.770 17915 2254 1 10 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.454 0.184 17915 2255 1 10 . 1 1 51 51 GLY H H 51 8.534 8.534 8.334 0.200 17915 2256 1 10 . 1 1 52 52 PHE N N 52 119.030 119.030 118.482 0.548 17915 2257 1 10 . 1 1 52 52 PHE C C 52 175.635 175.635 174.484 1.151 17915 2258 1 10 . 1 1 52 52 PHE CA C 52 58.724 58.724 57.467 1.257 17915 2259 1 10 . 1 1 52 52 PHE H H 52 9.098 9.098 7.903 1.195 17915 2260 1 10 . 1 1 53 53 VAL N N 53 110.897 110.897 120.424 -9.527 17915 2261 1 10 . 1 1 53 53 VAL CA C 53 58.108 58.108 59.287 -1.179 17915 2262 1 10 . 1 1 53 53 VAL H H 53 8.942 8.942 8.513 0.429 17915 2263 1 10 . 1 1 55 55 ALA N N 55 129.055 129.055 129.188 -0.133 17915 2264 1 10 . 1 1 55 55 ALA C C 55 178.565 178.565 178.748 -0.183 17915 2265 1 10 . 1 1 55 55 ALA CA C 55 54.629 54.629 55.082 -0.453 17915 2266 1 10 . 1 1 55 55 ALA H H 55 7.355 7.355 8.950 -1.595 17915 2267 1 10 . 1 1 56 56 ALA N N 56 113.282 113.282 118.637 -5.355 17915 2268 1 10 . 1 1 56 56 ALA C C 56 178.214 178.214 177.884 0.330 17915 2269 1 10 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.893 -0.950 17915 2270 1 10 . 1 1 56 56 ALA H H 56 7.750 7.750 8.344 -0.594 17915 2271 1 10 . 1 1 57 57 TYR N N 57 116.083 116.083 117.583 -1.500 17915 2272 1 10 . 1 1 57 57 TYR C C 57 174.565 174.565 173.996 0.569 17915 2273 1 10 . 1 1 57 57 TYR CA C 57 56.422 56.422 56.682 -0.260 17915 2274 1 10 . 1 1 57 57 TYR H H 57 7.611 7.611 7.648 -0.037 17915 2275 1 10 . 1 1 58 58 VAL N N 58 110.965 110.965 118.001 -7.036 17915 2276 1 10 . 1 1 58 58 VAL C C 58 173.647 173.647 174.205 -0.558 17915 2277 1 10 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.285 -1.043 17915 2278 1 10 . 1 1 58 58 VAL H H 58 7.301 7.301 7.275 0.026 17915 2279 1 10 . 1 1 59 59 LYS N N 59 118.586 118.586 125.345 -6.759 17915 2280 1 10 . 1 1 59 59 LYS C C 59 176.160 176.160 174.673 1.487 17915 2281 1 10 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.509 -1.468 17915 2282 1 10 . 1 1 59 59 LYS H H 59 8.515 8.515 8.214 0.301 17915 2283 1 10 . 1 1 60 60 LYS N N 60 125.734 125.734 125.531 0.203 17915 2284 1 10 . 1 1 60 60 LYS C C 60 176.793 176.793 176.643 0.150 17915 2285 1 10 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.262 3.355 17915 2286 1 10 . 1 1 60 60 LYS H H 60 9.135 9.135 8.497 0.638 17915 2287 1 10 . 1 1 61 61 LEU N N 61 125.061 125.061 122.915 2.146 17915 2288 1 10 . 1 1 61 61 LEU C C 61 174.106 174.106 175.118 -1.012 17915 2289 1 10 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.078 -1.101 17915 2290 1 10 . 1 1 61 61 LEU H H 61 8.384 8.384 8.736 -0.352 17915 2291 1 11 . 1 1 2 2 ASP N N 2 123.220 123.220 122.008 1.212 17915 2292 1 11 . 1 1 2 2 ASP C C 2 175.703 175.703 175.421 0.282 17915 2293 1 11 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.702 -0.661 17915 2294 1 11 . 1 1 2 2 ASP H H 2 8.738 8.738 8.118 0.620 17915 2295 1 11 . 1 1 3 3 GLU N N 3 121.895 121.895 116.664 5.231 17915 2296 1 11 . 1 1 3 3 GLU C C 3 176.480 176.480 174.986 1.494 17915 2297 1 11 . 1 1 3 3 GLU CA C 3 56.128 56.128 57.654 -1.526 17915 2298 1 11 . 1 1 3 3 GLU H H 3 8.570 8.570 8.627 -0.057 17915 2299 1 11 . 1 1 4 4 THR N N 4 114.607 114.607 110.210 4.397 17915 2300 1 11 . 1 1 4 4 THR C C 4 175.417 175.417 173.265 2.152 17915 2301 1 11 . 1 1 4 4 THR CA C 4 62.685 62.685 62.514 0.171 17915 2302 1 11 . 1 1 4 4 THR H H 4 8.176 8.176 7.752 0.424 17915 2303 1 11 . 1 1 5 5 GLY N N 5 111.430 111.430 111.941 -0.511 17915 2304 1 11 . 1 1 5 5 GLY C C 5 173.777 173.777 173.160 0.617 17915 2305 1 11 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.605 -0.045 17915 2306 1 11 . 1 1 5 5 GLY H H 5 8.344 8.344 8.203 0.141 17915 2307 1 11 . 1 1 6 6 LYS N N 6 119.850 119.850 121.583 -1.733 17915 2308 1 11 . 1 1 6 6 LYS C C 6 176.049 176.049 176.364 -0.315 17915 2309 1 11 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.529 0.385 17915 2310 1 11 . 1 1 6 6 LYS H H 6 7.903 7.903 8.003 -0.100 17915 2311 1 11 . 1 1 7 7 GLU N N 7 123.025 123.025 126.142 -3.117 17915 2312 1 11 . 1 1 7 7 GLU C C 7 174.172 174.172 175.410 -1.238 17915 2313 1 11 . 1 1 7 7 GLU CA C 7 55.459 55.459 56.569 -1.110 17915 2314 1 11 . 1 1 7 7 GLU H H 7 8.562 8.562 8.875 -0.313 17915 2315 1 11 . 1 1 8 8 LEU N N 8 123.147 123.147 121.327 1.820 17915 2316 1 11 . 1 1 8 8 LEU C C 8 177.495 177.495 174.245 3.250 17915 2317 1 11 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.924 -0.499 17915 2318 1 11 . 1 1 8 8 LEU H H 8 8.292 8.292 8.121 0.171 17915 2319 1 11 . 1 1 9 9 VAL N N 9 111.799 111.799 116.590 -4.791 17915 2320 1 11 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.370 -2.476 17915 2321 1 11 . 1 1 9 9 VAL H H 9 9.051 9.051 7.983 1.068 17915 2322 1 11 . 1 1 10 10 LEU N N 10 123.127 123.127 125.398 -2.271 17915 2323 1 11 . 1 1 10 10 LEU C C 10 176.729 176.729 175.584 1.145 17915 2324 1 11 . 1 1 10 10 LEU CA C 10 52.489 52.489 53.411 -0.923 17915 2325 1 11 . 1 1 10 10 LEU H H 10 8.864 8.864 8.011 0.853 17915 2326 1 11 . 1 1 11 11 ALA N N 11 126.907 126.907 123.514 3.393 17915 2327 1 11 . 1 1 11 11 ALA C C 11 178.406 178.406 176.682 1.724 17915 2328 1 11 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.711 0.804 17915 2329 1 11 . 1 1 11 11 ALA H H 11 8.988 8.988 8.137 0.851 17915 2330 1 11 . 1 1 12 12 LEU N N 12 127.694 127.694 123.955 3.739 17915 2331 1 11 . 1 1 12 12 LEU C C 12 175.046 175.046 175.898 -0.852 17915 2332 1 11 . 1 1 12 12 LEU CA C 12 55.727 55.727 55.664 0.063 17915 2333 1 11 . 1 1 12 12 LEU H H 12 9.136 9.136 8.412 0.724 17915 2334 1 11 . 1 1 13 13 TYR N N 13 111.415 111.415 117.024 -5.609 17915 2335 1 11 . 1 1 13 13 TYR C C 13 173.844 173.844 173.999 -0.155 17915 2336 1 11 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.451 -1.795 17915 2337 1 11 . 1 1 13 13 TYR H H 13 6.979 6.979 7.814 -0.835 17915 2338 1 11 . 1 1 14 14 ASP N N 14 117.591 117.591 124.106 -6.515 17915 2339 1 11 . 1 1 14 14 ASP C C 14 176.140 176.140 175.497 0.643 17915 2340 1 11 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.450 -0.928 17915 2341 1 11 . 1 1 14 14 ASP H H 14 8.260 8.260 8.703 -0.443 17915 2342 1 11 . 1 1 15 15 TYR N N 15 119.917 119.917 121.392 -1.475 17915 2343 1 11 . 1 1 15 15 TYR C C 15 172.859 172.859 173.775 -0.916 17915 2344 1 11 . 1 1 15 15 TYR CA C 15 59.661 59.661 57.244 2.417 17915 2345 1 11 . 1 1 15 15 TYR H H 15 8.580 8.580 8.252 0.328 17915 2346 1 11 . 1 1 16 16 GLN N N 16 127.024 127.024 120.714 6.310 17915 2347 1 11 . 1 1 16 16 GLN C C 16 176.377 176.377 175.568 0.809 17915 2348 1 11 . 1 1 16 16 GLN CA C 16 53.666 53.666 56.410 -2.744 17915 2349 1 11 . 1 1 16 16 GLN H H 16 7.450 7.450 8.197 -0.747 17915 2350 1 11 . 1 1 17 17 GLU N N 17 122.837 122.837 127.047 -4.210 17915 2351 1 11 . 1 1 17 17 GLU C C 17 176.140 176.140 174.762 1.378 17915 2352 1 11 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.010 0.066 17915 2353 1 11 . 1 1 17 17 GLU H H 17 7.899 7.899 8.523 -0.624 17915 2354 1 11 . 1 1 18 18 LYS N N 18 120.622 120.622 119.746 0.876 17915 2355 1 11 . 1 1 18 18 LYS C C 18 176.267 176.267 174.801 1.466 17915 2356 1 11 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.751 -1.506 17915 2357 1 11 . 1 1 18 18 LYS H H 18 8.649 8.649 8.048 0.601 17915 2358 1 11 . 1 1 19 19 SER N N 19 115.184 115.184 114.754 0.430 17915 2359 1 11 . 1 1 19 19 SER CA C 19 56.824 56.824 56.819 0.005 17915 2360 1 11 . 1 1 19 19 SER H H 19 7.552 7.552 7.841 -0.289 17915 2361 1 11 . 1 1 21 21 ARG N N 21 113.440 113.440 118.017 -4.577 17915 2362 1 11 . 1 1 21 21 ARG C C 21 176.638 176.638 176.770 -0.132 17915 2363 1 11 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.661 -0.453 17915 2364 1 11 . 1 1 21 21 ARG H H 21 7.596 7.596 8.265 -0.669 17915 2365 1 11 . 1 1 22 22 GLU N N 22 121.392 121.392 115.458 5.934 17915 2366 1 11 . 1 1 22 22 GLU C C 22 174.500 174.500 174.790 -0.290 17915 2367 1 11 . 1 1 22 22 GLU CA C 22 55.352 55.352 54.716 0.636 17915 2368 1 11 . 1 1 22 22 GLU H H 22 7.746 7.746 7.530 0.216 17915 2369 1 11 . 1 1 23 23 VAL N N 23 114.115 114.115 118.120 -4.005 17915 2370 1 11 . 1 1 23 23 VAL C C 23 172.337 172.337 174.528 -2.191 17915 2371 1 11 . 1 1 23 23 VAL CA C 23 59.875 59.875 59.561 0.314 17915 2372 1 11 . 1 1 23 23 VAL H H 23 7.318 7.318 8.366 -1.048 17915 2373 1 11 . 1 1 24 24 THR N N 24 118.996 118.996 119.185 -0.189 17915 2374 1 11 . 1 1 24 24 THR C C 24 174.451 174.451 173.871 0.580 17915 2375 1 11 . 1 1 24 24 THR CA C 24 61.641 61.641 61.483 0.158 17915 2376 1 11 . 1 1 24 24 THR H H 24 7.324 7.324 8.403 -1.079 17915 2377 1 11 . 1 1 25 25 MET N N 25 121.901 121.901 123.697 -1.796 17915 2378 1 11 . 1 1 25 25 MET C C 25 173.931 173.931 174.380 -0.449 17915 2379 1 11 . 1 1 25 25 MET CA C 25 54.389 54.389 53.998 0.390 17915 2380 1 11 . 1 1 25 25 MET H H 25 9.432 9.432 8.287 1.145 17915 2381 1 11 . 1 1 26 26 LYS N N 26 124.169 124.169 122.627 1.542 17915 2382 1 11 . 1 1 26 26 LYS C C 26 175.002 175.002 175.976 -0.974 17915 2383 1 11 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.620 -0.953 17915 2384 1 11 . 1 1 26 26 LYS H H 26 8.634 8.634 8.648 -0.014 17915 2385 1 11 . 1 1 27 27 LYS N N 27 122.603 122.603 125.074 -2.471 17915 2386 1 11 . 1 1 27 27 LYS C C 27 177.318 177.318 177.516 -0.198 17915 2387 1 11 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.857 0.787 17915 2388 1 11 . 1 1 27 27 LYS H H 27 8.919 8.919 9.001 -0.082 17915 2389 1 11 . 1 1 28 28 GLY N N 28 115.585 115.585 113.873 1.712 17915 2390 1 11 . 1 1 28 28 GLY C C 28 174.193 174.193 174.796 -0.603 17915 2391 1 11 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.989 -0.101 17915 2392 1 11 . 1 1 28 28 GLY H H 28 8.732 8.732 9.097 -0.365 17915 2393 1 11 . 1 1 29 29 ASP N N 29 121.770 121.770 122.914 -1.144 17915 2394 1 11 . 1 1 29 29 ASP C C 29 174.281 174.281 176.004 -1.723 17915 2395 1 11 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.645 0.841 17915 2396 1 11 . 1 1 29 29 ASP H H 29 8.388 8.388 7.983 0.405 17915 2397 1 11 . 1 1 30 30 ILE N N 30 120.469 120.469 115.468 5.001 17915 2398 1 11 . 1 1 30 30 ILE C C 30 176.356 176.356 174.942 1.414 17915 2399 1 11 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.537 -0.288 17915 2400 1 11 . 1 1 30 30 ILE H H 30 8.033 8.033 8.021 0.012 17915 2401 1 11 . 1 1 31 31 LEU N N 31 127.129 127.129 127.143 -0.014 17915 2402 1 11 . 1 1 31 31 LEU C C 31 175.745 175.745 176.483 -0.738 17915 2403 1 11 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.124 0.783 17915 2404 1 11 . 1 1 31 31 LEU H H 31 9.223 9.223 8.976 0.247 17915 2405 1 11 . 1 1 32 32 THR N N 32 117.055 117.055 115.527 1.528 17915 2406 1 11 . 1 1 32 32 THR C C 32 173.844 173.844 173.918 -0.074 17915 2407 1 11 . 1 1 32 32 THR CA C 32 63.247 63.247 60.494 2.753 17915 2408 1 11 . 1 1 32 32 THR H H 32 8.360 8.360 8.305 0.055 17915 2409 1 11 . 1 1 33 33 LEU N N 33 128.815 128.815 127.500 1.315 17915 2410 1 11 . 1 1 33 33 LEU C C 33 174.718 174.718 176.163 -1.445 17915 2411 1 11 . 1 1 33 33 LEU CA C 33 54.870 54.870 55.209 -0.339 17915 2412 1 11 . 1 1 33 33 LEU H H 33 8.937 8.937 8.780 0.157 17915 2413 1 11 . 1 1 34 34 LEU N N 34 126.230 126.230 128.898 -2.668 17915 2414 1 11 . 1 1 34 34 LEU C C 34 177.689 177.689 176.577 1.112 17915 2415 1 11 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.492 -0.274 17915 2416 1 11 . 1 1 34 34 LEU H H 34 8.929 8.929 8.845 0.084 17915 2417 1 11 . 1 1 35 35 ASN N N 35 113.879 113.879 113.026 0.853 17915 2418 1 11 . 1 1 35 35 ASN C C 35 174.565 174.565 173.363 1.202 17915 2419 1 11 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.617 0.959 17915 2420 1 11 . 1 1 35 35 ASN H H 35 7.489 7.489 7.760 -0.271 17915 2421 1 11 . 1 1 36 36 SER N N 36 123.684 123.684 116.763 6.921 17915 2422 1 11 . 1 1 36 36 SER C C 36 173.503 173.503 173.694 -0.191 17915 2423 1 11 . 1 1 36 36 SER CA C 36 56.904 56.904 59.121 -2.217 17915 2424 1 11 . 1 1 36 36 SER H H 36 9.086 9.086 8.684 0.402 17915 2425 1 11 . 1 1 37 37 THR N N 37 115.012 115.012 115.355 -0.343 17915 2426 1 11 . 1 1 37 37 THR C C 37 175.417 175.417 173.406 2.011 17915 2427 1 11 . 1 1 37 37 THR CA C 37 65.521 65.521 63.305 2.216 17915 2428 1 11 . 1 1 37 37 THR H H 37 8.071 8.071 8.216 -0.145 17915 2429 1 11 . 1 1 38 38 ASN N N 38 122.517 122.517 118.718 3.799 17915 2430 1 11 . 1 1 38 38 ASN C C 38 174.696 174.696 174.614 0.082 17915 2431 1 11 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.492 0.987 17915 2432 1 11 . 1 1 38 38 ASN H H 38 8.595 8.595 7.958 0.637 17915 2433 1 11 . 1 1 39 39 LYS N N 39 120.851 120.851 121.986 -1.135 17915 2434 1 11 . 1 1 39 39 LYS C C 39 176.444 176.444 177.675 -1.231 17915 2435 1 11 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.580 -0.176 17915 2436 1 11 . 1 1 39 39 LYS H H 39 8.416 8.416 8.785 -0.369 17915 2437 1 11 . 1 1 40 40 ASP N N 40 114.427 114.427 119.761 -5.334 17915 2438 1 11 . 1 1 40 40 ASP C C 40 176.960 176.960 175.778 1.182 17915 2439 1 11 . 1 1 40 40 ASP CA C 40 55.352 55.352 56.886 -1.534 17915 2440 1 11 . 1 1 40 40 ASP H H 40 8.085 8.085 8.317 -0.232 17915 2441 1 11 . 1 1 41 41 TRP N N 41 122.708 122.708 118.755 3.953 17915 2442 1 11 . 1 1 41 41 TRP C C 41 174.303 174.303 174.510 -0.207 17915 2443 1 11 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.942 -0.734 17915 2444 1 11 . 1 1 41 41 TRP H H 41 8.096 8.096 7.717 0.379 17915 2445 1 11 . 1 1 42 42 TRP N N 42 124.707 124.707 125.748 -1.041 17915 2446 1 11 . 1 1 42 42 TRP C C 42 174.303 174.303 174.899 -0.596 17915 2447 1 11 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.309 -2.322 17915 2448 1 11 . 1 1 42 42 TRP H H 42 9.245 9.245 8.337 0.908 17915 2449 1 11 . 1 1 43 43 LYS N N 43 124.005 124.005 121.464 2.541 17915 2450 1 11 . 1 1 43 43 LYS C C 43 175.482 175.482 175.118 0.364 17915 2451 1 11 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.591 -0.212 17915 2452 1 11 . 1 1 43 43 LYS H H 43 8.783 8.783 8.352 0.431 17915 2453 1 11 . 1 1 44 44 VAL N N 44 122.139 122.139 117.988 4.151 17915 2454 1 11 . 1 1 44 44 VAL C C 44 173.472 173.472 173.518 -0.046 17915 2455 1 11 . 1 1 44 44 VAL CA C 44 59.072 59.072 60.048 -0.976 17915 2456 1 11 . 1 1 44 44 VAL H H 44 9.287 9.287 8.537 0.750 17915 2457 1 11 . 1 1 45 45 GLU N N 45 118.524 118.524 121.134 -2.610 17915 2458 1 11 . 1 1 45 45 GLU C C 45 174.827 174.827 175.178 -0.351 17915 2459 1 11 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.971 -0.797 17915 2460 1 11 . 1 1 45 45 GLU H H 45 8.566 8.566 8.031 0.535 17915 2461 1 11 . 1 1 46 46 VAL N N 46 124.904 124.904 122.944 1.960 17915 2462 1 11 . 1 1 46 46 VAL C C 46 174.608 174.608 175.496 -0.888 17915 2463 1 11 . 1 1 46 46 VAL CA C 46 60.651 60.651 59.271 1.380 17915 2464 1 11 . 1 1 46 46 VAL H H 46 8.774 8.774 8.035 0.739 17915 2465 1 11 . 1 1 47 47 ASN N N 47 126.530 126.530 126.360 0.170 17915 2466 1 11 . 1 1 47 47 ASN C C 47 174.259 174.259 174.854 -0.595 17915 2467 1 11 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.924 -0.679 17915 2468 1 11 . 1 1 47 47 ASN H H 47 9.356 9.356 9.239 0.117 17915 2469 1 11 . 1 1 48 48 ASP N N 48 112.420 112.420 118.894 -6.474 17915 2470 1 11 . 1 1 48 48 ASP C C 48 174.521 174.521 175.214 -0.693 17915 2471 1 11 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.056 0.627 17915 2472 1 11 . 1 1 48 48 ASP H H 48 8.628 8.628 8.598 0.030 17915 2473 1 11 . 1 1 49 49 ARG N N 49 120.379 120.379 120.395 -0.016 17915 2474 1 11 . 1 1 49 49 ARG C C 49 174.477 174.477 173.884 0.593 17915 2475 1 11 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.632 -0.334 17915 2476 1 11 . 1 1 49 49 ARG H H 49 8.069 8.069 8.003 0.066 17915 2477 1 11 . 1 1 50 50 GLN N N 50 118.647 118.647 118.570 0.077 17915 2478 1 11 . 1 1 50 50 GLN C C 50 175.963 175.963 173.953 2.010 17915 2479 1 11 . 1 1 50 50 GLN CA C 50 53.425 53.425 55.015 -1.590 17915 2480 1 11 . 1 1 50 50 GLN H H 50 8.432 8.432 8.330 0.102 17915 2481 1 11 . 1 1 51 51 GLY N N 51 107.028 107.028 109.381 -2.353 17915 2482 1 11 . 1 1 51 51 GLY C C 51 170.479 170.479 172.041 -1.562 17915 2483 1 11 . 1 1 51 51 GLY CA C 51 45.638 45.638 44.456 1.182 17915 2484 1 11 . 1 1 51 51 GLY H H 51 8.534 8.534 8.489 0.045 17915 2485 1 11 . 1 1 52 52 PHE N N 52 119.030 119.030 118.970 0.060 17915 2486 1 11 . 1 1 52 52 PHE C C 52 175.635 175.635 175.680 -0.045 17915 2487 1 11 . 1 1 52 52 PHE CA C 52 58.724 58.724 56.458 2.266 17915 2488 1 11 . 1 1 52 52 PHE H H 52 9.098 9.098 8.486 0.612 17915 2489 1 11 . 1 1 53 53 VAL N N 53 110.897 110.897 119.176 -8.279 17915 2490 1 11 . 1 1 53 53 VAL CA C 53 58.108 58.108 58.237 -0.129 17915 2491 1 11 . 1 1 53 53 VAL H H 53 8.942 8.942 8.251 0.691 17915 2492 1 11 . 1 1 55 55 ALA N N 55 129.055 129.055 124.936 4.119 17915 2493 1 11 . 1 1 55 55 ALA C C 55 178.565 178.565 178.913 -0.348 17915 2494 1 11 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.778 -0.149 17915 2495 1 11 . 1 1 55 55 ALA H H 55 7.355 7.355 8.878 -1.523 17915 2496 1 11 . 1 1 56 56 ALA N N 56 113.282 113.282 120.202 -6.920 17915 2497 1 11 . 1 1 56 56 ALA C C 56 178.214 178.214 177.899 0.315 17915 2498 1 11 . 1 1 56 56 ALA CA C 56 52.943 52.943 54.177 -1.234 17915 2499 1 11 . 1 1 56 56 ALA H H 56 7.750 7.750 8.229 -0.479 17915 2500 1 11 . 1 1 57 57 TYR N N 57 116.083 116.083 117.605 -1.522 17915 2501 1 11 . 1 1 57 57 TYR C C 57 174.565 174.565 174.740 -0.175 17915 2502 1 11 . 1 1 57 57 TYR CA C 57 56.422 56.422 59.126 -2.704 17915 2503 1 11 . 1 1 57 57 TYR H H 57 7.611 7.611 7.487 0.124 17915 2504 1 11 . 1 1 58 58 VAL N N 58 110.965 110.965 115.474 -4.509 17915 2505 1 11 . 1 1 58 58 VAL C C 58 173.647 173.647 174.476 -0.829 17915 2506 1 11 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.362 -1.120 17915 2507 1 11 . 1 1 58 58 VAL H H 58 7.301 7.301 7.398 -0.097 17915 2508 1 11 . 1 1 59 59 LYS N N 59 118.586 118.586 124.892 -6.306 17915 2509 1 11 . 1 1 59 59 LYS C C 59 176.160 176.160 175.048 1.112 17915 2510 1 11 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.608 -0.567 17915 2511 1 11 . 1 1 59 59 LYS H H 59 8.515 8.515 7.975 0.540 17915 2512 1 11 . 1 1 60 60 LYS N N 60 125.734 125.734 122.873 2.861 17915 2513 1 11 . 1 1 60 60 LYS C C 60 176.793 176.793 176.759 0.034 17915 2514 1 11 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.300 3.317 17915 2515 1 11 . 1 1 60 60 LYS H H 60 9.135 9.135 8.406 0.729 17915 2516 1 11 . 1 1 61 61 LEU N N 61 125.061 125.061 119.387 5.674 17915 2517 1 11 . 1 1 61 61 LEU C C 61 174.106 174.106 175.382 -1.276 17915 2518 1 11 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.733 -0.756 17915 2519 1 11 . 1 1 61 61 LEU H H 61 8.384 8.384 8.441 -0.057 17915 2520 1 12 . 1 1 2 2 ASP N N 2 123.220 123.220 122.403 0.817 17915 2521 1 12 . 1 1 2 2 ASP C C 2 175.703 175.703 176.068 -0.365 17915 2522 1 12 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.671 -0.630 17915 2523 1 12 . 1 1 2 2 ASP H H 2 8.738 8.738 8.487 0.251 17915 2524 1 12 . 1 1 3 3 GLU N N 3 121.895 121.895 117.307 4.588 17915 2525 1 12 . 1 1 3 3 GLU C C 3 176.480 176.480 174.617 1.863 17915 2526 1 12 . 1 1 3 3 GLU CA C 3 56.128 56.128 57.163 -1.034 17915 2527 1 12 . 1 1 3 3 GLU H H 3 8.570 8.570 8.708 -0.138 17915 2528 1 12 . 1 1 4 4 THR N N 4 114.607 114.607 111.109 3.498 17915 2529 1 12 . 1 1 4 4 THR C C 4 175.417 175.417 173.415 2.002 17915 2530 1 12 . 1 1 4 4 THR CA C 4 62.685 62.685 62.190 0.495 17915 2531 1 12 . 1 1 4 4 THR H H 4 8.176 8.176 7.906 0.270 17915 2532 1 12 . 1 1 5 5 GLY N N 5 111.430 111.430 109.591 1.839 17915 2533 1 12 . 1 1 5 5 GLY C C 5 173.777 173.777 173.021 0.756 17915 2534 1 12 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.635 -0.075 17915 2535 1 12 . 1 1 5 5 GLY H H 5 8.344 8.344 7.980 0.364 17915 2536 1 12 . 1 1 6 6 LYS N N 6 119.850 119.850 124.764 -4.914 17915 2537 1 12 . 1 1 6 6 LYS C C 6 176.049 176.049 176.764 -0.715 17915 2538 1 12 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.230 -1.315 17915 2539 1 12 . 1 1 6 6 LYS H H 6 7.903 7.903 8.305 -0.402 17915 2540 1 12 . 1 1 7 7 GLU N N 7 123.025 123.025 120.194 2.831 17915 2541 1 12 . 1 1 7 7 GLU C C 7 174.172 174.172 174.494 -0.322 17915 2542 1 12 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.375 -1.916 17915 2543 1 12 . 1 1 7 7 GLU H H 7 8.562 8.562 8.793 -0.231 17915 2544 1 12 . 1 1 8 8 LEU N N 8 123.147 123.147 117.211 5.936 17915 2545 1 12 . 1 1 8 8 LEU C C 8 177.495 177.495 174.729 2.766 17915 2546 1 12 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.493 -0.068 17915 2547 1 12 . 1 1 8 8 LEU H H 8 8.292 8.292 7.390 0.902 17915 2548 1 12 . 1 1 9 9 VAL N N 9 111.799 111.799 118.800 -7.001 17915 2549 1 12 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.328 -2.434 17915 2550 1 12 . 1 1 9 9 VAL H H 9 9.051 9.051 8.218 0.833 17915 2551 1 12 . 1 1 10 10 LEU N N 10 123.127 123.127 125.347 -2.220 17915 2552 1 12 . 1 1 10 10 LEU C C 10 176.729 176.729 175.862 0.867 17915 2553 1 12 . 1 1 10 10 LEU CA C 10 52.489 52.489 54.039 -1.550 17915 2554 1 12 . 1 1 10 10 LEU H H 10 8.864 8.864 8.876 -0.012 17915 2555 1 12 . 1 1 11 11 ALA N N 11 126.907 126.907 126.328 0.579 17915 2556 1 12 . 1 1 11 11 ALA C C 11 178.406 178.406 176.435 1.971 17915 2557 1 12 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.457 1.058 17915 2558 1 12 . 1 1 11 11 ALA H H 11 8.988 8.988 8.491 0.497 17915 2559 1 12 . 1 1 12 12 LEU N N 12 127.694 127.694 125.922 1.772 17915 2560 1 12 . 1 1 12 12 LEU C C 12 175.046 175.046 176.286 -1.240 17915 2561 1 12 . 1 1 12 12 LEU CA C 12 55.727 55.727 55.862 -0.135 17915 2562 1 12 . 1 1 12 12 LEU H H 12 9.136 9.136 8.186 0.950 17915 2563 1 12 . 1 1 13 13 TYR N N 13 111.415 111.415 117.679 -6.264 17915 2564 1 12 . 1 1 13 13 TYR C C 13 173.844 173.844 174.540 -0.696 17915 2565 1 12 . 1 1 13 13 TYR CA C 13 54.656 54.656 57.483 -2.827 17915 2566 1 12 . 1 1 13 13 TYR H H 13 6.979 6.979 7.598 -0.619 17915 2567 1 12 . 1 1 14 14 ASP N N 14 117.591 117.591 122.163 -4.572 17915 2568 1 12 . 1 1 14 14 ASP C C 14 176.140 176.140 175.676 0.464 17915 2569 1 12 . 1 1 14 14 ASP CA C 14 54.522 54.522 57.057 -2.535 17915 2570 1 12 . 1 1 14 14 ASP H H 14 8.260 8.260 8.223 0.037 17915 2571 1 12 . 1 1 15 15 TYR N N 15 119.917 119.917 115.431 4.486 17915 2572 1 12 . 1 1 15 15 TYR C C 15 172.859 172.859 175.432 -2.573 17915 2573 1 12 . 1 1 15 15 TYR CA C 15 59.661 59.661 59.068 0.593 17915 2574 1 12 . 1 1 15 15 TYR H H 15 8.580 8.580 8.027 0.553 17915 2575 1 12 . 1 1 16 16 GLN N N 16 127.024 127.024 119.286 7.738 17915 2576 1 12 . 1 1 16 16 GLN C C 16 176.377 176.377 175.775 0.602 17915 2577 1 12 . 1 1 16 16 GLN CA C 16 53.666 53.666 56.345 -2.679 17915 2578 1 12 . 1 1 16 16 GLN H H 16 7.450 7.450 7.949 -0.499 17915 2579 1 12 . 1 1 17 17 GLU N N 17 122.837 122.837 124.015 -1.178 17915 2580 1 12 . 1 1 17 17 GLU C C 17 176.140 176.140 177.036 -0.896 17915 2581 1 12 . 1 1 17 17 GLU CA C 17 56.075 56.075 55.509 0.566 17915 2582 1 12 . 1 1 17 17 GLU H H 17 7.899 7.899 8.377 -0.478 17915 2583 1 12 . 1 1 18 18 LYS N N 18 120.622 120.622 119.148 1.474 17915 2584 1 12 . 1 1 18 18 LYS C C 18 176.267 176.267 176.150 0.117 17915 2585 1 12 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.339 -1.094 17915 2586 1 12 . 1 1 18 18 LYS H H 18 8.649 8.649 8.475 0.174 17915 2587 1 12 . 1 1 19 19 SER N N 19 115.184 115.184 115.970 -0.786 17915 2588 1 12 . 1 1 19 19 SER CA C 19 56.824 56.824 57.944 -1.120 17915 2589 1 12 . 1 1 19 19 SER H H 19 7.552 7.552 7.888 -0.336 17915 2590 1 12 . 1 1 21 21 ARG N N 21 113.440 113.440 117.343 -3.903 17915 2591 1 12 . 1 1 21 21 ARG C C 21 176.638 176.638 176.046 0.592 17915 2592 1 12 . 1 1 21 21 ARG CA C 21 56.208 56.208 55.998 0.210 17915 2593 1 12 . 1 1 21 21 ARG H H 21 7.596 7.596 7.795 -0.199 17915 2594 1 12 . 1 1 22 22 GLU N N 22 121.392 121.392 119.350 2.042 17915 2595 1 12 . 1 1 22 22 GLU C C 22 174.500 174.500 174.474 0.026 17915 2596 1 12 . 1 1 22 22 GLU CA C 22 55.352 55.352 57.052 -1.700 17915 2597 1 12 . 1 1 22 22 GLU H H 22 7.746 7.746 7.791 -0.045 17915 2598 1 12 . 1 1 23 23 VAL N N 23 114.115 114.115 116.431 -2.316 17915 2599 1 12 . 1 1 23 23 VAL C C 23 172.337 172.337 173.886 -1.549 17915 2600 1 12 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.674 -0.799 17915 2601 1 12 . 1 1 23 23 VAL H H 23 7.318 7.318 7.893 -0.575 17915 2602 1 12 . 1 1 24 24 THR N N 24 118.996 118.996 119.632 -0.636 17915 2603 1 12 . 1 1 24 24 THR C C 24 174.451 174.451 173.138 1.313 17915 2604 1 12 . 1 1 24 24 THR CA C 24 61.641 61.641 60.883 0.758 17915 2605 1 12 . 1 1 24 24 THR H H 24 7.324 7.324 8.383 -1.059 17915 2606 1 12 . 1 1 25 25 MET N N 25 121.901 121.901 123.895 -1.994 17915 2607 1 12 . 1 1 25 25 MET C C 25 173.931 173.931 174.283 -0.352 17915 2608 1 12 . 1 1 25 25 MET CA C 25 54.389 54.389 53.349 1.040 17915 2609 1 12 . 1 1 25 25 MET H H 25 9.432 9.432 7.894 1.538 17915 2610 1 12 . 1 1 26 26 LYS N N 26 124.169 124.169 121.353 2.816 17915 2611 1 12 . 1 1 26 26 LYS C C 26 175.002 175.002 176.089 -1.087 17915 2612 1 12 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.064 -1.398 17915 2613 1 12 . 1 1 26 26 LYS H H 26 8.634 8.634 8.530 0.104 17915 2614 1 12 . 1 1 27 27 LYS N N 27 122.603 122.603 123.740 -1.137 17915 2615 1 12 . 1 1 27 27 LYS C C 27 177.318 177.318 177.298 0.020 17915 2616 1 12 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.684 0.960 17915 2617 1 12 . 1 1 27 27 LYS H H 27 8.919 8.919 8.714 0.205 17915 2618 1 12 . 1 1 28 28 GLY N N 28 115.585 115.585 111.775 3.810 17915 2619 1 12 . 1 1 28 28 GLY C C 28 174.193 174.193 174.376 -0.183 17915 2620 1 12 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.778 0.111 17915 2621 1 12 . 1 1 28 28 GLY H H 28 8.732 8.732 8.530 0.202 17915 2622 1 12 . 1 1 29 29 ASP N N 29 121.770 121.770 120.823 0.947 17915 2623 1 12 . 1 1 29 29 ASP C C 29 174.281 174.281 174.769 -0.488 17915 2624 1 12 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.682 0.804 17915 2625 1 12 . 1 1 29 29 ASP H H 29 8.388 8.388 7.627 0.761 17915 2626 1 12 . 1 1 30 30 ILE N N 30 120.469 120.469 120.190 0.279 17915 2627 1 12 . 1 1 30 30 ILE C C 30 176.356 176.356 175.642 0.714 17915 2628 1 12 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.833 -0.584 17915 2629 1 12 . 1 1 30 30 ILE H H 30 8.033 8.033 8.343 -0.310 17915 2630 1 12 . 1 1 31 31 LEU N N 31 127.129 127.129 130.310 -3.181 17915 2631 1 12 . 1 1 31 31 LEU C C 31 175.745 175.745 176.106 -0.361 17915 2632 1 12 . 1 1 31 31 LEU CA C 31 53.907 53.907 54.208 -0.301 17915 2633 1 12 . 1 1 31 31 LEU H H 31 9.223 9.223 8.276 0.947 17915 2634 1 12 . 1 1 32 32 THR N N 32 117.055 117.055 118.381 -1.326 17915 2635 1 12 . 1 1 32 32 THR C C 32 173.844 173.844 174.262 -0.418 17915 2636 1 12 . 1 1 32 32 THR CA C 32 63.247 63.247 61.248 1.999 17915 2637 1 12 . 1 1 32 32 THR H H 32 8.360 8.360 8.469 -0.109 17915 2638 1 12 . 1 1 33 33 LEU N N 33 128.815 128.815 125.600 3.215 17915 2639 1 12 . 1 1 33 33 LEU C C 33 174.718 174.718 176.231 -1.513 17915 2640 1 12 . 1 1 33 33 LEU CA C 33 54.870 54.870 55.107 -0.237 17915 2641 1 12 . 1 1 33 33 LEU H H 33 8.937 8.937 8.667 0.270 17915 2642 1 12 . 1 1 34 34 LEU N N 34 126.230 126.230 126.203 0.027 17915 2643 1 12 . 1 1 34 34 LEU C C 34 177.689 177.689 176.600 1.089 17915 2644 1 12 . 1 1 34 34 LEU CA C 34 55.218 55.218 56.063 -0.845 17915 2645 1 12 . 1 1 34 34 LEU H H 34 8.929 8.929 8.851 0.078 17915 2646 1 12 . 1 1 35 35 ASN N N 35 113.879 113.879 115.187 -1.308 17915 2647 1 12 . 1 1 35 35 ASN C C 35 174.565 174.565 172.928 1.637 17915 2648 1 12 . 1 1 35 35 ASN CA C 35 54.576 54.576 52.634 1.942 17915 2649 1 12 . 1 1 35 35 ASN H H 35 7.489 7.489 7.876 -0.387 17915 2650 1 12 . 1 1 36 36 SER N N 36 123.684 123.684 115.649 8.035 17915 2651 1 12 . 1 1 36 36 SER C C 36 173.503 173.503 174.125 -0.622 17915 2652 1 12 . 1 1 36 36 SER CA C 36 56.904 56.904 57.866 -0.962 17915 2653 1 12 . 1 1 36 36 SER H H 36 9.086 9.086 8.520 0.566 17915 2654 1 12 . 1 1 37 37 THR N N 37 115.012 115.012 119.912 -4.900 17915 2655 1 12 . 1 1 37 37 THR C C 37 175.417 175.417 174.479 0.938 17915 2656 1 12 . 1 1 37 37 THR CA C 37 65.521 65.521 62.446 3.075 17915 2657 1 12 . 1 1 37 37 THR H H 37 8.071 8.071 8.467 -0.396 17915 2658 1 12 . 1 1 38 38 ASN N N 38 122.517 122.517 119.741 2.776 17915 2659 1 12 . 1 1 38 38 ASN C C 38 174.696 174.696 174.824 -0.128 17915 2660 1 12 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.841 0.638 17915 2661 1 12 . 1 1 38 38 ASN H H 38 8.595 8.595 8.280 0.315 17915 2662 1 12 . 1 1 39 39 LYS N N 39 120.851 120.851 120.993 -0.142 17915 2663 1 12 . 1 1 39 39 LYS C C 39 176.444 176.444 176.783 -0.339 17915 2664 1 12 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.036 0.367 17915 2665 1 12 . 1 1 39 39 LYS H H 39 8.416 8.416 8.685 -0.269 17915 2666 1 12 . 1 1 40 40 ASP N N 40 114.427 114.427 117.539 -3.112 17915 2667 1 12 . 1 1 40 40 ASP C C 40 176.960 176.960 176.690 0.270 17915 2668 1 12 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.623 -0.272 17915 2669 1 12 . 1 1 40 40 ASP H H 40 8.085 8.085 8.236 -0.151 17915 2670 1 12 . 1 1 41 41 TRP N N 41 122.708 122.708 120.772 1.936 17915 2671 1 12 . 1 1 41 41 TRP C C 41 174.303 174.303 175.042 -0.739 17915 2672 1 12 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.638 -0.430 17915 2673 1 12 . 1 1 41 41 TRP H H 41 8.096 8.096 7.857 0.239 17915 2674 1 12 . 1 1 42 42 TRP N N 42 124.707 124.707 124.246 0.461 17915 2675 1 12 . 1 1 42 42 TRP C C 42 174.303 174.303 174.679 -0.376 17915 2676 1 12 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.096 -2.109 17915 2677 1 12 . 1 1 42 42 TRP H H 42 9.245 9.245 8.267 0.978 17915 2678 1 12 . 1 1 43 43 LYS N N 43 124.005 124.005 124.682 -0.677 17915 2679 1 12 . 1 1 43 43 LYS C C 43 175.482 175.482 174.611 0.871 17915 2680 1 12 . 1 1 43 43 LYS CA C 43 55.379 55.379 54.922 0.457 17915 2681 1 12 . 1 1 43 43 LYS H H 43 8.783 8.783 8.320 0.463 17915 2682 1 12 . 1 1 44 44 VAL N N 44 122.139 122.139 123.171 -1.032 17915 2683 1 12 . 1 1 44 44 VAL C C 44 173.472 173.472 173.910 -0.438 17915 2684 1 12 . 1 1 44 44 VAL CA C 44 59.072 59.072 60.394 -1.322 17915 2685 1 12 . 1 1 44 44 VAL H H 44 9.287 9.287 8.523 0.764 17915 2686 1 12 . 1 1 45 45 GLU N N 45 118.524 118.524 126.076 -7.552 17915 2687 1 12 . 1 1 45 45 GLU C C 45 174.827 174.827 174.833 -0.006 17915 2688 1 12 . 1 1 45 45 GLU CA C 45 54.174 54.174 55.078 -0.904 17915 2689 1 12 . 1 1 45 45 GLU H H 45 8.566 8.566 8.106 0.460 17915 2690 1 12 . 1 1 46 46 VAL N N 46 124.904 124.904 122.347 2.557 17915 2691 1 12 . 1 1 46 46 VAL C C 46 174.608 174.608 175.983 -1.375 17915 2692 1 12 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.495 -0.844 17915 2693 1 12 . 1 1 46 46 VAL H H 46 8.774 8.774 8.356 0.418 17915 2694 1 12 . 1 1 47 47 ASN N N 47 126.530 126.530 127.086 -0.556 17915 2695 1 12 . 1 1 47 47 ASN C C 47 174.259 174.259 174.730 -0.471 17915 2696 1 12 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.367 0.878 17915 2697 1 12 . 1 1 47 47 ASN H H 47 9.356 9.356 9.023 0.334 17915 2698 1 12 . 1 1 48 48 ASP N N 48 112.420 112.420 119.521 -7.101 17915 2699 1 12 . 1 1 48 48 ASP C C 48 174.521 174.521 174.590 -0.069 17915 2700 1 12 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.038 -0.355 17915 2701 1 12 . 1 1 48 48 ASP H H 48 8.628 8.628 8.679 -0.051 17915 2702 1 12 . 1 1 49 49 ARG N N 49 120.379 120.379 120.714 -0.335 17915 2703 1 12 . 1 1 49 49 ARG C C 49 174.477 174.477 174.595 -0.118 17915 2704 1 12 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.436 -0.138 17915 2705 1 12 . 1 1 49 49 ARG H H 49 8.069 8.069 8.021 0.048 17915 2706 1 12 . 1 1 50 50 GLN N N 50 118.647 118.647 121.412 -2.765 17915 2707 1 12 . 1 1 50 50 GLN C C 50 175.963 175.963 174.793 1.170 17915 2708 1 12 . 1 1 50 50 GLN CA C 50 53.425 53.425 55.033 -1.608 17915 2709 1 12 . 1 1 50 50 GLN H H 50 8.432 8.432 8.278 0.154 17915 2710 1 12 . 1 1 51 51 GLY N N 51 107.028 107.028 108.906 -1.878 17915 2711 1 12 . 1 1 51 51 GLY C C 51 170.479 170.479 171.357 -0.878 17915 2712 1 12 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.660 -0.022 17915 2713 1 12 . 1 1 51 51 GLY H H 51 8.534 8.534 8.564 -0.030 17915 2714 1 12 . 1 1 52 52 PHE N N 52 119.030 119.030 120.811 -1.781 17915 2715 1 12 . 1 1 52 52 PHE C C 52 175.635 175.635 173.723 1.912 17915 2716 1 12 . 1 1 52 52 PHE CA C 52 58.724 58.724 57.232 1.492 17915 2717 1 12 . 1 1 52 52 PHE H H 52 9.098 9.098 8.242 0.856 17915 2718 1 12 . 1 1 53 53 VAL N N 53 110.897 110.897 124.126 -13.229 17915 2719 1 12 . 1 1 53 53 VAL CA C 53 58.108 58.108 57.520 0.588 17915 2720 1 12 . 1 1 53 53 VAL H H 53 8.942 8.942 7.730 1.212 17915 2721 1 12 . 1 1 55 55 ALA N N 55 129.055 129.055 128.825 0.230 17915 2722 1 12 . 1 1 55 55 ALA C C 55 178.565 178.565 178.331 0.234 17915 2723 1 12 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.579 0.050 17915 2724 1 12 . 1 1 55 55 ALA H H 55 7.355 7.355 8.309 -0.954 17915 2725 1 12 . 1 1 56 56 ALA N N 56 113.282 113.282 118.563 -5.281 17915 2726 1 12 . 1 1 56 56 ALA C C 56 178.214 178.214 177.890 0.324 17915 2727 1 12 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.828 -0.885 17915 2728 1 12 . 1 1 56 56 ALA H H 56 7.750 7.750 8.059 -0.309 17915 2729 1 12 . 1 1 57 57 TYR N N 57 116.083 116.083 118.046 -1.963 17915 2730 1 12 . 1 1 57 57 TYR C C 57 174.565 174.565 174.087 0.478 17915 2731 1 12 . 1 1 57 57 TYR CA C 57 56.422 56.422 57.106 -0.684 17915 2732 1 12 . 1 1 57 57 TYR H H 57 7.611 7.611 7.512 0.099 17915 2733 1 12 . 1 1 58 58 VAL N N 58 110.965 110.965 110.832 0.133 17915 2734 1 12 . 1 1 58 58 VAL C C 58 173.647 173.647 174.297 -0.650 17915 2735 1 12 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.221 -0.979 17915 2736 1 12 . 1 1 58 58 VAL H H 58 7.301 7.301 7.229 0.072 17915 2737 1 12 . 1 1 59 59 LYS N N 59 118.586 118.586 121.566 -2.980 17915 2738 1 12 . 1 1 59 59 LYS C C 59 176.160 176.160 175.310 0.850 17915 2739 1 12 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.367 -1.326 17915 2740 1 12 . 1 1 59 59 LYS H H 59 8.515 8.515 8.497 0.018 17915 2741 1 12 . 1 1 60 60 LYS N N 60 125.734 125.734 123.160 2.574 17915 2742 1 12 . 1 1 60 60 LYS C C 60 176.793 176.793 176.552 0.241 17915 2743 1 12 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.443 3.174 17915 2744 1 12 . 1 1 60 60 LYS H H 60 9.135 9.135 8.643 0.492 17915 2745 1 12 . 1 1 61 61 LEU N N 61 125.061 125.061 120.544 4.517 17915 2746 1 12 . 1 1 61 61 LEU C C 61 174.106 174.106 175.282 -1.176 17915 2747 1 12 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.815 -0.838 17915 2748 1 12 . 1 1 61 61 LEU H H 61 8.384 8.384 8.950 -0.566 17915 2749 1 13 . 1 1 2 2 ASP N N 2 123.220 123.220 121.313 1.907 17915 2750 1 13 . 1 1 2 2 ASP C C 2 175.703 175.703 175.348 0.355 17915 2751 1 13 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.367 -0.326 17915 2752 1 13 . 1 1 2 2 ASP H H 2 8.738 8.738 8.411 0.327 17915 2753 1 13 . 1 1 3 3 GLU N N 3 121.895 121.895 120.590 1.305 17915 2754 1 13 . 1 1 3 3 GLU C C 3 176.480 176.480 175.013 1.467 17915 2755 1 13 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.718 -0.590 17915 2756 1 13 . 1 1 3 3 GLU H H 3 8.570 8.570 8.636 -0.066 17915 2757 1 13 . 1 1 4 4 THR N N 4 114.607 114.607 115.694 -1.087 17915 2758 1 13 . 1 1 4 4 THR C C 4 175.417 175.417 173.736 1.681 17915 2759 1 13 . 1 1 4 4 THR CA C 4 62.685 62.685 62.775 -0.090 17915 2760 1 13 . 1 1 4 4 THR H H 4 8.176 8.176 8.429 -0.253 17915 2761 1 13 . 1 1 5 5 GLY N N 5 111.430 111.430 109.539 1.891 17915 2762 1 13 . 1 1 5 5 GLY C C 5 173.777 173.777 172.709 1.068 17915 2763 1 13 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.096 0.464 17915 2764 1 13 . 1 1 5 5 GLY H H 5 8.344 8.344 7.951 0.393 17915 2765 1 13 . 1 1 6 6 LYS N N 6 119.850 119.850 124.090 -4.240 17915 2766 1 13 . 1 1 6 6 LYS C C 6 176.049 176.049 176.518 -0.469 17915 2767 1 13 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.542 -1.628 17915 2768 1 13 . 1 1 6 6 LYS H H 6 7.903 7.903 8.241 -0.338 17915 2769 1 13 . 1 1 7 7 GLU N N 7 123.025 123.025 119.970 3.055 17915 2770 1 13 . 1 1 7 7 GLU C C 7 174.172 174.172 174.788 -0.616 17915 2771 1 13 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.786 -2.327 17915 2772 1 13 . 1 1 7 7 GLU H H 7 8.562 8.562 8.767 -0.205 17915 2773 1 13 . 1 1 8 8 LEU N N 8 123.147 123.147 117.060 6.087 17915 2774 1 13 . 1 1 8 8 LEU C C 8 177.495 177.495 174.740 2.755 17915 2775 1 13 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.850 -0.425 17915 2776 1 13 . 1 1 8 8 LEU H H 8 8.292 8.292 7.326 0.966 17915 2777 1 13 . 1 1 9 9 VAL N N 9 111.799 111.799 118.691 -6.892 17915 2778 1 13 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.214 -2.320 17915 2779 1 13 . 1 1 9 9 VAL H H 9 9.051 9.051 7.983 1.068 17915 2780 1 13 . 1 1 10 10 LEU N N 10 123.127 123.127 126.771 -3.644 17915 2781 1 13 . 1 1 10 10 LEU C C 10 176.729 176.729 175.140 1.589 17915 2782 1 13 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.998 -0.509 17915 2783 1 13 . 1 1 10 10 LEU H H 10 8.864 8.864 8.949 -0.085 17915 2784 1 13 . 1 1 11 11 ALA N N 11 126.907 126.907 125.965 0.942 17915 2785 1 13 . 1 1 11 11 ALA C C 11 178.406 178.406 177.051 1.355 17915 2786 1 13 . 1 1 11 11 ALA CA C 11 52.515 52.515 52.188 0.327 17915 2787 1 13 . 1 1 11 11 ALA H H 11 8.988 8.988 8.031 0.957 17915 2788 1 13 . 1 1 12 12 LEU N N 12 127.694 127.694 125.585 2.109 17915 2789 1 13 . 1 1 12 12 LEU C C 12 175.046 175.046 176.597 -1.551 17915 2790 1 13 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.201 -0.474 17915 2791 1 13 . 1 1 12 12 LEU H H 12 9.136 9.136 8.973 0.163 17915 2792 1 13 . 1 1 13 13 TYR N N 13 111.415 111.415 116.436 -5.021 17915 2793 1 13 . 1 1 13 13 TYR C C 13 173.844 173.844 173.272 0.572 17915 2794 1 13 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.573 -1.917 17915 2795 1 13 . 1 1 13 13 TYR H H 13 6.979 6.979 7.691 -0.712 17915 2796 1 13 . 1 1 14 14 ASP N N 14 117.591 117.591 121.029 -3.438 17915 2797 1 13 . 1 1 14 14 ASP C C 14 176.140 176.140 174.241 1.899 17915 2798 1 13 . 1 1 14 14 ASP CA C 14 54.522 54.522 54.549 -0.027 17915 2799 1 13 . 1 1 14 14 ASP H H 14 8.260 8.260 7.775 0.485 17915 2800 1 13 . 1 1 15 15 TYR N N 15 119.917 119.917 120.316 -0.399 17915 2801 1 13 . 1 1 15 15 TYR C C 15 172.859 172.859 173.557 -0.698 17915 2802 1 13 . 1 1 15 15 TYR CA C 15 59.661 59.661 57.713 1.948 17915 2803 1 13 . 1 1 15 15 TYR H H 15 8.580 8.580 7.891 0.689 17915 2804 1 13 . 1 1 16 16 GLN N N 16 127.024 127.024 119.756 7.268 17915 2805 1 13 . 1 1 16 16 GLN C C 16 176.377 176.377 174.394 1.983 17915 2806 1 13 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.142 -1.476 17915 2807 1 13 . 1 1 16 16 GLN H H 16 7.450 7.450 8.481 -1.031 17915 2808 1 13 . 1 1 17 17 GLU N N 17 122.837 122.837 125.259 -2.422 17915 2809 1 13 . 1 1 17 17 GLU C C 17 176.140 176.140 176.184 -0.044 17915 2810 1 13 . 1 1 17 17 GLU CA C 17 56.075 56.075 55.248 0.827 17915 2811 1 13 . 1 1 17 17 GLU H H 17 7.899 7.899 8.780 -0.881 17915 2812 1 13 . 1 1 18 18 LYS N N 18 120.622 120.622 118.743 1.879 17915 2813 1 13 . 1 1 18 18 LYS C C 18 176.267 176.267 175.276 0.991 17915 2814 1 13 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.304 -1.059 17915 2815 1 13 . 1 1 18 18 LYS H H 18 8.649 8.649 8.494 0.155 17915 2816 1 13 . 1 1 19 19 SER N N 19 115.184 115.184 114.064 1.120 17915 2817 1 13 . 1 1 19 19 SER CA C 19 56.824 56.824 55.761 1.063 17915 2818 1 13 . 1 1 19 19 SER H H 19 7.552 7.552 7.917 -0.365 17915 2819 1 13 . 1 1 21 21 ARG N N 21 113.440 113.440 117.161 -3.721 17915 2820 1 13 . 1 1 21 21 ARG C C 21 176.638 176.638 175.908 0.730 17915 2821 1 13 . 1 1 21 21 ARG CA C 21 56.208 56.208 57.301 -1.093 17915 2822 1 13 . 1 1 21 21 ARG H H 21 7.596 7.596 8.325 -0.729 17915 2823 1 13 . 1 1 22 22 GLU N N 22 121.392 121.392 117.146 4.246 17915 2824 1 13 . 1 1 22 22 GLU C C 22 174.500 174.500 175.174 -0.674 17915 2825 1 13 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.389 -1.037 17915 2826 1 13 . 1 1 22 22 GLU H H 22 7.746 7.746 7.287 0.459 17915 2827 1 13 . 1 1 23 23 VAL N N 23 114.115 114.115 114.093 0.022 17915 2828 1 13 . 1 1 23 23 VAL C C 23 172.337 172.337 174.610 -2.273 17915 2829 1 13 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.557 -0.682 17915 2830 1 13 . 1 1 23 23 VAL H H 23 7.318 7.318 8.316 -0.998 17915 2831 1 13 . 1 1 24 24 THR N N 24 118.996 118.996 114.482 4.514 17915 2832 1 13 . 1 1 24 24 THR C C 24 174.451 174.451 173.859 0.592 17915 2833 1 13 . 1 1 24 24 THR CA C 24 61.641 61.641 60.835 0.806 17915 2834 1 13 . 1 1 24 24 THR H H 24 7.324 7.324 8.107 -0.783 17915 2835 1 13 . 1 1 25 25 MET N N 25 121.901 121.901 118.522 3.379 17915 2836 1 13 . 1 1 25 25 MET C C 25 173.931 173.931 174.122 -0.191 17915 2837 1 13 . 1 1 25 25 MET CA C 25 54.389 54.389 54.184 0.205 17915 2838 1 13 . 1 1 25 25 MET H H 25 9.432 9.432 8.613 0.819 17915 2839 1 13 . 1 1 26 26 LYS N N 26 124.169 124.169 121.703 2.466 17915 2840 1 13 . 1 1 26 26 LYS C C 26 175.002 175.002 176.521 -1.519 17915 2841 1 13 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.898 -1.232 17915 2842 1 13 . 1 1 26 26 LYS H H 26 8.634 8.634 8.506 0.128 17915 2843 1 13 . 1 1 27 27 LYS N N 27 122.603 122.603 125.631 -3.028 17915 2844 1 13 . 1 1 27 27 LYS C C 27 177.318 177.318 176.911 0.407 17915 2845 1 13 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.825 0.819 17915 2846 1 13 . 1 1 27 27 LYS H H 27 8.919 8.919 8.807 0.112 17915 2847 1 13 . 1 1 28 28 GLY N N 28 115.585 115.585 113.801 1.784 17915 2848 1 13 . 1 1 28 28 GLY C C 28 174.193 174.193 174.579 -0.386 17915 2849 1 13 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.916 -0.028 17915 2850 1 13 . 1 1 28 28 GLY H H 28 8.732 8.732 8.936 -0.204 17915 2851 1 13 . 1 1 29 29 ASP N N 29 121.770 121.770 121.573 0.197 17915 2852 1 13 . 1 1 29 29 ASP C C 29 174.281 174.281 175.306 -1.025 17915 2853 1 13 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.441 1.045 17915 2854 1 13 . 1 1 29 29 ASP H H 29 8.388 8.388 8.014 0.374 17915 2855 1 13 . 1 1 30 30 ILE N N 30 120.469 120.469 116.729 3.740 17915 2856 1 13 . 1 1 30 30 ILE C C 30 176.356 176.356 174.685 1.671 17915 2857 1 13 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.446 0.803 17915 2858 1 13 . 1 1 30 30 ILE H H 30 8.033 8.033 8.021 0.012 17915 2859 1 13 . 1 1 31 31 LEU N N 31 127.129 127.129 126.553 0.576 17915 2860 1 13 . 1 1 31 31 LEU C C 31 175.745 175.745 175.691 0.054 17915 2861 1 13 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.283 0.624 17915 2862 1 13 . 1 1 31 31 LEU H H 31 9.223 9.223 8.483 0.740 17915 2863 1 13 . 1 1 32 32 THR N N 32 117.055 117.055 115.642 1.413 17915 2864 1 13 . 1 1 32 32 THR C C 32 173.844 173.844 173.734 0.110 17915 2865 1 13 . 1 1 32 32 THR CA C 32 63.247 63.247 60.808 2.439 17915 2866 1 13 . 1 1 32 32 THR H H 32 8.360 8.360 8.232 0.128 17915 2867 1 13 . 1 1 33 33 LEU N N 33 128.815 128.815 121.885 6.930 17915 2868 1 13 . 1 1 33 33 LEU C C 33 174.718 174.718 175.557 -0.839 17915 2869 1 13 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.611 0.259 17915 2870 1 13 . 1 1 33 33 LEU H H 33 8.937 8.937 8.291 0.646 17915 2871 1 13 . 1 1 34 34 LEU N N 34 126.230 126.230 124.811 1.419 17915 2872 1 13 . 1 1 34 34 LEU C C 34 177.689 177.689 177.050 0.639 17915 2873 1 13 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.855 -0.637 17915 2874 1 13 . 1 1 34 34 LEU H H 34 8.929 8.929 8.604 0.325 17915 2875 1 13 . 1 1 35 35 ASN N N 35 113.879 113.879 115.187 -1.308 17915 2876 1 13 . 1 1 35 35 ASN C C 35 174.565 174.565 173.268 1.297 17915 2877 1 13 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.328 1.248 17915 2878 1 13 . 1 1 35 35 ASN H H 35 7.489 7.489 7.666 -0.177 17915 2879 1 13 . 1 1 36 36 SER N N 36 123.684 123.684 117.519 6.165 17915 2880 1 13 . 1 1 36 36 SER C C 36 173.503 173.503 174.521 -1.018 17915 2881 1 13 . 1 1 36 36 SER CA C 36 56.904 56.904 57.716 -0.812 17915 2882 1 13 . 1 1 36 36 SER H H 36 9.086 9.086 8.530 0.556 17915 2883 1 13 . 1 1 37 37 THR N N 37 115.012 115.012 117.926 -2.914 17915 2884 1 13 . 1 1 37 37 THR C C 37 175.417 175.417 174.398 1.019 17915 2885 1 13 . 1 1 37 37 THR CA C 37 65.521 65.521 63.368 2.153 17915 2886 1 13 . 1 1 37 37 THR H H 37 8.071 8.071 8.478 -0.407 17915 2887 1 13 . 1 1 38 38 ASN N N 38 122.517 122.517 116.548 5.969 17915 2888 1 13 . 1 1 38 38 ASN C C 38 174.696 174.696 173.347 1.349 17915 2889 1 13 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.392 1.087 17915 2890 1 13 . 1 1 38 38 ASN H H 38 8.595 8.595 7.393 1.202 17915 2891 1 13 . 1 1 39 39 LYS N N 39 120.851 120.851 119.001 1.850 17915 2892 1 13 . 1 1 39 39 LYS C C 39 176.444 176.444 176.471 -0.027 17915 2893 1 13 . 1 1 39 39 LYS CA C 39 58.403 58.403 57.934 0.469 17915 2894 1 13 . 1 1 39 39 LYS H H 39 8.416 8.416 8.445 -0.029 17915 2895 1 13 . 1 1 40 40 ASP N N 40 114.427 114.427 117.649 -3.222 17915 2896 1 13 . 1 1 40 40 ASP C C 40 176.960 176.960 175.455 1.505 17915 2897 1 13 . 1 1 40 40 ASP CA C 40 55.352 55.352 54.868 0.484 17915 2898 1 13 . 1 1 40 40 ASP H H 40 8.085 8.085 8.103 -0.018 17915 2899 1 13 . 1 1 41 41 TRP N N 41 122.708 122.708 119.954 2.754 17915 2900 1 13 . 1 1 41 41 TRP C C 41 174.303 174.303 174.575 -0.272 17915 2901 1 13 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.351 -0.143 17915 2902 1 13 . 1 1 41 41 TRP H H 41 8.096 8.096 7.665 0.431 17915 2903 1 13 . 1 1 42 42 TRP N N 42 124.707 124.707 124.012 0.695 17915 2904 1 13 . 1 1 42 42 TRP C C 42 174.303 174.303 174.993 -0.690 17915 2905 1 13 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.404 -2.417 17915 2906 1 13 . 1 1 42 42 TRP H H 42 9.245 9.245 8.520 0.725 17915 2907 1 13 . 1 1 43 43 LYS N N 43 124.005 124.005 122.443 1.562 17915 2908 1 13 . 1 1 43 43 LYS C C 43 175.482 175.482 175.181 0.301 17915 2909 1 13 . 1 1 43 43 LYS CA C 43 55.379 55.379 54.675 0.704 17915 2910 1 13 . 1 1 43 43 LYS H H 43 8.783 8.783 8.763 0.020 17915 2911 1 13 . 1 1 44 44 VAL N N 44 122.139 122.139 118.210 3.929 17915 2912 1 13 . 1 1 44 44 VAL C C 44 173.472 173.472 174.298 -0.826 17915 2913 1 13 . 1 1 44 44 VAL CA C 44 59.072 59.072 58.841 0.231 17915 2914 1 13 . 1 1 44 44 VAL H H 44 9.287 9.287 8.591 0.696 17915 2915 1 13 . 1 1 45 45 GLU N N 45 118.524 118.524 121.549 -3.025 17915 2916 1 13 . 1 1 45 45 GLU C C 45 174.827 174.827 174.645 0.182 17915 2917 1 13 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.646 -0.472 17915 2918 1 13 . 1 1 45 45 GLU H H 45 8.566 8.566 8.156 0.410 17915 2919 1 13 . 1 1 46 46 VAL N N 46 124.904 124.904 126.201 -1.297 17915 2920 1 13 . 1 1 46 46 VAL C C 46 174.608 174.608 175.501 -0.893 17915 2921 1 13 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.449 -0.798 17915 2922 1 13 . 1 1 46 46 VAL H H 46 8.774 8.774 7.966 0.808 17915 2923 1 13 . 1 1 47 47 ASN N N 47 126.530 126.530 125.618 0.912 17915 2924 1 13 . 1 1 47 47 ASN C C 47 174.259 174.259 174.879 -0.620 17915 2925 1 13 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.754 -0.509 17915 2926 1 13 . 1 1 47 47 ASN H H 47 9.356 9.356 9.031 0.325 17915 2927 1 13 . 1 1 48 48 ASP N N 48 112.420 112.420 119.672 -7.252 17915 2928 1 13 . 1 1 48 48 ASP C C 48 174.521 174.521 174.884 -0.363 17915 2929 1 13 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.381 0.302 17915 2930 1 13 . 1 1 48 48 ASP H H 48 8.628 8.628 8.317 0.311 17915 2931 1 13 . 1 1 49 49 ARG N N 49 120.379 120.379 118.964 1.415 17915 2932 1 13 . 1 1 49 49 ARG C C 49 174.477 174.477 174.302 0.175 17915 2933 1 13 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.751 0.547 17915 2934 1 13 . 1 1 49 49 ARG H H 49 8.069 8.069 7.598 0.471 17915 2935 1 13 . 1 1 50 50 GLN N N 50 118.647 118.647 118.690 -0.043 17915 2936 1 13 . 1 1 50 50 GLN C C 50 175.963 175.963 173.906 2.057 17915 2937 1 13 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.748 -1.323 17915 2938 1 13 . 1 1 50 50 GLN H H 50 8.432 8.432 8.590 -0.158 17915 2939 1 13 . 1 1 51 51 GLY N N 51 107.028 107.028 108.453 -1.425 17915 2940 1 13 . 1 1 51 51 GLY C C 51 170.479 170.479 172.435 -1.956 17915 2941 1 13 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.624 0.014 17915 2942 1 13 . 1 1 51 51 GLY H H 51 8.534 8.534 7.974 0.560 17915 2943 1 13 . 1 1 52 52 PHE N N 52 119.030 119.030 121.399 -2.369 17915 2944 1 13 . 1 1 52 52 PHE C C 52 175.635 175.635 175.140 0.495 17915 2945 1 13 . 1 1 52 52 PHE CA C 52 58.724 58.724 57.687 1.037 17915 2946 1 13 . 1 1 52 52 PHE H H 52 9.098 9.098 7.778 1.320 17915 2947 1 13 . 1 1 53 53 VAL N N 53 110.897 110.897 124.068 -13.171 17915 2948 1 13 . 1 1 53 53 VAL CA C 53 58.108 58.108 58.025 0.083 17915 2949 1 13 . 1 1 53 53 VAL H H 53 8.942 8.942 8.265 0.677 17915 2950 1 13 . 1 1 55 55 ALA N N 55 129.055 129.055 128.613 0.442 17915 2951 1 13 . 1 1 55 55 ALA C C 55 178.565 178.565 178.594 -0.029 17915 2952 1 13 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.860 -0.231 17915 2953 1 13 . 1 1 55 55 ALA H H 55 7.355 7.355 8.495 -1.140 17915 2954 1 13 . 1 1 56 56 ALA N N 56 113.282 113.282 118.262 -4.980 17915 2955 1 13 . 1 1 56 56 ALA C C 56 178.214 178.214 177.426 0.788 17915 2956 1 13 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.636 -0.693 17915 2957 1 13 . 1 1 56 56 ALA H H 56 7.750 7.750 8.213 -0.463 17915 2958 1 13 . 1 1 57 57 TYR N N 57 116.083 116.083 117.036 -0.953 17915 2959 1 13 . 1 1 57 57 TYR C C 57 174.565 174.565 174.100 0.465 17915 2960 1 13 . 1 1 57 57 TYR CA C 57 56.422 56.422 56.190 0.232 17915 2961 1 13 . 1 1 57 57 TYR H H 57 7.611 7.611 7.561 0.050 17915 2962 1 13 . 1 1 58 58 VAL N N 58 110.965 110.965 113.264 -2.299 17915 2963 1 13 . 1 1 58 58 VAL C C 58 173.647 173.647 174.342 -0.695 17915 2964 1 13 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.450 -1.208 17915 2965 1 13 . 1 1 58 58 VAL H H 58 7.301 7.301 7.310 -0.009 17915 2966 1 13 . 1 1 59 59 LYS N N 59 118.586 118.586 122.385 -3.799 17915 2967 1 13 . 1 1 59 59 LYS C C 59 176.160 176.160 174.868 1.292 17915 2968 1 13 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.576 -1.535 17915 2969 1 13 . 1 1 59 59 LYS H H 59 8.515 8.515 8.030 0.485 17915 2970 1 13 . 1 1 60 60 LYS N N 60 125.734 125.734 125.361 0.373 17915 2971 1 13 . 1 1 60 60 LYS C C 60 176.793 176.793 176.824 -0.031 17915 2972 1 13 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.396 3.221 17915 2973 1 13 . 1 1 60 60 LYS H H 60 9.135 9.135 8.468 0.667 17915 2974 1 13 . 1 1 61 61 LEU N N 61 125.061 125.061 124.528 0.533 17915 2975 1 13 . 1 1 61 61 LEU C C 61 174.106 174.106 174.934 -0.828 17915 2976 1 13 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.207 -1.230 17915 2977 1 13 . 1 1 61 61 LEU H H 61 8.384 8.384 8.842 -0.458 17915 2978 1 14 . 1 1 2 2 ASP N N 2 123.220 123.220 120.697 2.523 17915 2979 1 14 . 1 1 2 2 ASP C C 2 175.703 175.703 174.671 1.032 17915 2980 1 14 . 1 1 2 2 ASP CA C 2 54.041 54.041 55.441 -1.400 17915 2981 1 14 . 1 1 2 2 ASP H H 2 8.738 8.738 8.567 0.171 17915 2982 1 14 . 1 1 3 3 GLU N N 3 121.895 121.895 119.966 1.929 17915 2983 1 14 . 1 1 3 3 GLU C C 3 176.480 176.480 174.786 1.694 17915 2984 1 14 . 1 1 3 3 GLU CA C 3 56.128 56.128 55.760 0.368 17915 2985 1 14 . 1 1 3 3 GLU H H 3 8.570 8.570 7.929 0.641 17915 2986 1 14 . 1 1 4 4 THR N N 4 114.607 114.607 118.197 -3.590 17915 2987 1 14 . 1 1 4 4 THR C C 4 175.417 175.417 174.032 1.385 17915 2988 1 14 . 1 1 4 4 THR CA C 4 62.685 62.685 63.337 -0.652 17915 2989 1 14 . 1 1 4 4 THR H H 4 8.176 8.176 8.369 -0.193 17915 2990 1 14 . 1 1 5 5 GLY N N 5 111.430 111.430 111.325 0.105 17915 2991 1 14 . 1 1 5 5 GLY C C 5 173.777 173.777 173.589 0.188 17915 2992 1 14 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.148 0.412 17915 2993 1 14 . 1 1 5 5 GLY H H 5 8.344 8.344 8.197 0.147 17915 2994 1 14 . 1 1 6 6 LYS N N 6 119.850 119.850 122.687 -2.837 17915 2995 1 14 . 1 1 6 6 LYS C C 6 176.049 176.049 176.121 -0.072 17915 2996 1 14 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.226 0.688 17915 2997 1 14 . 1 1 6 6 LYS H H 6 7.903 7.903 8.067 -0.164 17915 2998 1 14 . 1 1 7 7 GLU N N 7 123.025 123.025 127.300 -4.275 17915 2999 1 14 . 1 1 7 7 GLU C C 7 174.172 174.172 175.658 -1.486 17915 3000 1 14 . 1 1 7 7 GLU CA C 7 55.459 55.459 56.467 -1.008 17915 3001 1 14 . 1 1 7 7 GLU H H 7 8.562 8.562 8.824 -0.262 17915 3002 1 14 . 1 1 8 8 LEU N N 8 123.147 123.147 121.742 1.405 17915 3003 1 14 . 1 1 8 8 LEU C C 8 177.495 177.495 174.689 2.806 17915 3004 1 14 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.592 -0.167 17915 3005 1 14 . 1 1 8 8 LEU H H 8 8.292 8.292 8.269 0.023 17915 3006 1 14 . 1 1 9 9 VAL N N 9 111.799 111.799 119.166 -7.367 17915 3007 1 14 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.103 -2.209 17915 3008 1 14 . 1 1 9 9 VAL H H 9 9.051 9.051 8.013 1.038 17915 3009 1 14 . 1 1 10 10 LEU N N 10 123.127 123.127 125.466 -2.339 17915 3010 1 14 . 1 1 10 10 LEU C C 10 176.729 176.729 175.658 1.071 17915 3011 1 14 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.684 -0.195 17915 3012 1 14 . 1 1 10 10 LEU H H 10 8.864 8.864 7.958 0.906 17915 3013 1 14 . 1 1 11 11 ALA N N 11 126.907 126.907 123.247 3.660 17915 3014 1 14 . 1 1 11 11 ALA C C 11 178.406 178.406 177.019 1.387 17915 3015 1 14 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.492 1.023 17915 3016 1 14 . 1 1 11 11 ALA H H 11 8.988 8.988 8.554 0.434 17915 3017 1 14 . 1 1 12 12 LEU N N 12 127.694 127.694 127.195 0.499 17915 3018 1 14 . 1 1 12 12 LEU C C 12 175.046 175.046 175.899 -0.853 17915 3019 1 14 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.151 -0.424 17915 3020 1 14 . 1 1 12 12 LEU H H 12 9.136 9.136 8.763 0.373 17915 3021 1 14 . 1 1 13 13 TYR N N 13 111.415 111.415 117.900 -6.485 17915 3022 1 14 . 1 1 13 13 TYR C C 13 173.844 173.844 173.932 -0.088 17915 3023 1 14 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.507 -1.851 17915 3024 1 14 . 1 1 13 13 TYR H H 13 6.979 6.979 7.761 -0.782 17915 3025 1 14 . 1 1 14 14 ASP N N 14 117.591 117.591 123.796 -6.205 17915 3026 1 14 . 1 1 14 14 ASP C C 14 176.140 176.140 174.261 1.879 17915 3027 1 14 . 1 1 14 14 ASP CA C 14 54.522 54.522 54.864 -0.342 17915 3028 1 14 . 1 1 14 14 ASP H H 14 8.260 8.260 8.154 0.106 17915 3029 1 14 . 1 1 15 15 TYR N N 15 119.917 119.917 117.772 2.145 17915 3030 1 14 . 1 1 15 15 TYR C C 15 172.859 172.859 173.581 -0.722 17915 3031 1 14 . 1 1 15 15 TYR CA C 15 59.661 59.661 57.429 2.232 17915 3032 1 14 . 1 1 15 15 TYR H H 15 8.580 8.580 8.722 -0.142 17915 3033 1 14 . 1 1 16 16 GLN N N 16 127.024 127.024 115.941 11.083 17915 3034 1 14 . 1 1 16 16 GLN C C 16 176.377 176.377 174.652 1.725 17915 3035 1 14 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.136 -0.470 17915 3036 1 14 . 1 1 16 16 GLN H H 16 7.450 7.450 7.873 -0.423 17915 3037 1 14 . 1 1 17 17 GLU N N 17 122.837 122.837 120.511 2.326 17915 3038 1 14 . 1 1 17 17 GLU C C 17 176.140 176.140 176.112 0.028 17915 3039 1 14 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.230 -0.155 17915 3040 1 14 . 1 1 17 17 GLU H H 17 7.899 7.899 8.912 -1.013 17915 3041 1 14 . 1 1 18 18 LYS N N 18 120.622 120.622 121.007 -0.385 17915 3042 1 14 . 1 1 18 18 LYS C C 18 176.267 176.267 176.567 -0.300 17915 3043 1 14 . 1 1 18 18 LYS CA C 18 55.245 55.245 58.064 -2.819 17915 3044 1 14 . 1 1 18 18 LYS H H 18 8.649 8.649 8.079 0.570 17915 3045 1 14 . 1 1 19 19 SER N N 19 115.184 115.184 112.100 3.084 17915 3046 1 14 . 1 1 19 19 SER CA C 19 56.824 56.824 55.018 1.806 17915 3047 1 14 . 1 1 19 19 SER H H 19 7.552 7.552 7.766 -0.214 17915 3048 1 14 . 1 1 21 21 ARG N N 21 113.440 113.440 117.465 -4.025 17915 3049 1 14 . 1 1 21 21 ARG C C 21 176.638 176.638 175.767 0.871 17915 3050 1 14 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.106 0.102 17915 3051 1 14 . 1 1 21 21 ARG H H 21 7.596 7.596 8.035 -0.439 17915 3052 1 14 . 1 1 22 22 GLU N N 22 121.392 121.392 117.117 4.275 17915 3053 1 14 . 1 1 22 22 GLU C C 22 174.500 174.500 176.686 -2.186 17915 3054 1 14 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.237 -0.885 17915 3055 1 14 . 1 1 22 22 GLU H H 22 7.746 7.746 7.633 0.113 17915 3056 1 14 . 1 1 23 23 VAL N N 23 114.115 114.115 113.354 0.761 17915 3057 1 14 . 1 1 23 23 VAL C C 23 172.337 172.337 174.520 -2.183 17915 3058 1 14 . 1 1 23 23 VAL CA C 23 59.875 59.875 59.152 0.723 17915 3059 1 14 . 1 1 23 23 VAL H H 23 7.318 7.318 8.317 -0.999 17915 3060 1 14 . 1 1 24 24 THR N N 24 118.996 118.996 116.462 2.534 17915 3061 1 14 . 1 1 24 24 THR C C 24 174.451 174.451 173.602 0.849 17915 3062 1 14 . 1 1 24 24 THR CA C 24 61.641 61.641 61.493 0.148 17915 3063 1 14 . 1 1 24 24 THR H H 24 7.324 7.324 8.176 -0.852 17915 3064 1 14 . 1 1 25 25 MET N N 25 121.901 121.901 123.964 -2.063 17915 3065 1 14 . 1 1 25 25 MET C C 25 173.931 173.931 174.026 -0.095 17915 3066 1 14 . 1 1 25 25 MET CA C 25 54.389 54.389 54.344 0.045 17915 3067 1 14 . 1 1 25 25 MET H H 25 9.432 9.432 8.361 1.071 17915 3068 1 14 . 1 1 26 26 LYS N N 26 124.169 124.169 120.537 3.632 17915 3069 1 14 . 1 1 26 26 LYS C C 26 175.002 175.002 175.760 -0.758 17915 3070 1 14 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.584 -0.917 17915 3071 1 14 . 1 1 26 26 LYS H H 26 8.634 8.634 8.608 0.026 17915 3072 1 14 . 1 1 27 27 LYS N N 27 122.603 122.603 125.872 -3.269 17915 3073 1 14 . 1 1 27 27 LYS C C 27 177.318 177.318 177.317 0.001 17915 3074 1 14 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.351 0.293 17915 3075 1 14 . 1 1 27 27 LYS H H 27 8.919 8.919 8.894 0.025 17915 3076 1 14 . 1 1 28 28 GLY N N 28 115.585 115.585 115.759 -0.174 17915 3077 1 14 . 1 1 28 28 GLY C C 28 174.193 174.193 174.551 -0.358 17915 3078 1 14 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.755 0.133 17915 3079 1 14 . 1 1 28 28 GLY H H 28 8.732 8.732 8.979 -0.247 17915 3080 1 14 . 1 1 29 29 ASP N N 29 121.770 121.770 122.284 -0.514 17915 3081 1 14 . 1 1 29 29 ASP C C 29 174.281 174.281 175.386 -1.105 17915 3082 1 14 . 1 1 29 29 ASP CA C 29 55.486 55.486 55.024 0.462 17915 3083 1 14 . 1 1 29 29 ASP H H 29 8.388 8.388 8.082 0.306 17915 3084 1 14 . 1 1 30 30 ILE N N 30 120.469 120.469 121.577 -1.108 17915 3085 1 14 . 1 1 30 30 ILE C C 30 176.356 176.356 175.455 0.901 17915 3086 1 14 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.250 -0.001 17915 3087 1 14 . 1 1 30 30 ILE H H 30 8.033 8.033 8.326 -0.293 17915 3088 1 14 . 1 1 31 31 LEU N N 31 127.129 127.129 128.997 -1.868 17915 3089 1 14 . 1 1 31 31 LEU C C 31 175.745 175.745 175.606 0.139 17915 3090 1 14 . 1 1 31 31 LEU CA C 31 53.907 53.907 52.848 1.059 17915 3091 1 14 . 1 1 31 31 LEU H H 31 9.223 9.223 8.963 0.260 17915 3092 1 14 . 1 1 32 32 THR N N 32 117.055 117.055 115.568 1.487 17915 3093 1 14 . 1 1 32 32 THR C C 32 173.844 173.844 173.640 0.204 17915 3094 1 14 . 1 1 32 32 THR CA C 32 63.247 63.247 61.179 2.067 17915 3095 1 14 . 1 1 32 32 THR H H 32 8.360 8.360 8.350 0.010 17915 3096 1 14 . 1 1 33 33 LEU N N 33 128.815 128.815 126.729 2.086 17915 3097 1 14 . 1 1 33 33 LEU C C 33 174.718 174.718 176.883 -2.165 17915 3098 1 14 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.213 0.657 17915 3099 1 14 . 1 1 33 33 LEU H H 33 8.937 8.937 8.819 0.118 17915 3100 1 14 . 1 1 34 34 LEU N N 34 126.230 126.230 127.663 -1.433 17915 3101 1 14 . 1 1 34 34 LEU C C 34 177.689 177.689 176.413 1.276 17915 3102 1 14 . 1 1 34 34 LEU CA C 34 55.218 55.218 56.209 -0.991 17915 3103 1 14 . 1 1 34 34 LEU H H 34 8.929 8.929 8.812 0.117 17915 3104 1 14 . 1 1 35 35 ASN N N 35 113.879 113.879 115.527 -1.648 17915 3105 1 14 . 1 1 35 35 ASN C C 35 174.565 174.565 173.104 1.461 17915 3106 1 14 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.676 0.900 17915 3107 1 14 . 1 1 35 35 ASN H H 35 7.489 7.489 7.642 -0.153 17915 3108 1 14 . 1 1 36 36 SER N N 36 123.684 123.684 118.690 4.994 17915 3109 1 14 . 1 1 36 36 SER C C 36 173.503 173.503 173.475 0.028 17915 3110 1 14 . 1 1 36 36 SER CA C 36 56.904 56.904 58.228 -1.325 17915 3111 1 14 . 1 1 36 36 SER H H 36 9.086 9.086 8.494 0.592 17915 3112 1 14 . 1 1 37 37 THR N N 37 115.012 115.012 114.998 0.014 17915 3113 1 14 . 1 1 37 37 THR C C 37 175.417 175.417 173.785 1.632 17915 3114 1 14 . 1 1 37 37 THR CA C 37 65.521 65.521 62.057 3.463 17915 3115 1 14 . 1 1 37 37 THR H H 37 8.071 8.071 8.381 -0.310 17915 3116 1 14 . 1 1 38 38 ASN N N 38 122.517 122.517 119.344 3.173 17915 3117 1 14 . 1 1 38 38 ASN C C 38 174.696 174.696 173.836 0.860 17915 3118 1 14 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.020 0.459 17915 3119 1 14 . 1 1 38 38 ASN H H 38 8.595 8.595 7.899 0.696 17915 3120 1 14 . 1 1 39 39 LYS N N 39 120.851 120.851 121.387 -0.536 17915 3121 1 14 . 1 1 39 39 LYS C C 39 176.444 176.444 177.025 -0.581 17915 3122 1 14 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.064 0.339 17915 3123 1 14 . 1 1 39 39 LYS H H 39 8.416 8.416 8.581 -0.165 17915 3124 1 14 . 1 1 40 40 ASP N N 40 114.427 114.427 117.612 -3.185 17915 3125 1 14 . 1 1 40 40 ASP C C 40 176.960 176.960 175.093 1.867 17915 3126 1 14 . 1 1 40 40 ASP CA C 40 55.352 55.352 54.626 0.726 17915 3127 1 14 . 1 1 40 40 ASP H H 40 8.085 8.085 8.307 -0.222 17915 3128 1 14 . 1 1 41 41 TRP N N 41 122.708 122.708 121.245 1.463 17915 3129 1 14 . 1 1 41 41 TRP C C 41 174.303 174.303 174.037 0.266 17915 3130 1 14 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.691 -0.483 17915 3131 1 14 . 1 1 41 41 TRP H H 41 8.096 8.096 6.978 1.118 17915 3132 1 14 . 1 1 42 42 TRP N N 42 124.707 124.707 126.632 -1.925 17915 3133 1 14 . 1 1 42 42 TRP C C 42 174.303 174.303 175.237 -0.934 17915 3134 1 14 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.252 -1.265 17915 3135 1 14 . 1 1 42 42 TRP H H 42 9.245 9.245 7.307 1.938 17915 3136 1 14 . 1 1 43 43 LYS N N 43 124.005 124.005 123.683 0.322 17915 3137 1 14 . 1 1 43 43 LYS C C 43 175.482 175.482 174.391 1.091 17915 3138 1 14 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.970 -0.591 17915 3139 1 14 . 1 1 43 43 LYS H H 43 8.783 8.783 8.496 0.287 17915 3140 1 14 . 1 1 44 44 VAL N N 44 122.139 122.139 124.436 -2.297 17915 3141 1 14 . 1 1 44 44 VAL C C 44 173.472 173.472 173.170 0.302 17915 3142 1 14 . 1 1 44 44 VAL CA C 44 59.072 59.072 60.721 -1.649 17915 3143 1 14 . 1 1 44 44 VAL H H 44 9.287 9.287 8.677 0.610 17915 3144 1 14 . 1 1 45 45 GLU N N 45 118.524 118.524 125.981 -7.457 17915 3145 1 14 . 1 1 45 45 GLU C C 45 174.827 174.827 174.001 0.826 17915 3146 1 14 . 1 1 45 45 GLU CA C 45 54.174 54.174 55.297 -1.123 17915 3147 1 14 . 1 1 45 45 GLU H H 45 8.566 8.566 8.167 0.399 17915 3148 1 14 . 1 1 46 46 VAL N N 46 124.904 124.904 122.872 2.032 17915 3149 1 14 . 1 1 46 46 VAL C C 46 174.608 174.608 175.645 -1.037 17915 3150 1 14 . 1 1 46 46 VAL CA C 46 60.651 60.651 59.640 1.011 17915 3151 1 14 . 1 1 46 46 VAL H H 46 8.774 8.774 8.025 0.749 17915 3152 1 14 . 1 1 47 47 ASN N N 47 126.530 126.530 126.213 0.317 17915 3153 1 14 . 1 1 47 47 ASN C C 47 174.259 174.259 175.066 -0.807 17915 3154 1 14 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.706 -0.461 17915 3155 1 14 . 1 1 47 47 ASN H H 47 9.356 9.356 9.155 0.201 17915 3156 1 14 . 1 1 48 48 ASP N N 48 112.420 112.420 119.453 -7.033 17915 3157 1 14 . 1 1 48 48 ASP C C 48 174.521 174.521 175.028 -0.507 17915 3158 1 14 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.352 0.331 17915 3159 1 14 . 1 1 48 48 ASP H H 48 8.628 8.628 8.287 0.341 17915 3160 1 14 . 1 1 49 49 ARG N N 49 120.379 120.379 119.869 0.510 17915 3161 1 14 . 1 1 49 49 ARG C C 49 174.477 174.477 173.996 0.481 17915 3162 1 14 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.428 0.870 17915 3163 1 14 . 1 1 49 49 ARG H H 49 8.069 8.069 7.916 0.153 17915 3164 1 14 . 1 1 50 50 GLN N N 50 118.647 118.647 118.920 -0.273 17915 3165 1 14 . 1 1 50 50 GLN C C 50 175.963 175.963 175.418 0.545 17915 3166 1 14 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.313 -0.888 17915 3167 1 14 . 1 1 50 50 GLN H H 50 8.432 8.432 8.446 -0.014 17915 3168 1 14 . 1 1 51 51 GLY N N 51 107.028 107.028 108.822 -1.794 17915 3169 1 14 . 1 1 51 51 GLY C C 51 170.479 170.479 172.175 -1.696 17915 3170 1 14 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.172 0.466 17915 3171 1 14 . 1 1 51 51 GLY H H 51 8.534 8.534 7.996 0.538 17915 3172 1 14 . 1 1 52 52 PHE N N 52 119.030 119.030 119.873 -0.843 17915 3173 1 14 . 1 1 52 52 PHE C C 52 175.635 175.635 174.146 1.489 17915 3174 1 14 . 1 1 52 52 PHE CA C 52 58.724 58.724 57.406 1.318 17915 3175 1 14 . 1 1 52 52 PHE H H 52 9.098 9.098 8.243 0.855 17915 3176 1 14 . 1 1 53 53 VAL N N 53 110.897 110.897 124.078 -13.181 17915 3177 1 14 . 1 1 53 53 VAL CA C 53 58.108 58.108 57.243 0.865 17915 3178 1 14 . 1 1 53 53 VAL H H 53 8.942 8.942 8.236 0.706 17915 3179 1 14 . 1 1 55 55 ALA N N 55 129.055 129.055 127.825 1.230 17915 3180 1 14 . 1 1 55 55 ALA C C 55 178.565 178.565 178.466 0.099 17915 3181 1 14 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.692 -0.063 17915 3182 1 14 . 1 1 55 55 ALA H H 55 7.355 7.355 6.338 1.017 17915 3183 1 14 . 1 1 56 56 ALA N N 56 113.282 113.282 119.053 -5.771 17915 3184 1 14 . 1 1 56 56 ALA C C 56 178.214 178.214 177.560 0.654 17915 3185 1 14 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.587 -0.644 17915 3186 1 14 . 1 1 56 56 ALA H H 56 7.750 7.750 8.084 -0.334 17915 3187 1 14 . 1 1 57 57 TYR N N 57 116.083 116.083 116.573 -0.490 17915 3188 1 14 . 1 1 57 57 TYR C C 57 174.565 174.565 174.179 0.386 17915 3189 1 14 . 1 1 57 57 TYR CA C 57 56.422 56.422 56.964 -0.541 17915 3190 1 14 . 1 1 57 57 TYR H H 57 7.611 7.611 7.501 0.110 17915 3191 1 14 . 1 1 58 58 VAL N N 58 110.965 110.965 111.576 -0.611 17915 3192 1 14 . 1 1 58 58 VAL C C 58 173.647 173.647 174.524 -0.877 17915 3193 1 14 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.088 -0.846 17915 3194 1 14 . 1 1 58 58 VAL H H 58 7.301 7.301 7.288 0.013 17915 3195 1 14 . 1 1 59 59 LYS N N 59 118.586 118.586 121.969 -3.383 17915 3196 1 14 . 1 1 59 59 LYS C C 59 176.160 176.160 175.564 0.596 17915 3197 1 14 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.476 -1.435 17915 3198 1 14 . 1 1 59 59 LYS H H 59 8.515 8.515 8.085 0.430 17915 3199 1 14 . 1 1 60 60 LYS N N 60 125.734 125.734 123.118 2.616 17915 3200 1 14 . 1 1 60 60 LYS C C 60 176.793 176.793 176.735 0.058 17915 3201 1 14 . 1 1 60 60 LYS CA C 60 58.617 58.617 54.140 4.477 17915 3202 1 14 . 1 1 60 60 LYS H H 60 9.135 9.135 8.476 0.659 17915 3203 1 14 . 1 1 61 61 LEU N N 61 125.061 125.061 118.714 6.347 17915 3204 1 14 . 1 1 61 61 LEU C C 61 174.106 174.106 175.578 -1.472 17915 3205 1 14 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.040 -1.063 17915 3206 1 14 . 1 1 61 61 LEU H H 61 8.384 8.384 8.740 -0.356 17915 3207 1 15 . 1 1 2 2 ASP N N 2 123.220 123.220 121.549 1.671 17915 3208 1 15 . 1 1 2 2 ASP C C 2 175.703 175.703 174.687 1.016 17915 3209 1 15 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.993 -0.952 17915 3210 1 15 . 1 1 2 2 ASP H H 2 8.738 8.738 8.537 0.201 17915 3211 1 15 . 1 1 3 3 GLU N N 3 121.895 121.895 118.929 2.966 17915 3212 1 15 . 1 1 3 3 GLU C C 3 176.480 176.480 174.885 1.595 17915 3213 1 15 . 1 1 3 3 GLU CA C 3 56.128 56.128 55.957 0.171 17915 3214 1 15 . 1 1 3 3 GLU H H 3 8.570 8.570 8.463 0.107 17915 3215 1 15 . 1 1 4 4 THR N N 4 114.607 114.607 115.715 -1.108 17915 3216 1 15 . 1 1 4 4 THR C C 4 175.417 175.417 173.622 1.795 17915 3217 1 15 . 1 1 4 4 THR CA C 4 62.685 62.685 62.245 0.440 17915 3218 1 15 . 1 1 4 4 THR H H 4 8.176 8.176 8.549 -0.373 17915 3219 1 15 . 1 1 5 5 GLY N N 5 111.430 111.430 112.251 -0.821 17915 3220 1 15 . 1 1 5 5 GLY C C 5 173.777 173.777 172.630 1.147 17915 3221 1 15 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.957 -0.397 17915 3222 1 15 . 1 1 5 5 GLY H H 5 8.344 8.344 8.062 0.282 17915 3223 1 15 . 1 1 6 6 LYS N N 6 119.850 119.850 124.764 -4.914 17915 3224 1 15 . 1 1 6 6 LYS C C 6 176.049 176.049 176.637 -0.588 17915 3225 1 15 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.391 -1.477 17915 3226 1 15 . 1 1 6 6 LYS H H 6 7.903 7.903 8.132 -0.229 17915 3227 1 15 . 1 1 7 7 GLU N N 7 123.025 123.025 122.272 0.753 17915 3228 1 15 . 1 1 7 7 GLU C C 7 174.172 174.172 174.902 -0.730 17915 3229 1 15 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.652 -2.193 17915 3230 1 15 . 1 1 7 7 GLU H H 7 8.562 8.562 8.764 -0.202 17915 3231 1 15 . 1 1 8 8 LEU N N 8 123.147 123.147 118.012 5.135 17915 3232 1 15 . 1 1 8 8 LEU C C 8 177.495 177.495 174.954 2.541 17915 3233 1 15 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.961 -0.536 17915 3234 1 15 . 1 1 8 8 LEU H H 8 8.292 8.292 7.336 0.956 17915 3235 1 15 . 1 1 9 9 VAL N N 9 111.799 111.799 118.314 -6.515 17915 3236 1 15 . 1 1 9 9 VAL CA C 9 57.894 57.894 61.357 -3.463 17915 3237 1 15 . 1 1 9 9 VAL H H 9 9.051 9.051 8.266 0.785 17915 3238 1 15 . 1 1 10 10 LEU N N 10 123.127 123.127 126.378 -3.251 17915 3239 1 15 . 1 1 10 10 LEU C C 10 176.729 176.729 174.450 2.279 17915 3240 1 15 . 1 1 10 10 LEU CA C 10 52.489 52.489 53.304 -0.815 17915 3241 1 15 . 1 1 10 10 LEU H H 10 8.864 8.864 7.967 0.897 17915 3242 1 15 . 1 1 11 11 ALA N N 11 126.907 126.907 126.342 0.565 17915 3243 1 15 . 1 1 11 11 ALA C C 11 178.406 178.406 176.423 1.983 17915 3244 1 15 . 1 1 11 11 ALA CA C 11 52.515 52.515 50.963 1.552 17915 3245 1 15 . 1 1 11 11 ALA H H 11 8.988 8.988 8.841 0.147 17915 3246 1 15 . 1 1 12 12 LEU N N 12 127.694 127.694 126.068 1.626 17915 3247 1 15 . 1 1 12 12 LEU C C 12 175.046 175.046 175.757 -0.711 17915 3248 1 15 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.108 -0.381 17915 3249 1 15 . 1 1 12 12 LEU H H 12 9.136 9.136 8.986 0.150 17915 3250 1 15 . 1 1 13 13 TYR N N 13 111.415 111.415 110.155 1.260 17915 3251 1 15 . 1 1 13 13 TYR C C 13 173.844 173.844 174.125 -0.281 17915 3252 1 15 . 1 1 13 13 TYR CA C 13 54.656 54.656 55.209 -0.553 17915 3253 1 15 . 1 1 13 13 TYR H H 13 6.979 6.979 7.609 -0.630 17915 3254 1 15 . 1 1 14 14 ASP N N 14 117.591 117.591 122.819 -5.228 17915 3255 1 15 . 1 1 14 14 ASP C C 14 176.140 176.140 176.246 -0.106 17915 3256 1 15 . 1 1 14 14 ASP CA C 14 54.522 54.522 57.302 -2.780 17915 3257 1 15 . 1 1 14 14 ASP H H 14 8.260 8.260 8.381 -0.121 17915 3258 1 15 . 1 1 15 15 TYR N N 15 119.917 119.917 115.489 4.428 17915 3259 1 15 . 1 1 15 15 TYR C C 15 172.859 172.859 173.380 -0.521 17915 3260 1 15 . 1 1 15 15 TYR CA C 15 59.661 59.661 58.442 1.219 17915 3261 1 15 . 1 1 15 15 TYR H H 15 8.580 8.580 8.006 0.574 17915 3262 1 15 . 1 1 16 16 GLN N N 16 127.024 127.024 118.613 8.411 17915 3263 1 15 . 1 1 16 16 GLN C C 16 176.377 176.377 174.339 2.038 17915 3264 1 15 . 1 1 16 16 GLN CA C 16 53.666 53.666 53.512 0.154 17915 3265 1 15 . 1 1 16 16 GLN H H 16 7.450 7.450 8.152 -0.702 17915 3266 1 15 . 1 1 17 17 GLU N N 17 122.837 122.837 121.169 1.668 17915 3267 1 15 . 1 1 17 17 GLU C C 17 176.140 176.140 176.487 -0.347 17915 3268 1 15 . 1 1 17 17 GLU CA C 17 56.075 56.075 57.398 -1.323 17915 3269 1 15 . 1 1 17 17 GLU H H 17 7.899 7.899 8.709 -0.810 17915 3270 1 15 . 1 1 18 18 LYS N N 18 120.622 120.622 125.166 -4.544 17915 3271 1 15 . 1 1 18 18 LYS C C 18 176.267 176.267 176.057 0.210 17915 3272 1 15 . 1 1 18 18 LYS CA C 18 55.245 55.245 57.084 -1.839 17915 3273 1 15 . 1 1 18 18 LYS H H 18 8.649 8.649 8.613 0.036 17915 3274 1 15 . 1 1 19 19 SER N N 19 115.184 115.184 110.945 4.239 17915 3275 1 15 . 1 1 19 19 SER CA C 19 56.824 56.824 56.922 -0.098 17915 3276 1 15 . 1 1 19 19 SER H H 19 7.552 7.552 7.588 -0.036 17915 3277 1 15 . 1 1 21 21 ARG N N 21 113.440 113.440 117.869 -4.429 17915 3278 1 15 . 1 1 21 21 ARG C C 21 176.638 176.638 176.279 0.359 17915 3279 1 15 . 1 1 21 21 ARG CA C 21 56.208 56.208 57.350 -1.142 17915 3280 1 15 . 1 1 21 21 ARG H H 21 7.596 7.596 8.488 -0.892 17915 3281 1 15 . 1 1 22 22 GLU N N 22 121.392 121.392 115.842 5.550 17915 3282 1 15 . 1 1 22 22 GLU C C 22 174.500 174.500 174.511 -0.011 17915 3283 1 15 . 1 1 22 22 GLU CA C 22 55.352 55.352 55.035 0.317 17915 3284 1 15 . 1 1 22 22 GLU H H 22 7.746 7.746 7.574 0.172 17915 3285 1 15 . 1 1 23 23 VAL N N 23 114.115 114.115 119.080 -4.965 17915 3286 1 15 . 1 1 23 23 VAL C C 23 172.337 172.337 173.887 -1.550 17915 3287 1 15 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.376 -0.501 17915 3288 1 15 . 1 1 23 23 VAL H H 23 7.318 7.318 8.223 -0.905 17915 3289 1 15 . 1 1 24 24 THR N N 24 118.996 118.996 119.843 -0.847 17915 3290 1 15 . 1 1 24 24 THR C C 24 174.451 174.451 172.852 1.599 17915 3291 1 15 . 1 1 24 24 THR CA C 24 61.641 61.641 59.831 1.810 17915 3292 1 15 . 1 1 24 24 THR H H 24 7.324 7.324 8.006 -0.682 17915 3293 1 15 . 1 1 25 25 MET N N 25 121.901 121.901 121.957 -0.056 17915 3294 1 15 . 1 1 25 25 MET C C 25 173.931 173.931 175.341 -1.410 17915 3295 1 15 . 1 1 25 25 MET CA C 25 54.389 54.389 53.632 0.757 17915 3296 1 15 . 1 1 25 25 MET H H 25 9.432 9.432 8.542 0.890 17915 3297 1 15 . 1 1 26 26 LYS N N 26 124.169 124.169 124.208 -0.039 17915 3298 1 15 . 1 1 26 26 LYS C C 26 175.002 175.002 176.271 -1.269 17915 3299 1 15 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.211 -1.545 17915 3300 1 15 . 1 1 26 26 LYS H H 26 8.634 8.634 8.646 -0.012 17915 3301 1 15 . 1 1 27 27 LYS N N 27 122.603 122.603 120.519 2.084 17915 3302 1 15 . 1 1 27 27 LYS C C 27 177.318 177.318 177.449 -0.131 17915 3303 1 15 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.730 0.914 17915 3304 1 15 . 1 1 27 27 LYS H H 27 8.919 8.919 8.565 0.354 17915 3305 1 15 . 1 1 28 28 GLY N N 28 115.585 115.585 114.601 0.984 17915 3306 1 15 . 1 1 28 28 GLY C C 28 174.193 174.193 174.347 -0.154 17915 3307 1 15 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.843 0.045 17915 3308 1 15 . 1 1 28 28 GLY H H 28 8.732 8.732 9.309 -0.577 17915 3309 1 15 . 1 1 29 29 ASP N N 29 121.770 121.770 122.150 -0.380 17915 3310 1 15 . 1 1 29 29 ASP C C 29 174.281 174.281 175.906 -1.625 17915 3311 1 15 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.733 0.753 17915 3312 1 15 . 1 1 29 29 ASP H H 29 8.388 8.388 8.157 0.231 17915 3313 1 15 . 1 1 30 30 ILE N N 30 120.469 120.469 114.611 5.858 17915 3314 1 15 . 1 1 30 30 ILE C C 30 176.356 176.356 175.052 1.304 17915 3315 1 15 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.937 0.312 17915 3316 1 15 . 1 1 30 30 ILE H H 30 8.033 8.033 8.057 -0.024 17915 3317 1 15 . 1 1 31 31 LEU N N 31 127.129 127.129 126.847 0.282 17915 3318 1 15 . 1 1 31 31 LEU C C 31 175.745 175.745 176.209 -0.464 17915 3319 1 15 . 1 1 31 31 LEU CA C 31 53.907 53.907 54.242 -0.335 17915 3320 1 15 . 1 1 31 31 LEU H H 31 9.223 9.223 8.826 0.397 17915 3321 1 15 . 1 1 32 32 THR N N 32 117.055 117.055 120.052 -2.997 17915 3322 1 15 . 1 1 32 32 THR C C 32 173.844 173.844 174.166 -0.322 17915 3323 1 15 . 1 1 32 32 THR CA C 32 63.247 63.247 60.737 2.510 17915 3324 1 15 . 1 1 32 32 THR H H 32 8.360 8.360 8.578 -0.218 17915 3325 1 15 . 1 1 33 33 LEU N N 33 128.815 128.815 125.397 3.418 17915 3326 1 15 . 1 1 33 33 LEU C C 33 174.718 174.718 175.904 -1.186 17915 3327 1 15 . 1 1 33 33 LEU CA C 33 54.870 54.870 55.092 -0.222 17915 3328 1 15 . 1 1 33 33 LEU H H 33 8.937 8.937 8.617 0.320 17915 3329 1 15 . 1 1 34 34 LEU N N 34 126.230 126.230 126.369 -0.139 17915 3330 1 15 . 1 1 34 34 LEU C C 34 177.689 177.689 176.326 1.363 17915 3331 1 15 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.069 0.149 17915 3332 1 15 . 1 1 34 34 LEU H H 34 8.929 8.929 8.504 0.425 17915 3333 1 15 . 1 1 35 35 ASN N N 35 113.879 113.879 115.602 -1.723 17915 3334 1 15 . 1 1 35 35 ASN C C 35 174.565 174.565 172.606 1.959 17915 3335 1 15 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.335 1.241 17915 3336 1 15 . 1 1 35 35 ASN H H 35 7.489 7.489 7.491 -0.002 17915 3337 1 15 . 1 1 36 36 SER N N 36 123.684 123.684 117.764 5.920 17915 3338 1 15 . 1 1 36 36 SER C C 36 173.503 173.503 174.050 -0.547 17915 3339 1 15 . 1 1 36 36 SER CA C 36 56.904 56.904 57.315 -0.410 17915 3340 1 15 . 1 1 36 36 SER H H 36 9.086 9.086 8.457 0.629 17915 3341 1 15 . 1 1 37 37 THR N N 37 115.012 115.012 120.812 -5.800 17915 3342 1 15 . 1 1 37 37 THR C C 37 175.417 175.417 174.403 1.014 17915 3343 1 15 . 1 1 37 37 THR CA C 37 65.521 65.521 62.338 3.183 17915 3344 1 15 . 1 1 37 37 THR H H 37 8.071 8.071 8.697 -0.626 17915 3345 1 15 . 1 1 38 38 ASN N N 38 122.517 122.517 119.234 3.283 17915 3346 1 15 . 1 1 38 38 ASN C C 38 174.696 174.696 174.851 -0.155 17915 3347 1 15 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.310 1.169 17915 3348 1 15 . 1 1 38 38 ASN H H 38 8.595 8.595 7.948 0.647 17915 3349 1 15 . 1 1 39 39 LYS N N 39 120.851 120.851 121.604 -0.753 17915 3350 1 15 . 1 1 39 39 LYS C C 39 176.444 176.444 176.823 -0.379 17915 3351 1 15 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.493 -0.090 17915 3352 1 15 . 1 1 39 39 LYS H H 39 8.416 8.416 8.545 -0.129 17915 3353 1 15 . 1 1 40 40 ASP N N 40 114.427 114.427 117.869 -3.442 17915 3354 1 15 . 1 1 40 40 ASP C C 40 176.960 176.960 175.818 1.142 17915 3355 1 15 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.013 0.339 17915 3356 1 15 . 1 1 40 40 ASP H H 40 8.085 8.085 8.104 -0.019 17915 3357 1 15 . 1 1 41 41 TRP N N 41 122.708 122.708 119.220 3.488 17915 3358 1 15 . 1 1 41 41 TRP C C 41 174.303 174.303 175.254 -0.951 17915 3359 1 15 . 1 1 41 41 TRP CA C 41 56.208 56.208 55.282 0.926 17915 3360 1 15 . 1 1 41 41 TRP H H 41 8.096 8.096 7.523 0.573 17915 3361 1 15 . 1 1 42 42 TRP N N 42 124.707 124.707 123.721 0.986 17915 3362 1 15 . 1 1 42 42 TRP C C 42 174.303 174.303 175.636 -1.333 17915 3363 1 15 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.018 -2.031 17915 3364 1 15 . 1 1 42 42 TRP H H 42 9.245 9.245 8.501 0.744 17915 3365 1 15 . 1 1 43 43 LYS N N 43 124.005 124.005 121.468 2.537 17915 3366 1 15 . 1 1 43 43 LYS C C 43 175.482 175.482 174.890 0.592 17915 3367 1 15 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.447 -0.068 17915 3368 1 15 . 1 1 43 43 LYS H H 43 8.783 8.783 8.430 0.353 17915 3369 1 15 . 1 1 44 44 VAL N N 44 122.139 122.139 120.867 1.272 17915 3370 1 15 . 1 1 44 44 VAL C C 44 173.472 173.472 173.724 -0.252 17915 3371 1 15 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.423 -0.352 17915 3372 1 15 . 1 1 44 44 VAL H H 44 9.287 9.287 8.447 0.840 17915 3373 1 15 . 1 1 45 45 GLU N N 45 118.524 118.524 120.092 -1.568 17915 3374 1 15 . 1 1 45 45 GLU C C 45 174.827 174.827 174.671 0.156 17915 3375 1 15 . 1 1 45 45 GLU CA C 45 54.174 54.174 55.067 -0.893 17915 3376 1 15 . 1 1 45 45 GLU H H 45 8.566 8.566 7.991 0.575 17915 3377 1 15 . 1 1 46 46 VAL N N 46 124.904 124.904 124.287 0.617 17915 3378 1 15 . 1 1 46 46 VAL C C 46 174.608 174.608 175.232 -0.624 17915 3379 1 15 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.215 -0.563 17915 3380 1 15 . 1 1 46 46 VAL H H 46 8.774 8.774 8.260 0.514 17915 3381 1 15 . 1 1 47 47 ASN N N 47 126.530 126.530 126.762 -0.232 17915 3382 1 15 . 1 1 47 47 ASN C C 47 174.259 174.259 174.615 -0.356 17915 3383 1 15 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.703 -0.458 17915 3384 1 15 . 1 1 47 47 ASN H H 47 9.356 9.356 9.149 0.207 17915 3385 1 15 . 1 1 48 48 ASP N N 48 112.420 112.420 118.944 -6.524 17915 3386 1 15 . 1 1 48 48 ASP C C 48 174.521 174.521 175.038 -0.517 17915 3387 1 15 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.456 0.227 17915 3388 1 15 . 1 1 48 48 ASP H H 48 8.628 8.628 8.357 0.271 17915 3389 1 15 . 1 1 49 49 ARG N N 49 120.379 120.379 120.591 -0.212 17915 3390 1 15 . 1 1 49 49 ARG C C 49 174.477 174.477 174.222 0.255 17915 3391 1 15 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.809 0.490 17915 3392 1 15 . 1 1 49 49 ARG H H 49 8.069 8.069 7.802 0.267 17915 3393 1 15 . 1 1 50 50 GLN N N 50 118.647 118.647 118.379 0.268 17915 3394 1 15 . 1 1 50 50 GLN C C 50 175.963 175.963 174.835 1.128 17915 3395 1 15 . 1 1 50 50 GLN CA C 50 53.425 53.425 55.037 -1.612 17915 3396 1 15 . 1 1 50 50 GLN H H 50 8.432 8.432 8.669 -0.237 17915 3397 1 15 . 1 1 51 51 GLY N N 51 107.028 107.028 109.291 -2.263 17915 3398 1 15 . 1 1 51 51 GLY C C 51 170.479 170.479 171.696 -1.217 17915 3399 1 15 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.517 0.121 17915 3400 1 15 . 1 1 51 51 GLY H H 51 8.534 8.534 8.138 0.396 17915 3401 1 15 . 1 1 52 52 PHE N N 52 119.030 119.030 117.706 1.324 17915 3402 1 15 . 1 1 52 52 PHE C C 52 175.635 175.635 174.072 1.563 17915 3403 1 15 . 1 1 52 52 PHE CA C 52 58.724 58.724 56.054 2.670 17915 3404 1 15 . 1 1 52 52 PHE H H 52 9.098 9.098 7.906 1.192 17915 3405 1 15 . 1 1 53 53 VAL N N 53 110.897 110.897 117.195 -6.298 17915 3406 1 15 . 1 1 53 53 VAL CA C 53 58.108 58.108 58.305 -0.197 17915 3407 1 15 . 1 1 53 53 VAL H H 53 8.942 8.942 8.354 0.588 17915 3408 1 15 . 1 1 55 55 ALA N N 55 129.055 129.055 129.775 -0.720 17915 3409 1 15 . 1 1 55 55 ALA C C 55 178.565 178.565 178.565 0.000 17915 3410 1 15 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.554 0.075 17915 3411 1 15 . 1 1 55 55 ALA H H 55 7.355 7.355 8.608 -1.253 17915 3412 1 15 . 1 1 56 56 ALA N N 56 113.282 113.282 119.169 -5.887 17915 3413 1 15 . 1 1 56 56 ALA C C 56 178.214 178.214 178.295 -0.081 17915 3414 1 15 . 1 1 56 56 ALA CA C 56 52.943 52.943 54.081 -1.138 17915 3415 1 15 . 1 1 56 56 ALA H H 56 7.750 7.750 8.079 -0.329 17915 3416 1 15 . 1 1 57 57 TYR N N 57 116.083 116.083 116.925 -0.842 17915 3417 1 15 . 1 1 57 57 TYR C C 57 174.565 174.565 175.121 -0.556 17915 3418 1 15 . 1 1 57 57 TYR CA C 57 56.422 56.422 60.073 -3.651 17915 3419 1 15 . 1 1 57 57 TYR H H 57 7.611 7.611 7.601 0.010 17915 3420 1 15 . 1 1 58 58 VAL N N 58 110.965 110.965 110.887 0.078 17915 3421 1 15 . 1 1 58 58 VAL C C 58 173.647 173.647 174.151 -0.504 17915 3422 1 15 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.933 -1.691 17915 3423 1 15 . 1 1 58 58 VAL H H 58 7.301 7.301 7.408 -0.107 17915 3424 1 15 . 1 1 59 59 LYS N N 59 118.586 118.586 120.758 -2.172 17915 3425 1 15 . 1 1 59 59 LYS C C 59 176.160 176.160 175.738 0.422 17915 3426 1 15 . 1 1 59 59 LYS CA C 59 54.041 54.041 55.082 -1.041 17915 3427 1 15 . 1 1 59 59 LYS H H 59 8.515 8.515 7.914 0.601 17915 3428 1 15 . 1 1 60 60 LYS N N 60 125.734 125.734 123.146 2.588 17915 3429 1 15 . 1 1 60 60 LYS C C 60 176.793 176.793 177.192 -0.399 17915 3430 1 15 . 1 1 60 60 LYS CA C 60 58.617 58.617 56.605 2.012 17915 3431 1 15 . 1 1 60 60 LYS H H 60 9.135 9.135 8.646 0.489 17915 3432 1 15 . 1 1 61 61 LEU N N 61 125.061 125.061 119.726 5.335 17915 3433 1 15 . 1 1 61 61 LEU C C 61 174.106 174.106 175.524 -1.418 17915 3434 1 15 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.272 -1.295 17915 3435 1 15 . 1 1 61 61 LEU H H 61 8.384 8.384 8.907 -0.523 17915 3436 1 16 . 1 1 2 2 ASP N N 2 123.220 123.220 121.724 1.496 17915 3437 1 16 . 1 1 2 2 ASP C C 2 175.703 175.703 175.541 0.162 17915 3438 1 16 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.485 -0.444 17915 3439 1 16 . 1 1 2 2 ASP H H 2 8.738 8.738 8.108 0.630 17915 3440 1 16 . 1 1 3 3 GLU N N 3 121.895 121.895 121.822 0.073 17915 3441 1 16 . 1 1 3 3 GLU C C 3 176.480 176.480 174.893 1.587 17915 3442 1 16 . 1 1 3 3 GLU CA C 3 56.128 56.128 57.350 -1.222 17915 3443 1 16 . 1 1 3 3 GLU H H 3 8.570 8.570 8.877 -0.307 17915 3444 1 16 . 1 1 4 4 THR N N 4 114.607 114.607 111.777 2.830 17915 3445 1 16 . 1 1 4 4 THR C C 4 175.417 175.417 173.127 2.290 17915 3446 1 16 . 1 1 4 4 THR CA C 4 62.685 62.685 62.267 0.418 17915 3447 1 16 . 1 1 4 4 THR H H 4 8.176 8.176 7.755 0.421 17915 3448 1 16 . 1 1 5 5 GLY N N 5 111.430 111.430 111.129 0.301 17915 3449 1 16 . 1 1 5 5 GLY C C 5 173.777 173.777 172.628 1.149 17915 3450 1 16 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.834 -0.274 17915 3451 1 16 . 1 1 5 5 GLY H H 5 8.344 8.344 7.997 0.346 17915 3452 1 16 . 1 1 6 6 LYS N N 6 119.850 119.850 124.641 -4.791 17915 3453 1 16 . 1 1 6 6 LYS C C 6 176.049 176.049 176.811 -0.762 17915 3454 1 16 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.839 -1.925 17915 3455 1 16 . 1 1 6 6 LYS H H 6 7.903 7.903 8.243 -0.340 17915 3456 1 16 . 1 1 7 7 GLU N N 7 123.025 123.025 120.899 2.126 17915 3457 1 16 . 1 1 7 7 GLU C C 7 174.172 174.172 174.221 -0.049 17915 3458 1 16 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.659 -2.200 17915 3459 1 16 . 1 1 7 7 GLU H H 7 8.562 8.562 8.716 -0.154 17915 3460 1 16 . 1 1 8 8 LEU N N 8 123.147 123.147 116.953 6.194 17915 3461 1 16 . 1 1 8 8 LEU C C 8 177.495 177.495 174.503 2.992 17915 3462 1 16 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.978 -0.553 17915 3463 1 16 . 1 1 8 8 LEU H H 8 8.292 8.292 7.355 0.937 17915 3464 1 16 . 1 1 9 9 VAL N N 9 111.799 111.799 116.299 -4.500 17915 3465 1 16 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.636 -1.742 17915 3466 1 16 . 1 1 9 9 VAL H H 9 9.051 9.051 8.634 0.417 17915 3467 1 16 . 1 1 10 10 LEU N N 10 123.127 123.127 126.227 -3.100 17915 3468 1 16 . 1 1 10 10 LEU C C 10 176.729 176.729 174.923 1.806 17915 3469 1 16 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.507 -0.018 17915 3470 1 16 . 1 1 10 10 LEU H H 10 8.864 8.864 8.598 0.266 17915 3471 1 16 . 1 1 11 11 ALA N N 11 126.907 126.907 126.723 0.184 17915 3472 1 16 . 1 1 11 11 ALA C C 11 178.406 178.406 176.379 2.027 17915 3473 1 16 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.875 0.640 17915 3474 1 16 . 1 1 11 11 ALA H H 11 8.988 8.988 8.645 0.343 17915 3475 1 16 . 1 1 12 12 LEU N N 12 127.694 127.694 125.110 2.584 17915 3476 1 16 . 1 1 12 12 LEU C C 12 175.046 175.046 175.780 -0.734 17915 3477 1 16 . 1 1 12 12 LEU CA C 12 55.727 55.727 55.490 0.237 17915 3478 1 16 . 1 1 12 12 LEU H H 12 9.136 9.136 8.892 0.244 17915 3479 1 16 . 1 1 13 13 TYR N N 13 111.415 111.415 109.918 1.497 17915 3480 1 16 . 1 1 13 13 TYR C C 13 173.844 173.844 174.559 -0.715 17915 3481 1 16 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.137 -1.481 17915 3482 1 16 . 1 1 13 13 TYR H H 13 6.979 6.979 7.699 -0.720 17915 3483 1 16 . 1 1 14 14 ASP N N 14 117.591 117.591 122.553 -4.962 17915 3484 1 16 . 1 1 14 14 ASP C C 14 176.140 176.140 177.173 -1.033 17915 3485 1 16 . 1 1 14 14 ASP CA C 14 54.522 54.522 56.637 -2.115 17915 3486 1 16 . 1 1 14 14 ASP H H 14 8.260 8.260 8.084 0.176 17915 3487 1 16 . 1 1 15 15 TYR N N 15 119.917 119.917 117.997 1.920 17915 3488 1 16 . 1 1 15 15 TYR C C 15 172.859 172.859 173.554 -0.695 17915 3489 1 16 . 1 1 15 15 TYR CA C 15 59.661 59.661 59.086 0.575 17915 3490 1 16 . 1 1 15 15 TYR H H 15 8.580 8.580 8.091 0.489 17915 3491 1 16 . 1 1 16 16 GLN N N 16 127.024 127.024 121.004 6.020 17915 3492 1 16 . 1 1 16 16 GLN C C 16 176.377 176.377 173.568 2.809 17915 3493 1 16 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.285 -1.619 17915 3494 1 16 . 1 1 16 16 GLN H H 16 7.450 7.450 7.895 -0.445 17915 3495 1 16 . 1 1 17 17 GLU N N 17 122.837 122.837 125.073 -2.236 17915 3496 1 16 . 1 1 17 17 GLU C C 17 176.140 176.140 175.480 0.660 17915 3497 1 16 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.547 -0.472 17915 3498 1 16 . 1 1 17 17 GLU H H 17 7.899 7.899 8.583 -0.684 17915 3499 1 16 . 1 1 18 18 LYS N N 18 120.622 120.622 124.113 -3.491 17915 3500 1 16 . 1 1 18 18 LYS C C 18 176.267 176.267 175.374 0.893 17915 3501 1 16 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.357 -1.112 17915 3502 1 16 . 1 1 18 18 LYS H H 18 8.649 8.649 8.544 0.105 17915 3503 1 16 . 1 1 19 19 SER N N 19 115.184 115.184 114.891 0.293 17915 3504 1 16 . 1 1 19 19 SER CA C 19 56.824 56.824 55.036 1.788 17915 3505 1 16 . 1 1 19 19 SER H H 19 7.552 7.552 7.701 -0.149 17915 3506 1 16 . 1 1 21 21 ARG N N 21 113.440 113.440 117.150 -3.710 17915 3507 1 16 . 1 1 21 21 ARG C C 21 176.638 176.638 176.978 -0.340 17915 3508 1 16 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.559 -0.351 17915 3509 1 16 . 1 1 21 21 ARG H H 21 7.596 7.596 8.221 -0.625 17915 3510 1 16 . 1 1 22 22 GLU N N 22 121.392 121.392 119.035 2.357 17915 3511 1 16 . 1 1 22 22 GLU C C 22 174.500 174.500 175.808 -1.308 17915 3512 1 16 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.335 -0.983 17915 3513 1 16 . 1 1 22 22 GLU H H 22 7.746 7.746 7.756 -0.010 17915 3514 1 16 . 1 1 23 23 VAL N N 23 114.115 114.115 114.675 -0.560 17915 3515 1 16 . 1 1 23 23 VAL C C 23 172.337 172.337 174.672 -2.335 17915 3516 1 16 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.040 -0.165 17915 3517 1 16 . 1 1 23 23 VAL H H 23 7.318 7.318 8.210 -0.892 17915 3518 1 16 . 1 1 24 24 THR N N 24 118.996 118.996 115.008 3.988 17915 3519 1 16 . 1 1 24 24 THR C C 24 174.451 174.451 173.931 0.520 17915 3520 1 16 . 1 1 24 24 THR CA C 24 61.641 61.641 61.996 -0.355 17915 3521 1 16 . 1 1 24 24 THR H H 24 7.324 7.324 8.134 -0.810 17915 3522 1 16 . 1 1 25 25 MET N N 25 121.901 121.901 123.972 -2.071 17915 3523 1 16 . 1 1 25 25 MET C C 25 173.931 173.931 174.179 -0.248 17915 3524 1 16 . 1 1 25 25 MET CA C 25 54.389 54.389 54.379 0.010 17915 3525 1 16 . 1 1 25 25 MET H H 25 9.432 9.432 8.340 1.092 17915 3526 1 16 . 1 1 26 26 LYS N N 26 124.169 124.169 124.063 0.106 17915 3527 1 16 . 1 1 26 26 LYS C C 26 175.002 175.002 176.354 -1.352 17915 3528 1 16 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.746 -2.080 17915 3529 1 16 . 1 1 26 26 LYS H H 26 8.634 8.634 8.706 -0.072 17915 3530 1 16 . 1 1 27 27 LYS N N 27 122.603 122.603 123.745 -1.142 17915 3531 1 16 . 1 1 27 27 LYS C C 27 177.318 177.318 177.352 -0.034 17915 3532 1 16 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.830 0.814 17915 3533 1 16 . 1 1 27 27 LYS H H 27 8.919 8.919 8.764 0.155 17915 3534 1 16 . 1 1 28 28 GLY N N 28 115.585 115.585 113.780 1.805 17915 3535 1 16 . 1 1 28 28 GLY C C 28 174.193 174.193 174.801 -0.608 17915 3536 1 16 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.696 0.192 17915 3537 1 16 . 1 1 28 28 GLY H H 28 8.732 8.732 9.127 -0.395 17915 3538 1 16 . 1 1 29 29 ASP N N 29 121.770 121.770 122.730 -0.960 17915 3539 1 16 . 1 1 29 29 ASP C C 29 174.281 174.281 175.670 -1.389 17915 3540 1 16 . 1 1 29 29 ASP CA C 29 55.486 55.486 55.833 -0.347 17915 3541 1 16 . 1 1 29 29 ASP H H 29 8.388 8.388 7.838 0.550 17915 3542 1 16 . 1 1 30 30 ILE N N 30 120.469 120.469 116.869 3.600 17915 3543 1 16 . 1 1 30 30 ILE C C 30 176.356 176.356 174.714 1.642 17915 3544 1 16 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.537 -0.288 17915 3545 1 16 . 1 1 30 30 ILE H H 30 8.033 8.033 8.065 -0.032 17915 3546 1 16 . 1 1 31 31 LEU N N 31 127.129 127.129 128.416 -1.287 17915 3547 1 16 . 1 1 31 31 LEU C C 31 175.745 175.745 175.724 0.021 17915 3548 1 16 . 1 1 31 31 LEU CA C 31 53.907 53.907 54.143 -0.236 17915 3549 1 16 . 1 1 31 31 LEU H H 31 9.223 9.223 8.970 0.253 17915 3550 1 16 . 1 1 32 32 THR N N 32 117.055 117.055 117.838 -0.783 17915 3551 1 16 . 1 1 32 32 THR C C 32 173.844 173.844 173.358 0.486 17915 3552 1 16 . 1 1 32 32 THR CA C 32 63.247 63.247 61.803 1.444 17915 3553 1 16 . 1 1 32 32 THR H H 32 8.360 8.360 8.412 -0.052 17915 3554 1 16 . 1 1 33 33 LEU N N 33 128.815 128.815 124.033 4.782 17915 3555 1 16 . 1 1 33 33 LEU C C 33 174.718 174.718 175.865 -1.147 17915 3556 1 16 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.057 0.813 17915 3557 1 16 . 1 1 33 33 LEU H H 33 8.937 8.937 8.812 0.125 17915 3558 1 16 . 1 1 34 34 LEU N N 34 126.230 126.230 125.824 0.406 17915 3559 1 16 . 1 1 34 34 LEU C C 34 177.689 177.689 176.275 1.414 17915 3560 1 16 . 1 1 34 34 LEU CA C 34 55.218 55.218 56.127 -0.909 17915 3561 1 16 . 1 1 34 34 LEU H H 34 8.929 8.929 8.789 0.140 17915 3562 1 16 . 1 1 35 35 ASN N N 35 113.879 113.879 115.766 -1.887 17915 3563 1 16 . 1 1 35 35 ASN C C 35 174.565 174.565 172.797 1.768 17915 3564 1 16 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.849 0.727 17915 3565 1 16 . 1 1 35 35 ASN H H 35 7.489 7.489 7.536 -0.047 17915 3566 1 16 . 1 1 36 36 SER N N 36 123.684 123.684 119.768 3.916 17915 3567 1 16 . 1 1 36 36 SER C C 36 173.503 173.503 175.350 -1.847 17915 3568 1 16 . 1 1 36 36 SER CA C 36 56.904 56.904 57.577 -0.673 17915 3569 1 16 . 1 1 36 36 SER H H 36 9.086 9.086 8.554 0.532 17915 3570 1 16 . 1 1 37 37 THR N N 37 115.012 115.012 119.423 -4.411 17915 3571 1 16 . 1 1 37 37 THR C C 37 175.417 175.417 175.154 0.263 17915 3572 1 16 . 1 1 37 37 THR CA C 37 65.521 65.521 63.257 2.264 17915 3573 1 16 . 1 1 37 37 THR H H 37 8.071 8.071 8.844 -0.773 17915 3574 1 16 . 1 1 38 38 ASN N N 38 122.517 122.517 117.033 5.484 17915 3575 1 16 . 1 1 38 38 ASN C C 38 174.696 174.696 173.699 0.997 17915 3576 1 16 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.921 0.558 17915 3577 1 16 . 1 1 38 38 ASN H H 38 8.595 8.595 7.561 1.034 17915 3578 1 16 . 1 1 39 39 LYS N N 39 120.851 120.851 118.824 2.027 17915 3579 1 16 . 1 1 39 39 LYS C C 39 176.444 176.444 177.431 -0.987 17915 3580 1 16 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.714 -0.311 17915 3581 1 16 . 1 1 39 39 LYS H H 39 8.416 8.416 8.531 -0.115 17915 3582 1 16 . 1 1 40 40 ASP N N 40 114.427 114.427 117.401 -2.974 17915 3583 1 16 . 1 1 40 40 ASP C C 40 176.960 176.960 176.138 0.822 17915 3584 1 16 . 1 1 40 40 ASP CA C 40 55.352 55.352 56.390 -1.038 17915 3585 1 16 . 1 1 40 40 ASP H H 40 8.085 8.085 8.224 -0.139 17915 3586 1 16 . 1 1 41 41 TRP N N 41 122.708 122.708 120.450 2.258 17915 3587 1 16 . 1 1 41 41 TRP C C 41 174.303 174.303 175.122 -0.819 17915 3588 1 16 . 1 1 41 41 TRP CA C 41 56.208 56.208 55.788 0.420 17915 3589 1 16 . 1 1 41 41 TRP H H 41 8.096 8.096 7.677 0.419 17915 3590 1 16 . 1 1 42 42 TRP N N 42 124.707 124.707 124.200 0.507 17915 3591 1 16 . 1 1 42 42 TRP C C 42 174.303 174.303 174.888 -0.585 17915 3592 1 16 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.621 -1.634 17915 3593 1 16 . 1 1 42 42 TRP H H 42 9.245 9.245 7.723 1.522 17915 3594 1 16 . 1 1 43 43 LYS N N 43 124.005 124.005 125.404 -1.399 17915 3595 1 16 . 1 1 43 43 LYS C C 43 175.482 175.482 174.385 1.097 17915 3596 1 16 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.365 0.014 17915 3597 1 16 . 1 1 43 43 LYS H H 43 8.783 8.783 8.595 0.188 17915 3598 1 16 . 1 1 44 44 VAL N N 44 122.139 122.139 123.028 -0.889 17915 3599 1 16 . 1 1 44 44 VAL C C 44 173.472 173.472 173.542 -0.070 17915 3600 1 16 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.858 -0.786 17915 3601 1 16 . 1 1 44 44 VAL H H 44 9.287 9.287 8.112 1.175 17915 3602 1 16 . 1 1 45 45 GLU N N 45 118.524 118.524 126.725 -8.201 17915 3603 1 16 . 1 1 45 45 GLU C C 45 174.827 174.827 174.922 -0.095 17915 3604 1 16 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.413 -0.239 17915 3605 1 16 . 1 1 45 45 GLU H H 45 8.566 8.566 8.456 0.110 17915 3606 1 16 . 1 1 46 46 VAL N N 46 124.904 124.904 124.774 0.130 17915 3607 1 16 . 1 1 46 46 VAL C C 46 174.608 174.608 175.597 -0.989 17915 3608 1 16 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.196 -0.545 17915 3609 1 16 . 1 1 46 46 VAL H H 46 8.774 8.774 8.576 0.198 17915 3610 1 16 . 1 1 47 47 ASN N N 47 126.530 126.530 125.803 0.727 17915 3611 1 16 . 1 1 47 47 ASN C C 47 174.259 174.259 174.831 -0.572 17915 3612 1 16 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.766 -0.521 17915 3613 1 16 . 1 1 47 47 ASN H H 47 9.356 9.356 9.004 0.352 17915 3614 1 16 . 1 1 48 48 ASP N N 48 112.420 112.420 119.235 -6.815 17915 3615 1 16 . 1 1 48 48 ASP C C 48 174.521 174.521 174.720 -0.199 17915 3616 1 16 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.322 0.360 17915 3617 1 16 . 1 1 48 48 ASP H H 48 8.628 8.628 8.305 0.323 17915 3618 1 16 . 1 1 49 49 ARG N N 49 120.379 120.379 118.805 1.574 17915 3619 1 16 . 1 1 49 49 ARG C C 49 174.477 174.477 174.410 0.067 17915 3620 1 16 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.712 0.586 17915 3621 1 16 . 1 1 49 49 ARG H H 49 8.069 8.069 7.715 0.354 17915 3622 1 16 . 1 1 50 50 GLN N N 50 118.647 118.647 117.664 0.983 17915 3623 1 16 . 1 1 50 50 GLN C C 50 175.963 175.963 174.839 1.124 17915 3624 1 16 . 1 1 50 50 GLN CA C 50 53.425 53.425 53.524 -0.099 17915 3625 1 16 . 1 1 50 50 GLN H H 50 8.432 8.432 8.371 0.061 17915 3626 1 16 . 1 1 51 51 GLY N N 51 107.028 107.028 105.563 1.465 17915 3627 1 16 . 1 1 51 51 GLY C C 51 170.479 170.479 171.488 -1.009 17915 3628 1 16 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.124 0.514 17915 3629 1 16 . 1 1 51 51 GLY H H 51 8.534 8.534 7.567 0.967 17915 3630 1 16 . 1 1 52 52 PHE N N 52 119.030 119.030 118.270 0.760 17915 3631 1 16 . 1 1 52 52 PHE C C 52 175.635 175.635 174.163 1.472 17915 3632 1 16 . 1 1 52 52 PHE CA C 52 58.724 58.724 57.387 1.337 17915 3633 1 16 . 1 1 52 52 PHE H H 52 9.098 9.098 8.276 0.822 17915 3634 1 16 . 1 1 53 53 VAL N N 53 110.897 110.897 121.161 -10.264 17915 3635 1 16 . 1 1 53 53 VAL CA C 53 58.108 58.108 57.596 0.512 17915 3636 1 16 . 1 1 53 53 VAL H H 53 8.942 8.942 8.275 0.667 17915 3637 1 16 . 1 1 55 55 ALA N N 55 129.055 129.055 128.445 0.610 17915 3638 1 16 . 1 1 55 55 ALA C C 55 178.565 178.565 178.866 -0.301 17915 3639 1 16 . 1 1 55 55 ALA CA C 55 54.629 54.629 55.008 -0.379 17915 3640 1 16 . 1 1 55 55 ALA H H 55 7.355 7.355 8.525 -1.170 17915 3641 1 16 . 1 1 56 56 ALA N N 56 113.282 113.282 119.330 -6.048 17915 3642 1 16 . 1 1 56 56 ALA C C 56 178.214 178.214 177.505 0.709 17915 3643 1 16 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.728 -0.785 17915 3644 1 16 . 1 1 56 56 ALA H H 56 7.750 7.750 8.328 -0.578 17915 3645 1 16 . 1 1 57 57 TYR N N 57 116.083 116.083 115.865 0.218 17915 3646 1 16 . 1 1 57 57 TYR C C 57 174.565 174.565 174.044 0.521 17915 3647 1 16 . 1 1 57 57 TYR CA C 57 56.422 56.422 58.356 -1.934 17915 3648 1 16 . 1 1 57 57 TYR H H 57 7.611 7.611 7.597 0.014 17915 3649 1 16 . 1 1 58 58 VAL N N 58 110.965 110.965 117.266 -6.301 17915 3650 1 16 . 1 1 58 58 VAL C C 58 173.647 173.647 173.992 -0.345 17915 3651 1 16 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.708 -1.466 17915 3652 1 16 . 1 1 58 58 VAL H H 58 7.301 7.301 7.246 0.055 17915 3653 1 16 . 1 1 59 59 LYS N N 59 118.586 118.586 125.702 -7.116 17915 3654 1 16 . 1 1 59 59 LYS C C 59 176.160 176.160 175.415 0.745 17915 3655 1 16 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.017 0.023 17915 3656 1 16 . 1 1 59 59 LYS H H 59 8.515 8.515 8.131 0.384 17915 3657 1 16 . 1 1 60 60 LYS N N 60 125.734 125.734 123.573 2.161 17915 3658 1 16 . 1 1 60 60 LYS C C 60 176.793 176.793 176.631 0.162 17915 3659 1 16 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.331 3.286 17915 3660 1 16 . 1 1 60 60 LYS H H 60 9.135 9.135 8.739 0.396 17915 3661 1 16 . 1 1 61 61 LEU N N 61 125.061 125.061 121.654 3.407 17915 3662 1 16 . 1 1 61 61 LEU C C 61 174.106 174.106 175.199 -1.093 17915 3663 1 16 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.116 -1.139 17915 3664 1 16 . 1 1 61 61 LEU H H 61 8.384 8.384 8.572 -0.188 17915 3665 1 17 . 1 1 2 2 ASP N N 2 123.220 123.220 123.024 0.196 17915 3666 1 17 . 1 1 2 2 ASP C C 2 175.703 175.703 175.176 0.527 17915 3667 1 17 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.217 -0.176 17915 3668 1 17 . 1 1 2 2 ASP H H 2 8.738 8.738 8.531 0.207 17915 3669 1 17 . 1 1 3 3 GLU N N 3 121.895 121.895 119.225 2.670 17915 3670 1 17 . 1 1 3 3 GLU C C 3 176.480 176.480 174.905 1.575 17915 3671 1 17 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.498 -0.370 17915 3672 1 17 . 1 1 3 3 GLU H H 3 8.570 8.570 8.418 0.152 17915 3673 1 17 . 1 1 4 4 THR N N 4 114.607 114.607 118.938 -4.331 17915 3674 1 17 . 1 1 4 4 THR C C 4 175.417 175.417 174.444 0.973 17915 3675 1 17 . 1 1 4 4 THR CA C 4 62.685 62.685 61.324 1.361 17915 3676 1 17 . 1 1 4 4 THR H H 4 8.176 8.176 8.559 -0.383 17915 3677 1 17 . 1 1 5 5 GLY N N 5 111.430 111.430 111.228 0.202 17915 3678 1 17 . 1 1 5 5 GLY C C 5 173.777 173.777 172.936 0.841 17915 3679 1 17 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.984 -0.424 17915 3680 1 17 . 1 1 5 5 GLY H H 5 8.344 8.344 7.565 0.779 17915 3681 1 17 . 1 1 6 6 LYS N N 6 119.850 119.850 124.651 -4.801 17915 3682 1 17 . 1 1 6 6 LYS C C 6 176.049 176.049 176.357 -0.308 17915 3683 1 17 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.178 -1.264 17915 3684 1 17 . 1 1 6 6 LYS H H 6 7.903 7.903 8.233 -0.330 17915 3685 1 17 . 1 1 7 7 GLU N N 7 123.025 123.025 118.960 4.065 17915 3686 1 17 . 1 1 7 7 GLU C C 7 174.172 174.172 174.400 -0.228 17915 3687 1 17 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.970 -2.511 17915 3688 1 17 . 1 1 7 7 GLU H H 7 8.562 8.562 8.572 -0.010 17915 3689 1 17 . 1 1 8 8 LEU N N 8 123.147 123.147 116.692 6.455 17915 3690 1 17 . 1 1 8 8 LEU C C 8 177.495 177.495 174.205 3.290 17915 3691 1 17 . 1 1 8 8 LEU CA C 8 53.425 53.425 54.045 -0.620 17915 3692 1 17 . 1 1 8 8 LEU H H 8 8.292 8.292 7.213 1.079 17915 3693 1 17 . 1 1 9 9 VAL N N 9 111.799 111.799 119.381 -7.582 17915 3694 1 17 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.054 -2.160 17915 3695 1 17 . 1 1 9 9 VAL H H 9 9.051 9.051 8.440 0.611 17915 3696 1 17 . 1 1 10 10 LEU N N 10 123.127 123.127 127.798 -4.671 17915 3697 1 17 . 1 1 10 10 LEU C C 10 176.729 176.729 175.918 0.811 17915 3698 1 17 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.769 -0.280 17915 3699 1 17 . 1 1 10 10 LEU H H 10 8.864 8.864 8.308 0.556 17915 3700 1 17 . 1 1 11 11 ALA N N 11 126.907 126.907 124.088 2.819 17915 3701 1 17 . 1 1 11 11 ALA C C 11 178.406 178.406 177.777 0.629 17915 3702 1 17 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.657 0.858 17915 3703 1 17 . 1 1 11 11 ALA H H 11 8.988 8.988 7.963 1.025 17915 3704 1 17 . 1 1 12 12 LEU N N 12 127.694 127.694 126.094 1.600 17915 3705 1 17 . 1 1 12 12 LEU C C 12 175.046 175.046 176.711 -1.665 17915 3706 1 17 . 1 1 12 12 LEU CA C 12 55.727 55.727 57.065 -1.338 17915 3707 1 17 . 1 1 12 12 LEU H H 12 9.136 9.136 8.861 0.275 17915 3708 1 17 . 1 1 13 13 TYR N N 13 111.415 111.415 117.522 -6.107 17915 3709 1 17 . 1 1 13 13 TYR C C 13 173.844 173.844 174.213 -0.369 17915 3710 1 17 . 1 1 13 13 TYR CA C 13 54.656 54.656 57.169 -2.513 17915 3711 1 17 . 1 1 13 13 TYR H H 13 6.979 6.979 7.797 -0.818 17915 3712 1 17 . 1 1 14 14 ASP N N 14 117.591 117.591 118.380 -0.789 17915 3713 1 17 . 1 1 14 14 ASP C C 14 176.140 176.140 174.066 2.074 17915 3714 1 17 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.415 -0.893 17915 3715 1 17 . 1 1 14 14 ASP H H 14 8.260 8.260 7.919 0.341 17915 3716 1 17 . 1 1 15 15 TYR N N 15 119.917 119.917 122.903 -2.986 17915 3717 1 17 . 1 1 15 15 TYR C C 15 172.859 172.859 173.453 -0.594 17915 3718 1 17 . 1 1 15 15 TYR CA C 15 59.661 59.661 58.212 1.449 17915 3719 1 17 . 1 1 15 15 TYR H H 15 8.580 8.580 8.080 0.500 17915 3720 1 17 . 1 1 16 16 GLN N N 16 127.024 127.024 122.995 4.029 17915 3721 1 17 . 1 1 16 16 GLN C C 16 176.377 176.377 175.105 1.272 17915 3722 1 17 . 1 1 16 16 GLN CA C 16 53.666 53.666 53.966 -0.300 17915 3723 1 17 . 1 1 16 16 GLN H H 16 7.450 7.450 7.664 -0.214 17915 3724 1 17 . 1 1 17 17 GLU N N 17 122.837 122.837 120.676 2.161 17915 3725 1 17 . 1 1 17 17 GLU C C 17 176.140 176.140 175.718 0.422 17915 3726 1 17 . 1 1 17 17 GLU CA C 17 56.075 56.075 57.721 -1.646 17915 3727 1 17 . 1 1 17 17 GLU H H 17 7.899 7.899 8.690 -0.791 17915 3728 1 17 . 1 1 18 18 LYS N N 18 120.622 120.622 118.199 2.423 17915 3729 1 17 . 1 1 18 18 LYS C C 18 176.267 176.267 174.289 1.978 17915 3730 1 17 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.913 -1.668 17915 3731 1 17 . 1 1 18 18 LYS H H 18 8.649 8.649 8.380 0.269 17915 3732 1 17 . 1 1 19 19 SER N N 19 115.184 115.184 111.643 3.541 17915 3733 1 17 . 1 1 19 19 SER CA C 19 56.824 56.824 56.422 0.402 17915 3734 1 17 . 1 1 19 19 SER H H 19 7.552 7.552 7.412 0.140 17915 3735 1 17 . 1 1 21 21 ARG N N 21 113.440 113.440 117.784 -4.344 17915 3736 1 17 . 1 1 21 21 ARG C C 21 176.638 176.638 175.265 1.373 17915 3737 1 17 . 1 1 21 21 ARG CA C 21 56.208 56.208 55.224 0.985 17915 3738 1 17 . 1 1 21 21 ARG H H 21 7.596 7.596 8.032 -0.436 17915 3739 1 17 . 1 1 22 22 GLU N N 22 121.392 121.392 117.129 4.263 17915 3740 1 17 . 1 1 22 22 GLU C C 22 174.500 174.500 173.939 0.561 17915 3741 1 17 . 1 1 22 22 GLU CA C 22 55.352 55.352 57.533 -2.181 17915 3742 1 17 . 1 1 22 22 GLU H H 22 7.746 7.746 7.859 -0.114 17915 3743 1 17 . 1 1 23 23 VAL N N 23 114.115 114.115 114.512 -0.397 17915 3744 1 17 . 1 1 23 23 VAL C C 23 172.337 172.337 173.499 -1.162 17915 3745 1 17 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.429 -0.554 17915 3746 1 17 . 1 1 23 23 VAL H H 23 7.318 7.318 8.103 -0.785 17915 3747 1 17 . 1 1 24 24 THR N N 24 118.996 118.996 116.459 2.537 17915 3748 1 17 . 1 1 24 24 THR C C 24 174.451 174.451 172.947 1.504 17915 3749 1 17 . 1 1 24 24 THR CA C 24 61.641 61.641 61.124 0.517 17915 3750 1 17 . 1 1 24 24 THR H H 24 7.324 7.324 8.398 -1.074 17915 3751 1 17 . 1 1 25 25 MET N N 25 121.901 121.901 126.340 -4.439 17915 3752 1 17 . 1 1 25 25 MET C C 25 173.931 173.931 174.027 -0.096 17915 3753 1 17 . 1 1 25 25 MET CA C 25 54.389 54.389 53.984 0.405 17915 3754 1 17 . 1 1 25 25 MET H H 25 9.432 9.432 8.130 1.302 17915 3755 1 17 . 1 1 26 26 LYS N N 26 124.169 124.169 121.039 3.130 17915 3756 1 17 . 1 1 26 26 LYS C C 26 175.002 175.002 175.963 -0.961 17915 3757 1 17 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.389 -0.723 17915 3758 1 17 . 1 1 26 26 LYS H H 26 8.634 8.634 8.399 0.235 17915 3759 1 17 . 1 1 27 27 LYS N N 27 122.603 122.603 126.559 -3.956 17915 3760 1 17 . 1 1 27 27 LYS C C 27 177.318 177.318 177.313 0.005 17915 3761 1 17 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.385 0.259 17915 3762 1 17 . 1 1 27 27 LYS H H 27 8.919 8.919 8.892 0.027 17915 3763 1 17 . 1 1 28 28 GLY N N 28 115.585 115.585 115.147 0.438 17915 3764 1 17 . 1 1 28 28 GLY C C 28 174.193 174.193 174.478 -0.285 17915 3765 1 17 . 1 1 28 28 GLY CA C 28 44.888 44.888 45.100 -0.212 17915 3766 1 17 . 1 1 28 28 GLY H H 28 8.732 8.732 8.448 0.284 17915 3767 1 17 . 1 1 29 29 ASP N N 29 121.770 121.770 122.055 -0.285 17915 3768 1 17 . 1 1 29 29 ASP C C 29 174.281 174.281 175.503 -1.222 17915 3769 1 17 . 1 1 29 29 ASP CA C 29 55.486 55.486 53.492 1.994 17915 3770 1 17 . 1 1 29 29 ASP H H 29 8.388 8.388 7.989 0.399 17915 3771 1 17 . 1 1 30 30 ILE N N 30 120.469 120.469 117.426 3.043 17915 3772 1 17 . 1 1 30 30 ILE C C 30 176.356 176.356 174.731 1.625 17915 3773 1 17 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.930 0.319 17915 3774 1 17 . 1 1 30 30 ILE H H 30 8.033 8.033 8.042 -0.009 17915 3775 1 17 . 1 1 31 31 LEU N N 31 127.129 127.129 128.040 -0.911 17915 3776 1 17 . 1 1 31 31 LEU C C 31 175.745 175.745 175.717 0.028 17915 3777 1 17 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.807 0.100 17915 3778 1 17 . 1 1 31 31 LEU H H 31 9.223 9.223 8.369 0.854 17915 3779 1 17 . 1 1 32 32 THR N N 32 117.055 117.055 115.792 1.263 17915 3780 1 17 . 1 1 32 32 THR C C 32 173.844 173.844 173.908 -0.064 17915 3781 1 17 . 1 1 32 32 THR CA C 32 63.247 63.247 61.333 1.914 17915 3782 1 17 . 1 1 32 32 THR H H 32 8.360 8.360 8.327 0.033 17915 3783 1 17 . 1 1 33 33 LEU N N 33 128.815 128.815 122.044 6.771 17915 3784 1 17 . 1 1 33 33 LEU C C 33 174.718 174.718 175.435 -0.717 17915 3785 1 17 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.145 0.725 17915 3786 1 17 . 1 1 33 33 LEU H H 33 8.937 8.937 7.738 1.199 17915 3787 1 17 . 1 1 34 34 LEU N N 34 126.230 126.230 125.182 1.048 17915 3788 1 17 . 1 1 34 34 LEU C C 34 177.689 177.689 176.745 0.944 17915 3789 1 17 . 1 1 34 34 LEU CA C 34 55.218 55.218 56.699 -1.481 17915 3790 1 17 . 1 1 34 34 LEU H H 34 8.929 8.929 8.534 0.395 17915 3791 1 17 . 1 1 35 35 ASN N N 35 113.879 113.879 112.998 0.881 17915 3792 1 17 . 1 1 35 35 ASN C C 35 174.565 174.565 172.942 1.623 17915 3793 1 17 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.310 1.266 17915 3794 1 17 . 1 1 35 35 ASN H H 35 7.489 7.489 8.033 -0.544 17915 3795 1 17 . 1 1 36 36 SER N N 36 123.684 123.684 117.977 5.707 17915 3796 1 17 . 1 1 36 36 SER C C 36 173.503 173.503 174.438 -0.935 17915 3797 1 17 . 1 1 36 36 SER CA C 36 56.904 56.904 57.370 -0.466 17915 3798 1 17 . 1 1 36 36 SER H H 36 9.086 9.086 8.671 0.415 17915 3799 1 17 . 1 1 37 37 THR N N 37 115.012 115.012 117.993 -2.981 17915 3800 1 17 . 1 1 37 37 THR C C 37 175.417 175.417 176.008 -0.591 17915 3801 1 17 . 1 1 37 37 THR CA C 37 65.521 65.521 64.529 0.992 17915 3802 1 17 . 1 1 37 37 THR H H 37 8.071 8.071 8.380 -0.309 17915 3803 1 17 . 1 1 38 38 ASN N N 38 122.517 122.517 119.295 3.222 17915 3804 1 17 . 1 1 38 38 ASN C C 38 174.696 174.696 175.379 -0.683 17915 3805 1 17 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.296 0.183 17915 3806 1 17 . 1 1 38 38 ASN H H 38 8.595 8.595 8.539 0.056 17915 3807 1 17 . 1 1 39 39 LYS N N 39 120.851 120.851 119.418 1.433 17915 3808 1 17 . 1 1 39 39 LYS C C 39 176.444 176.444 176.856 -0.412 17915 3809 1 17 . 1 1 39 39 LYS CA C 39 58.403 58.403 59.018 -0.615 17915 3810 1 17 . 1 1 39 39 LYS H H 39 8.416 8.416 8.575 -0.159 17915 3811 1 17 . 1 1 40 40 ASP N N 40 114.427 114.427 117.440 -3.013 17915 3812 1 17 . 1 1 40 40 ASP C C 40 176.960 176.960 175.113 1.847 17915 3813 1 17 . 1 1 40 40 ASP CA C 40 55.352 55.352 54.725 0.627 17915 3814 1 17 . 1 1 40 40 ASP H H 40 8.085 8.085 8.086 -0.001 17915 3815 1 17 . 1 1 41 41 TRP N N 41 122.708 122.708 118.788 3.920 17915 3816 1 17 . 1 1 41 41 TRP C C 41 174.303 174.303 174.621 -0.318 17915 3817 1 17 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.868 -0.660 17915 3818 1 17 . 1 1 41 41 TRP H H 41 8.096 8.096 7.637 0.459 17915 3819 1 17 . 1 1 42 42 TRP N N 42 124.707 124.707 122.725 1.982 17915 3820 1 17 . 1 1 42 42 TRP C C 42 174.303 174.303 175.109 -0.806 17915 3821 1 17 . 1 1 42 42 TRP CA C 42 53.987 53.987 54.944 -0.957 17915 3822 1 17 . 1 1 42 42 TRP H H 42 9.245 9.245 8.364 0.881 17915 3823 1 17 . 1 1 43 43 LYS N N 43 124.005 124.005 120.666 3.339 17915 3824 1 17 . 1 1 43 43 LYS C C 43 175.482 175.482 174.962 0.520 17915 3825 1 17 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.286 0.093 17915 3826 1 17 . 1 1 43 43 LYS H H 43 8.783 8.783 8.518 0.265 17915 3827 1 17 . 1 1 44 44 VAL N N 44 122.139 122.139 120.092 2.047 17915 3828 1 17 . 1 1 44 44 VAL C C 44 173.472 173.472 174.218 -0.746 17915 3829 1 17 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.121 -0.049 17915 3830 1 17 . 1 1 44 44 VAL H H 44 9.287 9.287 8.485 0.802 17915 3831 1 17 . 1 1 45 45 GLU N N 45 118.524 118.524 121.688 -3.164 17915 3832 1 17 . 1 1 45 45 GLU C C 45 174.827 174.827 175.458 -0.631 17915 3833 1 17 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.664 -0.490 17915 3834 1 17 . 1 1 45 45 GLU H H 45 8.566 8.566 8.346 0.220 17915 3835 1 17 . 1 1 46 46 VAL N N 46 124.904 124.904 122.557 2.347 17915 3836 1 17 . 1 1 46 46 VAL C C 46 174.608 174.608 175.129 -0.521 17915 3837 1 17 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.427 -0.776 17915 3838 1 17 . 1 1 46 46 VAL H H 46 8.774 8.774 7.876 0.898 17915 3839 1 17 . 1 1 47 47 ASN N N 47 126.530 126.530 125.256 1.274 17915 3840 1 17 . 1 1 47 47 ASN C C 47 174.259 174.259 174.813 -0.554 17915 3841 1 17 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.056 1.189 17915 3842 1 17 . 1 1 47 47 ASN H H 47 9.356 9.356 9.049 0.307 17915 3843 1 17 . 1 1 48 48 ASP N N 48 112.420 112.420 114.298 -1.878 17915 3844 1 17 . 1 1 48 48 ASP C C 48 174.521 174.521 174.988 -0.467 17915 3845 1 17 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.808 -1.125 17915 3846 1 17 . 1 1 48 48 ASP H H 48 8.628 8.628 8.352 0.276 17915 3847 1 17 . 1 1 49 49 ARG N N 49 120.379 120.379 116.539 3.840 17915 3848 1 17 . 1 1 49 49 ARG C C 49 174.477 174.477 174.330 0.147 17915 3849 1 17 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.178 1.120 17915 3850 1 17 . 1 1 49 49 ARG H H 49 8.069 8.069 7.755 0.314 17915 3851 1 17 . 1 1 50 50 GLN N N 50 118.647 118.647 118.375 0.272 17915 3852 1 17 . 1 1 50 50 GLN C C 50 175.963 175.963 175.290 0.673 17915 3853 1 17 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.556 -1.131 17915 3854 1 17 . 1 1 50 50 GLN H H 50 8.432 8.432 8.603 -0.171 17915 3855 1 17 . 1 1 51 51 GLY N N 51 107.028 107.028 108.681 -1.653 17915 3856 1 17 . 1 1 51 51 GLY C C 51 170.479 170.479 172.526 -2.047 17915 3857 1 17 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.598 0.040 17915 3858 1 17 . 1 1 51 51 GLY H H 51 8.534 8.534 8.405 0.129 17915 3859 1 17 . 1 1 52 52 PHE N N 52 119.030 119.030 122.645 -3.615 17915 3860 1 17 . 1 1 52 52 PHE C C 52 175.635 175.635 173.499 2.136 17915 3861 1 17 . 1 1 52 52 PHE CA C 52 58.724 58.724 57.084 1.640 17915 3862 1 17 . 1 1 52 52 PHE H H 52 9.098 9.098 8.216 0.882 17915 3863 1 17 . 1 1 53 53 VAL N N 53 110.897 110.897 127.326 -16.429 17915 3864 1 17 . 1 1 53 53 VAL CA C 53 58.108 58.108 56.839 1.269 17915 3865 1 17 . 1 1 53 53 VAL H H 53 8.942 8.942 8.292 0.650 17915 3866 1 17 . 1 1 55 55 ALA N N 55 129.055 129.055 127.183 1.872 17915 3867 1 17 . 1 1 55 55 ALA C C 55 178.565 178.565 178.794 -0.229 17915 3868 1 17 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.165 0.464 17915 3869 1 17 . 1 1 55 55 ALA H H 55 7.355 7.355 8.122 -0.767 17915 3870 1 17 . 1 1 56 56 ALA N N 56 113.282 113.282 119.377 -6.095 17915 3871 1 17 . 1 1 56 56 ALA C C 56 178.214 178.214 177.854 0.360 17915 3872 1 17 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.887 -0.944 17915 3873 1 17 . 1 1 56 56 ALA H H 56 7.750 7.750 7.966 -0.216 17915 3874 1 17 . 1 1 57 57 TYR N N 57 116.083 116.083 115.825 0.258 17915 3875 1 17 . 1 1 57 57 TYR C C 57 174.565 174.565 175.818 -1.253 17915 3876 1 17 . 1 1 57 57 TYR CA C 57 56.422 56.422 59.188 -2.766 17915 3877 1 17 . 1 1 57 57 TYR H H 57 7.611 7.611 7.576 0.035 17915 3878 1 17 . 1 1 58 58 VAL N N 58 110.965 110.965 112.743 -1.778 17915 3879 1 17 . 1 1 58 58 VAL C C 58 173.647 173.647 173.801 -0.154 17915 3880 1 17 . 1 1 58 58 VAL CA C 58 58.242 58.242 60.381 -2.139 17915 3881 1 17 . 1 1 58 58 VAL H H 58 7.301 7.301 7.703 -0.402 17915 3882 1 17 . 1 1 59 59 LYS N N 59 118.586 118.586 122.668 -4.082 17915 3883 1 17 . 1 1 59 59 LYS C C 59 176.160 176.160 175.248 0.912 17915 3884 1 17 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.555 -0.514 17915 3885 1 17 . 1 1 59 59 LYS H H 59 8.515 8.515 8.367 0.148 17915 3886 1 17 . 1 1 60 60 LYS N N 60 125.734 125.734 122.094 3.640 17915 3887 1 17 . 1 1 60 60 LYS C C 60 176.793 176.793 176.499 0.294 17915 3888 1 17 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.203 3.414 17915 3889 1 17 . 1 1 60 60 LYS H H 60 9.135 9.135 8.537 0.598 17915 3890 1 17 . 1 1 61 61 LEU N N 61 125.061 125.061 121.432 3.629 17915 3891 1 17 . 1 1 61 61 LEU C C 61 174.106 174.106 175.576 -1.470 17915 3892 1 17 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.562 -0.584 17915 3893 1 17 . 1 1 61 61 LEU H H 61 8.384 8.384 8.790 -0.406 17915 3894 1 18 . 1 1 2 2 ASP N N 2 123.220 123.220 122.934 0.286 17915 3895 1 18 . 1 1 2 2 ASP C C 2 175.703 175.703 176.326 -0.623 17915 3896 1 18 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.990 -0.949 17915 3897 1 18 . 1 1 2 2 ASP H H 2 8.738 8.738 8.691 0.047 17915 3898 1 18 . 1 1 3 3 GLU N N 3 121.895 121.895 117.953 3.942 17915 3899 1 18 . 1 1 3 3 GLU C C 3 176.480 176.480 175.195 1.285 17915 3900 1 18 . 1 1 3 3 GLU CA C 3 56.128 56.128 57.049 -0.921 17915 3901 1 18 . 1 1 3 3 GLU H H 3 8.570 8.570 8.613 -0.043 17915 3902 1 18 . 1 1 4 4 THR N N 4 114.607 114.607 109.893 4.714 17915 3903 1 18 . 1 1 4 4 THR C C 4 175.417 175.417 173.899 1.518 17915 3904 1 18 . 1 1 4 4 THR CA C 4 62.685 62.685 60.411 2.274 17915 3905 1 18 . 1 1 4 4 THR H H 4 8.176 8.176 8.096 0.080 17915 3906 1 18 . 1 1 5 5 GLY N N 5 111.430 111.430 108.625 2.805 17915 3907 1 18 . 1 1 5 5 GLY C C 5 173.777 173.777 172.723 1.054 17915 3908 1 18 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.435 0.125 17915 3909 1 18 . 1 1 5 5 GLY H H 5 8.344 8.344 8.030 0.314 17915 3910 1 18 . 1 1 6 6 LYS N N 6 119.850 119.850 122.694 -2.844 17915 3911 1 18 . 1 1 6 6 LYS C C 6 176.049 176.049 174.897 1.152 17915 3912 1 18 . 1 1 6 6 LYS CA C 6 55.914 55.914 55.696 0.218 17915 3913 1 18 . 1 1 6 6 LYS H H 6 7.903 7.903 7.843 0.060 17915 3914 1 18 . 1 1 7 7 GLU N N 7 123.025 123.025 123.087 -0.062 17915 3915 1 18 . 1 1 7 7 GLU C C 7 174.172 174.172 174.117 0.055 17915 3916 1 18 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.338 -1.879 17915 3917 1 18 . 1 1 7 7 GLU H H 7 8.562 8.562 8.502 0.060 17915 3918 1 18 . 1 1 8 8 LEU N N 8 123.147 123.147 118.551 4.596 17915 3919 1 18 . 1 1 8 8 LEU C C 8 177.495 177.495 175.484 2.011 17915 3920 1 18 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.316 0.109 17915 3921 1 18 . 1 1 8 8 LEU H H 8 8.292 8.292 7.613 0.679 17915 3922 1 18 . 1 1 9 9 VAL N N 9 111.799 111.799 116.775 -4.976 17915 3923 1 18 . 1 1 9 9 VAL CA C 9 57.894 57.894 60.095 -2.201 17915 3924 1 18 . 1 1 9 9 VAL H H 9 9.051 9.051 8.277 0.774 17915 3925 1 18 . 1 1 10 10 LEU N N 10 123.127 123.127 125.624 -2.497 17915 3926 1 18 . 1 1 10 10 LEU C C 10 176.729 176.729 176.548 0.181 17915 3927 1 18 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.869 -0.380 17915 3928 1 18 . 1 1 10 10 LEU H H 10 8.864 8.864 7.888 0.976 17915 3929 1 18 . 1 1 11 11 ALA N N 11 126.907 126.907 125.611 1.296 17915 3930 1 18 . 1 1 11 11 ALA C C 11 178.406 178.406 177.193 1.213 17915 3931 1 18 . 1 1 11 11 ALA CA C 11 52.515 52.515 52.063 0.452 17915 3932 1 18 . 1 1 11 11 ALA H H 11 8.988 8.988 8.694 0.294 17915 3933 1 18 . 1 1 12 12 LEU N N 12 127.694 127.694 124.911 2.783 17915 3934 1 18 . 1 1 12 12 LEU C C 12 175.046 175.046 175.385 -0.339 17915 3935 1 18 . 1 1 12 12 LEU CA C 12 55.727 55.727 55.795 -0.068 17915 3936 1 18 . 1 1 12 12 LEU H H 12 9.136 9.136 8.781 0.355 17915 3937 1 18 . 1 1 13 13 TYR N N 13 111.415 111.415 114.286 -2.871 17915 3938 1 18 . 1 1 13 13 TYR C C 13 173.844 173.844 174.365 -0.521 17915 3939 1 18 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.142 -1.486 17915 3940 1 18 . 1 1 13 13 TYR H H 13 6.979 6.979 7.467 -0.488 17915 3941 1 18 . 1 1 14 14 ASP N N 14 117.591 117.591 122.331 -4.740 17915 3942 1 18 . 1 1 14 14 ASP C C 14 176.140 176.140 176.108 0.032 17915 3943 1 18 . 1 1 14 14 ASP CA C 14 54.522 54.522 54.805 -0.283 17915 3944 1 18 . 1 1 14 14 ASP H H 14 8.260 8.260 8.384 -0.124 17915 3945 1 18 . 1 1 15 15 TYR N N 15 119.917 119.917 114.996 4.921 17915 3946 1 18 . 1 1 15 15 TYR C C 15 172.859 172.859 175.055 -2.196 17915 3947 1 18 . 1 1 15 15 TYR CA C 15 59.661 59.661 59.626 0.035 17915 3948 1 18 . 1 1 15 15 TYR H H 15 8.580 8.580 8.626 -0.046 17915 3949 1 18 . 1 1 16 16 GLN N N 16 127.024 127.024 119.206 7.818 17915 3950 1 18 . 1 1 16 16 GLN C C 16 176.377 176.377 175.172 1.205 17915 3951 1 18 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.525 -1.859 17915 3952 1 18 . 1 1 16 16 GLN H H 16 7.450 7.450 8.396 -0.946 17915 3953 1 18 . 1 1 17 17 GLU N N 17 122.837 122.837 123.052 -0.215 17915 3954 1 18 . 1 1 17 17 GLU C C 17 176.140 176.140 177.098 -0.958 17915 3955 1 18 . 1 1 17 17 GLU CA C 17 56.075 56.075 58.755 -2.680 17915 3956 1 18 . 1 1 17 17 GLU H H 17 7.899 7.899 8.948 -1.049 17915 3957 1 18 . 1 1 18 18 LYS N N 18 120.622 120.622 115.050 5.572 17915 3958 1 18 . 1 1 18 18 LYS C C 18 176.267 176.267 175.841 0.426 17915 3959 1 18 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.300 -1.055 17915 3960 1 18 . 1 1 18 18 LYS H H 18 8.649 8.649 7.680 0.969 17915 3961 1 18 . 1 1 19 19 SER N N 19 115.184 115.184 117.365 -2.181 17915 3962 1 18 . 1 1 19 19 SER CA C 19 56.824 56.824 56.399 0.425 17915 3963 1 18 . 1 1 19 19 SER H H 19 7.552 7.552 8.190 -0.638 17915 3964 1 18 . 1 1 21 21 ARG N N 21 113.440 113.440 118.242 -4.802 17915 3965 1 18 . 1 1 21 21 ARG C C 21 176.638 176.638 177.159 -0.521 17915 3966 1 18 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.520 -0.312 17915 3967 1 18 . 1 1 21 21 ARG H H 21 7.596 7.596 8.111 -0.515 17915 3968 1 18 . 1 1 22 22 GLU N N 22 121.392 121.392 116.490 4.902 17915 3969 1 18 . 1 1 22 22 GLU C C 22 174.500 174.500 175.791 -1.291 17915 3970 1 18 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.947 -1.595 17915 3971 1 18 . 1 1 22 22 GLU H H 22 7.746 7.746 7.732 0.014 17915 3972 1 18 . 1 1 23 23 VAL N N 23 114.115 114.115 118.371 -4.256 17915 3973 1 18 . 1 1 23 23 VAL C C 23 172.337 172.337 174.619 -2.282 17915 3974 1 18 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.756 -0.881 17915 3975 1 18 . 1 1 23 23 VAL H H 23 7.318 7.318 8.211 -0.893 17915 3976 1 18 . 1 1 24 24 THR N N 24 118.996 118.996 121.504 -2.508 17915 3977 1 18 . 1 1 24 24 THR C C 24 174.451 174.451 174.115 0.336 17915 3978 1 18 . 1 1 24 24 THR CA C 24 61.641 61.641 61.994 -0.353 17915 3979 1 18 . 1 1 24 24 THR H H 24 7.324 7.324 8.324 -1.000 17915 3980 1 18 . 1 1 25 25 MET N N 25 121.901 121.901 126.867 -4.966 17915 3981 1 18 . 1 1 25 25 MET C C 25 173.931 173.931 174.698 -0.767 17915 3982 1 18 . 1 1 25 25 MET CA C 25 54.389 54.389 54.087 0.302 17915 3983 1 18 . 1 1 25 25 MET H H 25 9.432 9.432 8.390 1.042 17915 3984 1 18 . 1 1 26 26 LYS N N 26 124.169 124.169 121.432 2.737 17915 3985 1 18 . 1 1 26 26 LYS C C 26 175.002 175.002 176.610 -1.608 17915 3986 1 18 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.630 -1.964 17915 3987 1 18 . 1 1 26 26 LYS H H 26 8.634 8.634 8.684 -0.050 17915 3988 1 18 . 1 1 27 27 LYS N N 27 122.603 122.603 124.880 -2.277 17915 3989 1 18 . 1 1 27 27 LYS C C 27 177.318 177.318 177.517 -0.199 17915 3990 1 18 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.596 0.048 17915 3991 1 18 . 1 1 27 27 LYS H H 27 8.919 8.919 8.872 0.047 17915 3992 1 18 . 1 1 28 28 GLY N N 28 115.585 115.585 113.811 1.774 17915 3993 1 18 . 1 1 28 28 GLY C C 28 174.193 174.193 174.471 -0.278 17915 3994 1 18 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.965 -0.077 17915 3995 1 18 . 1 1 28 28 GLY H H 28 8.732 8.732 8.266 0.466 17915 3996 1 18 . 1 1 29 29 ASP N N 29 121.770 121.770 121.832 -0.062 17915 3997 1 18 . 1 1 29 29 ASP C C 29 174.281 174.281 175.400 -1.119 17915 3998 1 18 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.083 1.403 17915 3999 1 18 . 1 1 29 29 ASP H H 29 8.388 8.388 7.966 0.422 17915 4000 1 18 . 1 1 30 30 ILE N N 30 120.469 120.469 116.655 3.814 17915 4001 1 18 . 1 1 30 30 ILE C C 30 176.356 176.356 174.415 1.941 17915 4002 1 18 . 1 1 30 30 ILE CA C 30 60.249 60.249 59.217 1.032 17915 4003 1 18 . 1 1 30 30 ILE H H 30 8.033 8.033 8.062 -0.029 17915 4004 1 18 . 1 1 31 31 LEU N N 31 127.129 127.129 124.682 2.447 17915 4005 1 18 . 1 1 31 31 LEU C C 31 175.745 175.745 176.063 -0.318 17915 4006 1 18 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.267 0.640 17915 4007 1 18 . 1 1 31 31 LEU H H 31 9.223 9.223 8.965 0.258 17915 4008 1 18 . 1 1 32 32 THR N N 32 117.055 117.055 119.087 -2.032 17915 4009 1 18 . 1 1 32 32 THR C C 32 173.844 173.844 173.863 -0.019 17915 4010 1 18 . 1 1 32 32 THR CA C 32 63.247 63.247 61.994 1.253 17915 4011 1 18 . 1 1 32 32 THR H H 32 8.360 8.360 8.345 0.015 17915 4012 1 18 . 1 1 33 33 LEU N N 33 128.815 128.815 122.421 6.394 17915 4013 1 18 . 1 1 33 33 LEU C C 33 174.718 174.718 175.778 -1.060 17915 4014 1 18 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.743 0.127 17915 4015 1 18 . 1 1 33 33 LEU H H 33 8.937 8.937 8.457 0.480 17915 4016 1 18 . 1 1 34 34 LEU N N 34 126.230 126.230 122.015 4.215 17915 4017 1 18 . 1 1 34 34 LEU C C 34 177.689 177.689 177.086 0.603 17915 4018 1 18 . 1 1 34 34 LEU CA C 34 55.218 55.218 54.824 0.394 17915 4019 1 18 . 1 1 34 34 LEU H H 34 8.929 8.929 8.437 0.492 17915 4020 1 18 . 1 1 35 35 ASN N N 35 113.879 113.879 117.792 -3.913 17915 4021 1 18 . 1 1 35 35 ASN C C 35 174.565 174.565 174.295 0.270 17915 4022 1 18 . 1 1 35 35 ASN CA C 35 54.576 54.576 52.913 1.663 17915 4023 1 18 . 1 1 35 35 ASN H H 35 7.489 7.489 7.605 -0.116 17915 4024 1 18 . 1 1 36 36 SER N N 36 123.684 123.684 115.691 7.993 17915 4025 1 18 . 1 1 36 36 SER C C 36 173.503 173.503 174.609 -1.106 17915 4026 1 18 . 1 1 36 36 SER CA C 36 56.904 56.904 58.141 -1.237 17915 4027 1 18 . 1 1 36 36 SER H H 36 9.086 9.086 8.532 0.554 17915 4028 1 18 . 1 1 37 37 THR N N 37 115.012 115.012 120.371 -5.359 17915 4029 1 18 . 1 1 37 37 THR C C 37 175.417 175.417 173.834 1.583 17915 4030 1 18 . 1 1 37 37 THR CA C 37 65.521 65.521 63.765 1.756 17915 4031 1 18 . 1 1 37 37 THR H H 37 8.071 8.071 8.062 0.009 17915 4032 1 18 . 1 1 38 38 ASN N N 38 122.517 122.517 121.374 1.143 17915 4033 1 18 . 1 1 38 38 ASN C C 38 174.696 174.696 176.161 -1.465 17915 4034 1 18 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.736 -0.257 17915 4035 1 18 . 1 1 38 38 ASN H H 38 8.595 8.595 8.708 -0.113 17915 4036 1 18 . 1 1 39 39 LYS N N 39 120.851 120.851 120.741 0.110 17915 4037 1 18 . 1 1 39 39 LYS C C 39 176.444 176.444 176.946 -0.502 17915 4038 1 18 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.692 -0.289 17915 4039 1 18 . 1 1 39 39 LYS H H 39 8.416 8.416 8.722 -0.306 17915 4040 1 18 . 1 1 40 40 ASP N N 40 114.427 114.427 116.823 -2.396 17915 4041 1 18 . 1 1 40 40 ASP C C 40 176.960 176.960 174.834 2.126 17915 4042 1 18 . 1 1 40 40 ASP CA C 40 55.352 55.352 54.791 0.561 17915 4043 1 18 . 1 1 40 40 ASP H H 40 8.085 8.085 7.969 0.116 17915 4044 1 18 . 1 1 41 41 TRP N N 41 122.708 122.708 118.704 4.004 17915 4045 1 18 . 1 1 41 41 TRP C C 41 174.303 174.303 174.458 -0.155 17915 4046 1 18 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.712 -0.504 17915 4047 1 18 . 1 1 41 41 TRP H H 41 8.096 8.096 7.560 0.536 17915 4048 1 18 . 1 1 42 42 TRP N N 42 124.707 124.707 123.581 1.126 17915 4049 1 18 . 1 1 42 42 TRP C C 42 174.303 174.303 174.289 0.014 17915 4050 1 18 . 1 1 42 42 TRP CA C 42 53.987 53.987 54.723 -0.736 17915 4051 1 18 . 1 1 42 42 TRP H H 42 9.245 9.245 7.613 1.632 17915 4052 1 18 . 1 1 43 43 LYS N N 43 124.005 124.005 121.047 2.958 17915 4053 1 18 . 1 1 43 43 LYS C C 43 175.482 175.482 175.473 0.009 17915 4054 1 18 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.249 0.130 17915 4055 1 18 . 1 1 43 43 LYS H H 43 8.783 8.783 8.584 0.199 17915 4056 1 18 . 1 1 44 44 VAL N N 44 122.139 122.139 119.288 2.851 17915 4057 1 18 . 1 1 44 44 VAL C C 44 173.472 173.472 174.380 -0.908 17915 4058 1 18 . 1 1 44 44 VAL CA C 44 59.072 59.072 60.047 -0.975 17915 4059 1 18 . 1 1 44 44 VAL H H 44 9.287 9.287 8.431 0.856 17915 4060 1 18 . 1 1 45 45 GLU N N 45 118.524 118.524 120.719 -2.195 17915 4061 1 18 . 1 1 45 45 GLU C C 45 174.827 174.827 175.531 -0.704 17915 4062 1 18 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.678 -0.504 17915 4063 1 18 . 1 1 45 45 GLU H H 45 8.566 8.566 8.056 0.510 17915 4064 1 18 . 1 1 46 46 VAL N N 46 124.904 124.904 124.924 -0.020 17915 4065 1 18 . 1 1 46 46 VAL C C 46 174.608 174.608 175.276 -0.668 17915 4066 1 18 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.087 -0.436 17915 4067 1 18 . 1 1 46 46 VAL H H 46 8.774 8.774 7.905 0.869 17915 4068 1 18 . 1 1 47 47 ASN N N 47 126.530 126.530 126.497 0.033 17915 4069 1 18 . 1 1 47 47 ASN C C 47 174.259 174.259 175.004 -0.745 17915 4070 1 18 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.901 -0.656 17915 4071 1 18 . 1 1 47 47 ASN H H 47 9.356 9.356 9.202 0.154 17915 4072 1 18 . 1 1 48 48 ASP N N 48 112.420 112.420 120.296 -7.876 17915 4073 1 18 . 1 1 48 48 ASP C C 48 174.521 174.521 174.689 -0.168 17915 4074 1 18 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.740 -0.057 17915 4075 1 18 . 1 1 48 48 ASP H H 48 8.628 8.628 8.378 0.250 17915 4076 1 18 . 1 1 49 49 ARG N N 49 120.379 120.379 119.473 0.906 17915 4077 1 18 . 1 1 49 49 ARG C C 49 174.477 174.477 174.343 0.134 17915 4078 1 18 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.162 0.136 17915 4079 1 18 . 1 1 49 49 ARG H H 49 8.069 8.069 7.957 0.112 17915 4080 1 18 . 1 1 50 50 GLN N N 50 118.647 118.647 118.055 0.592 17915 4081 1 18 . 1 1 50 50 GLN C C 50 175.963 175.963 174.340 1.623 17915 4082 1 18 . 1 1 50 50 GLN CA C 50 53.425 53.425 55.023 -1.598 17915 4083 1 18 . 1 1 50 50 GLN H H 50 8.432 8.432 8.359 0.073 17915 4084 1 18 . 1 1 51 51 GLY N N 51 107.028 107.028 109.769 -2.741 17915 4085 1 18 . 1 1 51 51 GLY C C 51 170.479 170.479 171.952 -1.473 17915 4086 1 18 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.758 -0.120 17915 4087 1 18 . 1 1 51 51 GLY H H 51 8.534 8.534 8.738 -0.204 17915 4088 1 18 . 1 1 52 52 PHE N N 52 119.030 119.030 117.573 1.457 17915 4089 1 18 . 1 1 52 52 PHE C C 52 175.635 175.635 173.752 1.883 17915 4090 1 18 . 1 1 52 52 PHE CA C 52 58.724 58.724 56.809 1.915 17915 4091 1 18 . 1 1 52 52 PHE H H 52 9.098 9.098 7.363 1.735 17915 4092 1 18 . 1 1 53 53 VAL N N 53 110.897 110.897 123.508 -12.611 17915 4093 1 18 . 1 1 53 53 VAL CA C 53 58.108 58.108 58.868 -0.760 17915 4094 1 18 . 1 1 53 53 VAL H H 53 8.942 8.942 8.723 0.219 17915 4095 1 18 . 1 1 55 55 ALA N N 55 129.055 129.055 127.725 1.330 17915 4096 1 18 . 1 1 55 55 ALA C C 55 178.565 178.565 178.912 -0.347 17915 4097 1 18 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.648 -0.019 17915 4098 1 18 . 1 1 55 55 ALA H H 55 7.355 7.355 8.631 -1.276 17915 4099 1 18 . 1 1 56 56 ALA N N 56 113.282 113.282 118.962 -5.680 17915 4100 1 18 . 1 1 56 56 ALA C C 56 178.214 178.214 177.937 0.277 17915 4101 1 18 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.982 -1.039 17915 4102 1 18 . 1 1 56 56 ALA H H 56 7.750 7.750 8.132 -0.382 17915 4103 1 18 . 1 1 57 57 TYR N N 57 116.083 116.083 118.339 -2.256 17915 4104 1 18 . 1 1 57 57 TYR C C 57 174.565 174.565 174.099 0.466 17915 4105 1 18 . 1 1 57 57 TYR CA C 57 56.422 56.422 57.490 -1.068 17915 4106 1 18 . 1 1 57 57 TYR H H 57 7.611 7.611 7.998 -0.387 17915 4107 1 18 . 1 1 58 58 VAL N N 58 110.965 110.965 112.810 -1.845 17915 4108 1 18 . 1 1 58 58 VAL C C 58 173.647 173.647 174.271 -0.624 17915 4109 1 18 . 1 1 58 58 VAL CA C 58 58.242 58.242 58.663 -0.421 17915 4110 1 18 . 1 1 58 58 VAL H H 58 7.301 7.301 7.498 -0.197 17915 4111 1 18 . 1 1 59 59 LYS N N 59 118.586 118.586 120.865 -2.279 17915 4112 1 18 . 1 1 59 59 LYS C C 59 176.160 176.160 175.848 0.312 17915 4113 1 18 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.862 -0.821 17915 4114 1 18 . 1 1 59 59 LYS H H 59 8.515 8.515 8.097 0.418 17915 4115 1 18 . 1 1 60 60 LYS N N 60 125.734 125.734 122.142 3.592 17915 4116 1 18 . 1 1 60 60 LYS C C 60 176.793 176.793 176.534 0.259 17915 4117 1 18 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.395 3.222 17915 4118 1 18 . 1 1 60 60 LYS H H 60 9.135 9.135 8.499 0.636 17915 4119 1 18 . 1 1 61 61 LEU N N 61 125.061 125.061 124.847 0.214 17915 4120 1 18 . 1 1 61 61 LEU C C 61 174.106 174.106 175.702 -1.596 17915 4121 1 18 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.484 -0.507 17915 4122 1 18 . 1 1 61 61 LEU H H 61 8.384 8.384 8.839 -0.455 17915 4123 1 19 . 1 1 2 2 ASP N N 2 123.220 123.220 121.571 1.649 17915 4124 1 19 . 1 1 2 2 ASP C C 2 175.703 175.703 174.478 1.225 17915 4125 1 19 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.016 0.025 17915 4126 1 19 . 1 1 2 2 ASP H H 2 8.738 8.738 8.623 0.115 17915 4127 1 19 . 1 1 3 3 GLU N N 3 121.895 121.895 119.567 2.328 17915 4128 1 19 . 1 1 3 3 GLU C C 3 176.480 176.480 175.300 1.180 17915 4129 1 19 . 1 1 3 3 GLU CA C 3 56.128 56.128 55.707 0.421 17915 4130 1 19 . 1 1 3 3 GLU H H 3 8.570 8.570 8.551 0.019 17915 4131 1 19 . 1 1 4 4 THR N N 4 114.607 114.607 114.033 0.574 17915 4132 1 19 . 1 1 4 4 THR C C 4 175.417 175.417 173.580 1.837 17915 4133 1 19 . 1 1 4 4 THR CA C 4 62.685 62.685 61.561 1.124 17915 4134 1 19 . 1 1 4 4 THR H H 4 8.176 8.176 8.471 -0.295 17915 4135 1 19 . 1 1 5 5 GLY N N 5 111.430 111.430 111.568 -0.138 17915 4136 1 19 . 1 1 5 5 GLY C C 5 173.777 173.777 172.885 0.892 17915 4137 1 19 . 1 1 5 5 GLY CA C 5 45.560 45.560 46.127 -0.567 17915 4138 1 19 . 1 1 5 5 GLY H H 5 8.344 8.344 8.114 0.230 17915 4139 1 19 . 1 1 6 6 LYS N N 6 119.850 119.850 124.281 -4.431 17915 4140 1 19 . 1 1 6 6 LYS C C 6 176.049 176.049 176.878 -0.829 17915 4141 1 19 . 1 1 6 6 LYS CA C 6 55.914 55.914 56.700 -0.785 17915 4142 1 19 . 1 1 6 6 LYS H H 6 7.903 7.903 8.320 -0.417 17915 4143 1 19 . 1 1 7 7 GLU N N 7 123.025 123.025 120.654 2.371 17915 4144 1 19 . 1 1 7 7 GLU C C 7 174.172 174.172 174.457 -0.285 17915 4145 1 19 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.747 -2.288 17915 4146 1 19 . 1 1 7 7 GLU H H 7 8.562 8.562 8.817 -0.255 17915 4147 1 19 . 1 1 8 8 LEU N N 8 123.147 123.147 117.336 5.811 17915 4148 1 19 . 1 1 8 8 LEU C C 8 177.495 177.495 174.720 2.775 17915 4149 1 19 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.200 0.225 17915 4150 1 19 . 1 1 8 8 LEU H H 8 8.292 8.292 7.329 0.963 17915 4151 1 19 . 1 1 9 9 VAL N N 9 111.799 111.799 116.700 -4.901 17915 4152 1 19 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.463 -1.569 17915 4153 1 19 . 1 1 9 9 VAL H H 9 9.051 9.051 8.065 0.986 17915 4154 1 19 . 1 1 10 10 LEU N N 10 123.127 123.127 125.932 -2.805 17915 4155 1 19 . 1 1 10 10 LEU C C 10 176.729 176.729 175.697 1.032 17915 4156 1 19 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.976 -0.487 17915 4157 1 19 . 1 1 10 10 LEU H H 10 8.864 8.864 8.697 0.167 17915 4158 1 19 . 1 1 11 11 ALA N N 11 126.907 126.907 129.549 -2.642 17915 4159 1 19 . 1 1 11 11 ALA C C 11 178.406 178.406 176.746 1.660 17915 4160 1 19 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.716 0.799 17915 4161 1 19 . 1 1 11 11 ALA H H 11 8.988 8.988 8.279 0.709 17915 4162 1 19 . 1 1 12 12 LEU N N 12 127.694 127.694 124.608 3.086 17915 4163 1 19 . 1 1 12 12 LEU C C 12 175.046 175.046 176.295 -1.249 17915 4164 1 19 . 1 1 12 12 LEU CA C 12 55.727 55.727 55.589 0.139 17915 4165 1 19 . 1 1 12 12 LEU H H 12 9.136 9.136 8.792 0.344 17915 4166 1 19 . 1 1 13 13 TYR N N 13 111.415 111.415 117.178 -5.763 17915 4167 1 19 . 1 1 13 13 TYR C C 13 173.844 173.844 174.619 -0.775 17915 4168 1 19 . 1 1 13 13 TYR CA C 13 54.656 54.656 57.387 -2.731 17915 4169 1 19 . 1 1 13 13 TYR H H 13 6.979 6.979 7.995 -1.016 17915 4170 1 19 . 1 1 14 14 ASP N N 14 117.591 117.591 122.121 -4.530 17915 4171 1 19 . 1 1 14 14 ASP C C 14 176.140 176.140 175.783 0.357 17915 4172 1 19 . 1 1 14 14 ASP CA C 14 54.522 54.522 56.650 -2.128 17915 4173 1 19 . 1 1 14 14 ASP H H 14 8.260 8.260 8.297 -0.037 17915 4174 1 19 . 1 1 15 15 TYR N N 15 119.917 119.917 115.033 4.884 17915 4175 1 19 . 1 1 15 15 TYR C C 15 172.859 172.859 175.584 -2.725 17915 4176 1 19 . 1 1 15 15 TYR CA C 15 59.661 59.661 59.506 0.155 17915 4177 1 19 . 1 1 15 15 TYR H H 15 8.580 8.580 8.282 0.298 17915 4178 1 19 . 1 1 16 16 GLN N N 16 127.024 127.024 120.813 6.211 17915 4179 1 19 . 1 1 16 16 GLN C C 16 176.377 176.377 174.712 1.665 17915 4180 1 19 . 1 1 16 16 GLN CA C 16 53.666 53.666 55.829 -2.163 17915 4181 1 19 . 1 1 16 16 GLN H H 16 7.450 7.450 8.790 -1.340 17915 4182 1 19 . 1 1 17 17 GLU N N 17 122.837 122.837 125.168 -2.331 17915 4183 1 19 . 1 1 17 17 GLU C C 17 176.140 176.140 176.625 -0.485 17915 4184 1 19 . 1 1 17 17 GLU CA C 17 56.075 56.075 57.839 -1.764 17915 4185 1 19 . 1 1 17 17 GLU H H 17 7.899 7.899 9.214 -1.315 17915 4186 1 19 . 1 1 18 18 LYS N N 18 120.622 120.622 119.684 0.938 17915 4187 1 19 . 1 1 18 18 LYS C C 18 176.267 176.267 174.444 1.823 17915 4188 1 19 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.251 -1.006 17915 4189 1 19 . 1 1 18 18 LYS H H 18 8.649 8.649 8.155 0.494 17915 4190 1 19 . 1 1 19 19 SER N N 19 115.184 115.184 115.891 -0.707 17915 4191 1 19 . 1 1 19 19 SER CA C 19 56.824 56.824 56.851 -0.027 17915 4192 1 19 . 1 1 19 19 SER H H 19 7.552 7.552 7.934 -0.382 17915 4193 1 19 . 1 1 21 21 ARG N N 21 113.440 113.440 118.973 -5.533 17915 4194 1 19 . 1 1 21 21 ARG C C 21 176.638 176.638 176.367 0.271 17915 4195 1 19 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.127 0.081 17915 4196 1 19 . 1 1 21 21 ARG H H 21 7.596 7.596 8.146 -0.550 17915 4197 1 19 . 1 1 22 22 GLU N N 22 121.392 121.392 118.928 2.464 17915 4198 1 19 . 1 1 22 22 GLU C C 22 174.500 174.500 175.390 -0.890 17915 4199 1 19 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.597 -1.245 17915 4200 1 19 . 1 1 22 22 GLU H H 22 7.746 7.746 7.846 -0.100 17915 4201 1 19 . 1 1 23 23 VAL N N 23 114.115 114.115 118.856 -4.741 17915 4202 1 19 . 1 1 23 23 VAL C C 23 172.337 172.337 175.309 -2.972 17915 4203 1 19 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.810 -0.935 17915 4204 1 19 . 1 1 23 23 VAL H H 23 7.318 7.318 8.153 -0.835 17915 4205 1 19 . 1 1 24 24 THR N N 24 118.996 118.996 119.410 -0.414 17915 4206 1 19 . 1 1 24 24 THR C C 24 174.451 174.451 173.526 0.925 17915 4207 1 19 . 1 1 24 24 THR CA C 24 61.641 61.641 60.865 0.776 17915 4208 1 19 . 1 1 24 24 THR H H 24 7.324 7.324 8.287 -0.963 17915 4209 1 19 . 1 1 25 25 MET N N 25 121.901 121.901 124.410 -2.509 17915 4210 1 19 . 1 1 25 25 MET C C 25 173.931 173.931 174.048 -0.117 17915 4211 1 19 . 1 1 25 25 MET CA C 25 54.389 54.389 54.121 0.268 17915 4212 1 19 . 1 1 25 25 MET H H 25 9.432 9.432 8.391 1.041 17915 4213 1 19 . 1 1 26 26 LYS N N 26 124.169 124.169 122.212 1.957 17915 4214 1 19 . 1 1 26 26 LYS C C 26 175.002 175.002 175.847 -0.845 17915 4215 1 19 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.955 -1.288 17915 4216 1 19 . 1 1 26 26 LYS H H 26 8.634 8.634 8.679 -0.045 17915 4217 1 19 . 1 1 27 27 LYS N N 27 122.603 122.603 124.112 -1.509 17915 4218 1 19 . 1 1 27 27 LYS C C 27 177.318 177.318 176.939 0.379 17915 4219 1 19 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.874 0.770 17915 4220 1 19 . 1 1 27 27 LYS H H 27 8.919 8.919 8.659 0.260 17915 4221 1 19 . 1 1 28 28 GLY N N 28 115.585 115.585 113.646 1.939 17915 4222 1 19 . 1 1 28 28 GLY C C 28 174.193 174.193 174.876 -0.683 17915 4223 1 19 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.644 0.244 17915 4224 1 19 . 1 1 28 28 GLY H H 28 8.732 8.732 8.613 0.119 17915 4225 1 19 . 1 1 29 29 ASP N N 29 121.770 121.770 122.738 -0.968 17915 4226 1 19 . 1 1 29 29 ASP C C 29 174.281 174.281 175.783 -1.502 17915 4227 1 19 . 1 1 29 29 ASP CA C 29 55.486 55.486 55.039 0.447 17915 4228 1 19 . 1 1 29 29 ASP H H 29 8.388 8.388 7.708 0.680 17915 4229 1 19 . 1 1 30 30 ILE N N 30 120.469 120.469 115.995 4.474 17915 4230 1 19 . 1 1 30 30 ILE C C 30 176.356 176.356 175.214 1.142 17915 4231 1 19 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.078 0.171 17915 4232 1 19 . 1 1 30 30 ILE H H 30 8.033 8.033 7.965 0.068 17915 4233 1 19 . 1 1 31 31 LEU N N 31 127.129 127.129 127.920 -0.791 17915 4234 1 19 . 1 1 31 31 LEU C C 31 175.745 175.745 176.377 -0.632 17915 4235 1 19 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.720 0.187 17915 4236 1 19 . 1 1 31 31 LEU H H 31 9.223 9.223 8.349 0.874 17915 4237 1 19 . 1 1 32 32 THR N N 32 117.055 117.055 118.200 -1.145 17915 4238 1 19 . 1 1 32 32 THR C C 32 173.844 173.844 174.675 -0.831 17915 4239 1 19 . 1 1 32 32 THR CA C 32 63.247 63.247 61.688 1.560 17915 4240 1 19 . 1 1 32 32 THR H H 32 8.360 8.360 8.446 -0.086 17915 4241 1 19 . 1 1 33 33 LEU N N 33 128.815 128.815 124.042 4.773 17915 4242 1 19 . 1 1 33 33 LEU C C 33 174.718 174.718 175.976 -1.258 17915 4243 1 19 . 1 1 33 33 LEU CA C 33 54.870 54.870 55.092 -0.222 17915 4244 1 19 . 1 1 33 33 LEU H H 33 8.937 8.937 8.506 0.431 17915 4245 1 19 . 1 1 34 34 LEU N N 34 126.230 126.230 125.412 0.818 17915 4246 1 19 . 1 1 34 34 LEU C C 34 177.689 177.689 177.101 0.588 17915 4247 1 19 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.450 -0.232 17915 4248 1 19 . 1 1 34 34 LEU H H 34 8.929 8.929 8.596 0.333 17915 4249 1 19 . 1 1 35 35 ASN N N 35 113.879 113.879 116.135 -2.256 17915 4250 1 19 . 1 1 35 35 ASN C C 35 174.565 174.565 173.171 1.394 17915 4251 1 19 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.658 0.918 17915 4252 1 19 . 1 1 35 35 ASN H H 35 7.489 7.489 7.781 -0.292 17915 4253 1 19 . 1 1 36 36 SER N N 36 123.684 123.684 118.575 5.109 17915 4254 1 19 . 1 1 36 36 SER C C 36 173.503 173.503 174.041 -0.538 17915 4255 1 19 . 1 1 36 36 SER CA C 36 56.904 56.904 57.914 -1.010 17915 4256 1 19 . 1 1 36 36 SER H H 36 9.086 9.086 8.618 0.468 17915 4257 1 19 . 1 1 37 37 THR N N 37 115.012 115.012 117.655 -2.643 17915 4258 1 19 . 1 1 37 37 THR C C 37 175.417 175.417 173.730 1.687 17915 4259 1 19 . 1 1 37 37 THR CA C 37 65.521 65.521 62.848 2.673 17915 4260 1 19 . 1 1 37 37 THR H H 37 8.071 8.071 8.513 -0.442 17915 4261 1 19 . 1 1 38 38 ASN N N 38 122.517 122.517 120.071 2.446 17915 4262 1 19 . 1 1 38 38 ASN C C 38 174.696 174.696 173.845 0.851 17915 4263 1 19 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.086 0.393 17915 4264 1 19 . 1 1 38 38 ASN H H 38 8.595 8.595 7.923 0.672 17915 4265 1 19 . 1 1 39 39 LYS N N 39 120.851 120.851 120.583 0.268 17915 4266 1 19 . 1 1 39 39 LYS C C 39 176.444 176.444 176.047 0.397 17915 4267 1 19 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.012 0.391 17915 4268 1 19 . 1 1 39 39 LYS H H 39 8.416 8.416 8.366 0.050 17915 4269 1 19 . 1 1 40 40 ASP N N 40 114.427 114.427 116.597 -2.170 17915 4270 1 19 . 1 1 40 40 ASP C C 40 176.960 176.960 174.932 2.028 17915 4271 1 19 . 1 1 40 40 ASP CA C 40 55.352 55.352 53.663 1.688 17915 4272 1 19 . 1 1 40 40 ASP H H 40 8.085 8.085 7.975 0.110 17915 4273 1 19 . 1 1 41 41 TRP N N 41 122.708 122.708 119.254 3.454 17915 4274 1 19 . 1 1 41 41 TRP C C 41 174.303 174.303 173.520 0.783 17915 4275 1 19 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.295 -0.087 17915 4276 1 19 . 1 1 41 41 TRP H H 41 8.096 8.096 6.821 1.275 17915 4277 1 19 . 1 1 42 42 TRP N N 42 124.707 124.707 123.102 1.605 17915 4278 1 19 . 1 1 42 42 TRP C C 42 174.303 174.303 174.937 -0.634 17915 4279 1 19 . 1 1 42 42 TRP CA C 42 53.987 53.987 56.553 -2.566 17915 4280 1 19 . 1 1 42 42 TRP H H 42 9.245 9.245 8.127 1.118 17915 4281 1 19 . 1 1 43 43 LYS N N 43 124.005 124.005 122.550 1.455 17915 4282 1 19 . 1 1 43 43 LYS C C 43 175.482 175.482 174.801 0.681 17915 4283 1 19 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.728 -0.349 17915 4284 1 19 . 1 1 43 43 LYS H H 43 8.783 8.783 8.709 0.074 17915 4285 1 19 . 1 1 44 44 VAL N N 44 122.139 122.139 119.691 2.448 17915 4286 1 19 . 1 1 44 44 VAL C C 44 173.472 173.472 173.444 0.028 17915 4287 1 19 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.895 -0.823 17915 4288 1 19 . 1 1 44 44 VAL H H 44 9.287 9.287 8.385 0.902 17915 4289 1 19 . 1 1 45 45 GLU N N 45 118.524 118.524 121.122 -2.598 17915 4290 1 19 . 1 1 45 45 GLU C C 45 174.827 174.827 174.432 0.395 17915 4291 1 19 . 1 1 45 45 GLU CA C 45 54.174 54.174 55.186 -1.012 17915 4292 1 19 . 1 1 45 45 GLU H H 45 8.566 8.566 8.096 0.470 17915 4293 1 19 . 1 1 46 46 VAL N N 46 124.904 124.904 124.508 0.396 17915 4294 1 19 . 1 1 46 46 VAL C C 46 174.608 174.608 175.252 -0.644 17915 4295 1 19 . 1 1 46 46 VAL CA C 46 60.651 60.651 60.120 0.531 17915 4296 1 19 . 1 1 46 46 VAL H H 46 8.774 8.774 7.870 0.904 17915 4297 1 19 . 1 1 47 47 ASN N N 47 126.530 126.530 127.712 -1.182 17915 4298 1 19 . 1 1 47 47 ASN C C 47 174.259 174.259 174.505 -0.246 17915 4299 1 19 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.196 1.049 17915 4300 1 19 . 1 1 47 47 ASN H H 47 9.356 9.356 8.990 0.366 17915 4301 1 19 . 1 1 48 48 ASP N N 48 112.420 112.420 114.406 -1.986 17915 4302 1 19 . 1 1 48 48 ASP C C 48 174.521 174.521 174.506 0.015 17915 4303 1 19 . 1 1 48 48 ASP CA C 48 54.683 54.683 55.029 -0.346 17915 4304 1 19 . 1 1 48 48 ASP H H 48 8.628 8.628 8.449 0.179 17915 4305 1 19 . 1 1 49 49 ARG N N 49 120.379 120.379 118.278 2.101 17915 4306 1 19 . 1 1 49 49 ARG C C 49 174.477 174.477 174.097 0.380 17915 4307 1 19 . 1 1 49 49 ARG CA C 49 55.298 55.298 54.786 0.512 17915 4308 1 19 . 1 1 49 49 ARG H H 49 8.069 8.069 7.744 0.325 17915 4309 1 19 . 1 1 50 50 GLN N N 50 118.647 118.647 120.515 -1.868 17915 4310 1 19 . 1 1 50 50 GLN C C 50 175.963 175.963 175.155 0.808 17915 4311 1 19 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.560 -1.135 17915 4312 1 19 . 1 1 50 50 GLN H H 50 8.432 8.432 8.535 -0.103 17915 4313 1 19 . 1 1 51 51 GLY N N 51 107.028 107.028 109.071 -2.043 17915 4314 1 19 . 1 1 51 51 GLY C C 51 170.479 170.479 172.408 -1.929 17915 4315 1 19 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.583 0.055 17915 4316 1 19 . 1 1 51 51 GLY H H 51 8.534 8.534 8.269 0.265 17915 4317 1 19 . 1 1 52 52 PHE N N 52 119.030 119.030 121.352 -2.322 17915 4318 1 19 . 1 1 52 52 PHE C C 52 175.635 175.635 175.841 -0.206 17915 4319 1 19 . 1 1 52 52 PHE CA C 52 58.724 58.724 58.209 0.515 17915 4320 1 19 . 1 1 52 52 PHE H H 52 9.098 9.098 8.225 0.873 17915 4321 1 19 . 1 1 53 53 VAL N N 53 110.897 110.897 126.605 -15.708 17915 4322 1 19 . 1 1 53 53 VAL CA C 53 58.108 58.108 59.042 -0.934 17915 4323 1 19 . 1 1 53 53 VAL H H 53 8.942 8.942 8.606 0.336 17915 4324 1 19 . 1 1 55 55 ALA N N 55 129.055 129.055 127.988 1.067 17915 4325 1 19 . 1 1 55 55 ALA C C 55 178.565 178.565 178.654 -0.089 17915 4326 1 19 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.733 -0.104 17915 4327 1 19 . 1 1 55 55 ALA H H 55 7.355 7.355 6.859 0.496 17915 4328 1 19 . 1 1 56 56 ALA N N 56 113.282 113.282 118.481 -5.199 17915 4329 1 19 . 1 1 56 56 ALA C C 56 178.214 178.214 177.816 0.398 17915 4330 1 19 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.965 -1.022 17915 4331 1 19 . 1 1 56 56 ALA H H 56 7.750 7.750 8.102 -0.352 17915 4332 1 19 . 1 1 57 57 TYR N N 57 116.083 116.083 117.034 -0.951 17915 4333 1 19 . 1 1 57 57 TYR C C 57 174.565 174.565 173.781 0.784 17915 4334 1 19 . 1 1 57 57 TYR CA C 57 56.422 56.422 58.050 -1.628 17915 4335 1 19 . 1 1 57 57 TYR H H 57 7.611 7.611 7.412 0.199 17915 4336 1 19 . 1 1 58 58 VAL N N 58 110.965 110.965 117.548 -6.583 17915 4337 1 19 . 1 1 58 58 VAL C C 58 173.647 173.647 173.981 -0.334 17915 4338 1 19 . 1 1 58 58 VAL CA C 58 58.242 58.242 60.318 -2.075 17915 4339 1 19 . 1 1 58 58 VAL H H 58 7.301 7.301 7.445 -0.144 17915 4340 1 19 . 1 1 59 59 LYS N N 59 118.586 118.586 126.101 -7.515 17915 4341 1 19 . 1 1 59 59 LYS C C 59 176.160 176.160 175.211 0.949 17915 4342 1 19 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.972 -0.931 17915 4343 1 19 . 1 1 59 59 LYS H H 59 8.515 8.515 8.097 0.418 17915 4344 1 19 . 1 1 60 60 LYS N N 60 125.734 125.734 123.679 2.055 17915 4345 1 19 . 1 1 60 60 LYS C C 60 176.793 176.793 176.461 0.332 17915 4346 1 19 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.354 3.263 17915 4347 1 19 . 1 1 60 60 LYS H H 60 9.135 9.135 8.674 0.461 17915 4348 1 19 . 1 1 61 61 LEU N N 61 125.061 125.061 120.860 4.201 17915 4349 1 19 . 1 1 61 61 LEU C C 61 174.106 174.106 175.085 -0.979 17915 4350 1 19 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.261 -1.284 17915 4351 1 19 . 1 1 61 61 LEU H H 61 8.384 8.384 8.941 -0.557 17915 4352 1 20 . 1 1 2 2 ASP N N 2 123.220 123.220 123.464 -0.244 17915 4353 1 20 . 1 1 2 2 ASP C C 2 175.703 175.703 175.382 0.321 17915 4354 1 20 . 1 1 2 2 ASP CA C 2 54.041 54.041 55.086 -1.045 17915 4355 1 20 . 1 1 2 2 ASP H H 2 8.738 8.738 8.367 0.371 17915 4356 1 20 . 1 1 3 3 GLU N N 3 121.895 121.895 122.273 -0.378 17915 4357 1 20 . 1 1 3 3 GLU C C 3 176.480 176.480 175.330 1.150 17915 4358 1 20 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.203 -0.075 17915 4359 1 20 . 1 1 3 3 GLU H H 3 8.570 8.570 8.570 0.000 17915 4360 1 20 . 1 1 4 4 THR N N 4 114.607 114.607 112.901 1.706 17915 4361 1 20 . 1 1 4 4 THR C C 4 175.417 175.417 173.042 2.375 17915 4362 1 20 . 1 1 4 4 THR CA C 4 62.685 62.685 62.595 0.090 17915 4363 1 20 . 1 1 4 4 THR H H 4 8.176 8.176 7.986 0.190 17915 4364 1 20 . 1 1 5 5 GLY N N 5 111.430 111.430 113.084 -1.654 17915 4365 1 20 . 1 1 5 5 GLY C C 5 173.777 173.777 172.635 1.142 17915 4366 1 20 . 1 1 5 5 GLY CA C 5 45.560 45.560 46.285 -0.725 17915 4367 1 20 . 1 1 5 5 GLY H H 5 8.344 8.344 8.287 0.057 17915 4368 1 20 . 1 1 6 6 LYS N N 6 119.850 119.850 124.228 -4.378 17915 4369 1 20 . 1 1 6 6 LYS C C 6 176.049 176.049 176.990 -0.941 17915 4370 1 20 . 1 1 6 6 LYS CA C 6 55.914 55.914 57.399 -1.485 17915 4371 1 20 . 1 1 6 6 LYS H H 6 7.903 7.903 8.341 -0.438 17915 4372 1 20 . 1 1 7 7 GLU N N 7 123.025 123.025 121.299 1.726 17915 4373 1 20 . 1 1 7 7 GLU C C 7 174.172 174.172 174.720 -0.548 17915 4374 1 20 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.934 -2.475 17915 4375 1 20 . 1 1 7 7 GLU H H 7 8.562 8.562 8.800 -0.238 17915 4376 1 20 . 1 1 8 8 LEU N N 8 123.147 123.147 116.604 6.543 17915 4377 1 20 . 1 1 8 8 LEU C C 8 177.495 177.495 174.791 2.704 17915 4378 1 20 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.404 0.021 17915 4379 1 20 . 1 1 8 8 LEU H H 8 8.292 8.292 7.317 0.975 17915 4380 1 20 . 1 1 9 9 VAL N N 9 111.799 111.799 114.375 -2.576 17915 4381 1 20 . 1 1 9 9 VAL CA C 9 57.894 57.894 58.867 -0.973 17915 4382 1 20 . 1 1 9 9 VAL H H 9 9.051 9.051 8.012 1.039 17915 4383 1 20 . 1 1 10 10 LEU N N 10 123.127 123.127 120.331 2.796 17915 4384 1 20 . 1 1 10 10 LEU C C 10 176.729 176.729 174.927 1.802 17915 4385 1 20 . 1 1 10 10 LEU CA C 10 52.489 52.489 53.529 -1.040 17915 4386 1 20 . 1 1 10 10 LEU H H 10 8.864 8.864 7.673 1.191 17915 4387 1 20 . 1 1 11 11 ALA N N 11 126.907 126.907 125.295 1.612 17915 4388 1 20 . 1 1 11 11 ALA C C 11 178.406 178.406 177.177 1.229 17915 4389 1 20 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.552 0.963 17915 4390 1 20 . 1 1 11 11 ALA H H 11 8.988 8.988 8.224 0.764 17915 4391 1 20 . 1 1 12 12 LEU N N 12 127.694 127.694 125.520 2.174 17915 4392 1 20 . 1 1 12 12 LEU C C 12 175.046 175.046 176.780 -1.734 17915 4393 1 20 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.751 -1.024 17915 4394 1 20 . 1 1 12 12 LEU H H 12 9.136 9.136 8.651 0.485 17915 4395 1 20 . 1 1 13 13 TYR N N 13 111.415 111.415 117.175 -5.760 17915 4396 1 20 . 1 1 13 13 TYR C C 13 173.844 173.844 173.785 0.059 17915 4397 1 20 . 1 1 13 13 TYR CA C 13 54.656 54.656 57.003 -2.347 17915 4398 1 20 . 1 1 13 13 TYR H H 13 6.979 6.979 7.637 -0.658 17915 4399 1 20 . 1 1 14 14 ASP N N 14 117.591 117.591 121.319 -3.728 17915 4400 1 20 . 1 1 14 14 ASP C C 14 176.140 176.140 175.103 1.037 17915 4401 1 20 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.277 -0.755 17915 4402 1 20 . 1 1 14 14 ASP H H 14 8.260 8.260 8.048 0.212 17915 4403 1 20 . 1 1 15 15 TYR N N 15 119.917 119.917 125.337 -5.420 17915 4404 1 20 . 1 1 15 15 TYR C C 15 172.859 172.859 174.281 -1.422 17915 4405 1 20 . 1 1 15 15 TYR CA C 15 59.661 59.661 57.746 1.915 17915 4406 1 20 . 1 1 15 15 TYR H H 15 8.580 8.580 8.287 0.293 17915 4407 1 20 . 1 1 16 16 GLN N N 16 127.024 127.024 116.603 10.421 17915 4408 1 20 . 1 1 16 16 GLN C C 16 176.377 176.377 174.044 2.333 17915 4409 1 20 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.057 -0.391 17915 4410 1 20 . 1 1 16 16 GLN H H 16 7.450 7.450 7.604 -0.154 17915 4411 1 20 . 1 1 17 17 GLU N N 17 122.837 122.837 120.670 2.167 17915 4412 1 20 . 1 1 17 17 GLU C C 17 176.140 176.140 175.877 0.263 17915 4413 1 20 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.607 -0.532 17915 4414 1 20 . 1 1 17 17 GLU H H 17 7.899 7.899 8.744 -0.845 17915 4415 1 20 . 1 1 18 18 LYS N N 18 120.622 120.622 125.751 -5.129 17915 4416 1 20 . 1 1 18 18 LYS C C 18 176.267 176.267 174.831 1.436 17915 4417 1 20 . 1 1 18 18 LYS CA C 18 55.245 55.245 55.876 -0.631 17915 4418 1 20 . 1 1 18 18 LYS H H 18 8.649 8.649 8.935 -0.286 17915 4419 1 20 . 1 1 19 19 SER N N 19 115.184 115.184 112.408 2.776 17915 4420 1 20 . 1 1 19 19 SER CA C 19 56.824 56.824 56.759 0.065 17915 4421 1 20 . 1 1 19 19 SER H H 19 7.552 7.552 7.506 0.046 17915 4422 1 20 . 1 1 21 21 ARG N N 21 113.440 113.440 117.077 -3.637 17915 4423 1 20 . 1 1 21 21 ARG C C 21 176.638 176.638 175.704 0.934 17915 4424 1 20 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.286 -0.078 17915 4425 1 20 . 1 1 21 21 ARG H H 21 7.596 7.596 8.589 -0.993 17915 4426 1 20 . 1 1 22 22 GLU N N 22 121.392 121.392 117.058 4.334 17915 4427 1 20 . 1 1 22 22 GLU C C 22 174.500 174.500 174.841 -0.341 17915 4428 1 20 . 1 1 22 22 GLU CA C 22 55.352 55.352 55.343 0.009 17915 4429 1 20 . 1 1 22 22 GLU H H 22 7.746 7.746 7.573 0.173 17915 4430 1 20 . 1 1 23 23 VAL N N 23 114.115 114.115 118.427 -4.312 17915 4431 1 20 . 1 1 23 23 VAL C C 23 172.337 172.337 174.525 -2.188 17915 4432 1 20 . 1 1 23 23 VAL CA C 23 59.875 59.875 59.857 0.018 17915 4433 1 20 . 1 1 23 23 VAL H H 23 7.318 7.318 8.131 -0.813 17915 4434 1 20 . 1 1 24 24 THR N N 24 118.996 118.996 119.929 -0.933 17915 4435 1 20 . 1 1 24 24 THR C C 24 174.451 174.451 174.278 0.173 17915 4436 1 20 . 1 1 24 24 THR CA C 24 61.641 61.641 61.632 0.009 17915 4437 1 20 . 1 1 24 24 THR H H 24 7.324 7.324 8.322 -0.998 17915 4438 1 20 . 1 1 25 25 MET N N 25 121.901 121.901 126.101 -4.200 17915 4439 1 20 . 1 1 25 25 MET C C 25 173.931 173.931 174.801 -0.870 17915 4440 1 20 . 1 1 25 25 MET CA C 25 54.389 54.389 53.979 0.410 17915 4441 1 20 . 1 1 25 25 MET H H 25 9.432 9.432 8.419 1.013 17915 4442 1 20 . 1 1 26 26 LYS N N 26 124.169 124.169 121.451 2.718 17915 4443 1 20 . 1 1 26 26 LYS C C 26 175.002 175.002 176.422 -1.420 17915 4444 1 20 . 1 1 26 26 LYS CA C 26 53.666 53.666 55.043 -1.377 17915 4445 1 20 . 1 1 26 26 LYS H H 26 8.634 8.634 8.640 -0.006 17915 4446 1 20 . 1 1 27 27 LYS N N 27 122.603 122.603 122.331 0.272 17915 4447 1 20 . 1 1 27 27 LYS C C 27 177.318 177.318 177.485 -0.167 17915 4448 1 20 . 1 1 27 27 LYS CA C 27 58.644 58.644 57.674 0.970 17915 4449 1 20 . 1 1 27 27 LYS H H 27 8.919 8.919 8.579 0.340 17915 4450 1 20 . 1 1 28 28 GLY N N 28 115.585 115.585 112.716 2.869 17915 4451 1 20 . 1 1 28 28 GLY C C 28 174.193 174.193 174.649 -0.456 17915 4452 1 20 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.838 0.050 17915 4453 1 20 . 1 1 28 28 GLY H H 28 8.732 8.732 8.648 0.084 17915 4454 1 20 . 1 1 29 29 ASP N N 29 121.770 121.770 122.671 -0.901 17915 4455 1 20 . 1 1 29 29 ASP C C 29 174.281 174.281 175.224 -0.943 17915 4456 1 20 . 1 1 29 29 ASP CA C 29 55.486 55.486 55.003 0.483 17915 4457 1 20 . 1 1 29 29 ASP H H 29 8.388 8.388 7.897 0.491 17915 4458 1 20 . 1 1 30 30 ILE N N 30 120.469 120.469 123.949 -3.480 17915 4459 1 20 . 1 1 30 30 ILE C C 30 176.356 176.356 174.907 1.449 17915 4460 1 20 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.457 -0.208 17915 4461 1 20 . 1 1 30 30 ILE H H 30 8.033 8.033 8.160 -0.127 17915 4462 1 20 . 1 1 31 31 LEU N N 31 127.129 127.129 126.350 0.779 17915 4463 1 20 . 1 1 31 31 LEU C C 31 175.745 175.745 176.068 -0.323 17915 4464 1 20 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.242 0.665 17915 4465 1 20 . 1 1 31 31 LEU H H 31 9.223 9.223 8.615 0.608 17915 4466 1 20 . 1 1 32 32 THR N N 32 117.055 117.055 118.944 -1.889 17915 4467 1 20 . 1 1 32 32 THR C C 32 173.844 173.844 174.031 -0.187 17915 4468 1 20 . 1 1 32 32 THR CA C 32 63.247 63.247 62.553 0.694 17915 4469 1 20 . 1 1 32 32 THR H H 32 8.360 8.360 8.702 -0.342 17915 4470 1 20 . 1 1 33 33 LEU N N 33 128.815 128.815 127.792 1.023 17915 4471 1 20 . 1 1 33 33 LEU C C 33 174.718 174.718 176.554 -1.836 17915 4472 1 20 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.186 0.684 17915 4473 1 20 . 1 1 33 33 LEU H H 33 8.937 8.937 8.589 0.348 17915 4474 1 20 . 1 1 34 34 LEU N N 34 126.230 126.230 126.521 -0.291 17915 4475 1 20 . 1 1 34 34 LEU C C 34 177.689 177.689 176.247 1.442 17915 4476 1 20 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.375 -0.157 17915 4477 1 20 . 1 1 34 34 LEU H H 34 8.929 8.929 8.623 0.306 17915 4478 1 20 . 1 1 35 35 ASN N N 35 113.879 113.879 116.143 -2.264 17915 4479 1 20 . 1 1 35 35 ASN C C 35 174.565 174.565 172.878 1.687 17915 4480 1 20 . 1 1 35 35 ASN CA C 35 54.576 54.576 54.136 0.439 17915 4481 1 20 . 1 1 35 35 ASN H H 35 7.489 7.489 7.585 -0.096 17915 4482 1 20 . 1 1 36 36 SER N N 36 123.684 123.684 118.492 5.192 17915 4483 1 20 . 1 1 36 36 SER C C 36 173.503 173.503 173.701 -0.198 17915 4484 1 20 . 1 1 36 36 SER CA C 36 56.904 56.904 57.951 -1.047 17915 4485 1 20 . 1 1 36 36 SER H H 36 9.086 9.086 8.566 0.520 17915 4486 1 20 . 1 1 37 37 THR N N 37 115.012 115.012 118.020 -3.008 17915 4487 1 20 . 1 1 37 37 THR C C 37 175.417 175.417 172.992 2.425 17915 4488 1 20 . 1 1 37 37 THR CA C 37 65.521 65.521 62.772 2.749 17915 4489 1 20 . 1 1 37 37 THR H H 37 8.071 8.071 8.598 -0.527 17915 4490 1 20 . 1 1 38 38 ASN N N 38 122.517 122.517 119.289 3.228 17915 4491 1 20 . 1 1 38 38 ASN C C 38 174.696 174.696 174.435 0.261 17915 4492 1 20 . 1 1 38 38 ASN CA C 38 53.479 53.479 53.041 0.438 17915 4493 1 20 . 1 1 38 38 ASN H H 38 8.595 8.595 8.078 0.517 17915 4494 1 20 . 1 1 39 39 LYS N N 39 120.851 120.851 120.699 0.152 17915 4495 1 20 . 1 1 39 39 LYS C C 39 176.444 176.444 177.237 -0.793 17915 4496 1 20 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.294 0.109 17915 4497 1 20 . 1 1 39 39 LYS H H 39 8.416 8.416 8.474 -0.058 17915 4498 1 20 . 1 1 40 40 ASP N N 40 114.427 114.427 118.366 -3.939 17915 4499 1 20 . 1 1 40 40 ASP C C 40 176.960 176.960 175.251 1.709 17915 4500 1 20 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.216 0.136 17915 4501 1 20 . 1 1 40 40 ASP H H 40 8.085 8.085 8.475 -0.390 17915 4502 1 20 . 1 1 41 41 TRP N N 41 122.708 122.708 120.298 2.410 17915 4503 1 20 . 1 1 41 41 TRP C C 41 174.303 174.303 174.542 -0.239 17915 4504 1 20 . 1 1 41 41 TRP CA C 41 56.208 56.208 55.841 0.367 17915 4505 1 20 . 1 1 41 41 TRP H H 41 8.096 8.096 7.363 0.733 17915 4506 1 20 . 1 1 42 42 TRP N N 42 124.707 124.707 124.127 0.580 17915 4507 1 20 . 1 1 42 42 TRP C C 42 174.303 174.303 175.146 -0.843 17915 4508 1 20 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.565 -1.578 17915 4509 1 20 . 1 1 42 42 TRP H H 42 9.245 9.245 7.009 2.236 17915 4510 1 20 . 1 1 43 43 LYS N N 43 124.005 124.005 123.166 0.839 17915 4511 1 20 . 1 1 43 43 LYS C C 43 175.482 175.482 174.520 0.962 17915 4512 1 20 . 1 1 43 43 LYS CA C 43 55.379 55.379 56.041 -0.662 17915 4513 1 20 . 1 1 43 43 LYS H H 43 8.783 8.783 8.991 -0.208 17915 4514 1 20 . 1 1 44 44 VAL N N 44 122.139 122.139 122.811 -0.672 17915 4515 1 20 . 1 1 44 44 VAL C C 44 173.472 173.472 173.137 0.335 17915 4516 1 20 . 1 1 44 44 VAL CA C 44 59.072 59.072 60.556 -1.484 17915 4517 1 20 . 1 1 44 44 VAL H H 44 9.287 9.287 8.599 0.688 17915 4518 1 20 . 1 1 45 45 GLU N N 45 118.524 118.524 125.838 -7.314 17915 4519 1 20 . 1 1 45 45 GLU C C 45 174.827 174.827 175.367 -0.540 17915 4520 1 20 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.738 -0.564 17915 4521 1 20 . 1 1 45 45 GLU H H 45 8.566 8.566 8.147 0.419 17915 4522 1 20 . 1 1 46 46 VAL N N 46 124.904 124.904 126.981 -2.077 17915 4523 1 20 . 1 1 46 46 VAL C C 46 174.608 174.608 175.021 -0.413 17915 4524 1 20 . 1 1 46 46 VAL CA C 46 60.651 60.651 61.462 -0.811 17915 4525 1 20 . 1 1 46 46 VAL H H 46 8.774 8.774 8.722 0.052 17915 4526 1 20 . 1 1 47 47 ASN N N 47 126.530 126.530 126.091 0.439 17915 4527 1 20 . 1 1 47 47 ASN C C 47 174.259 174.259 174.873 -0.614 17915 4528 1 20 . 1 1 47 47 ASN CA C 47 55.245 55.245 55.787 -0.542 17915 4529 1 20 . 1 1 47 47 ASN H H 47 9.356 9.356 8.948 0.408 17915 4530 1 20 . 1 1 48 48 ASP N N 48 112.420 112.420 119.681 -7.261 17915 4531 1 20 . 1 1 48 48 ASP C C 48 174.521 174.521 174.710 -0.189 17915 4532 1 20 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.240 0.443 17915 4533 1 20 . 1 1 48 48 ASP H H 48 8.628 8.628 8.264 0.364 17915 4534 1 20 . 1 1 49 49 ARG N N 49 120.379 120.379 119.922 0.457 17915 4535 1 20 . 1 1 49 49 ARG C C 49 174.477 174.477 173.999 0.478 17915 4536 1 20 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.404 -0.106 17915 4537 1 20 . 1 1 49 49 ARG H H 49 8.069 8.069 7.748 0.321 17915 4538 1 20 . 1 1 50 50 GLN N N 50 118.647 118.647 118.993 -0.346 17915 4539 1 20 . 1 1 50 50 GLN C C 50 175.963 175.963 175.073 0.890 17915 4540 1 20 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.825 -1.400 17915 4541 1 20 . 1 1 50 50 GLN H H 50 8.432 8.432 8.657 -0.225 17915 4542 1 20 . 1 1 51 51 GLY N N 51 107.028 107.028 108.801 -1.773 17915 4543 1 20 . 1 1 51 51 GLY C C 51 170.479 170.479 173.946 -3.467 17915 4544 1 20 . 1 1 51 51 GLY CA C 51 45.638 45.638 44.881 0.757 17915 4545 1 20 . 1 1 51 51 GLY H H 51 8.534 8.534 8.250 0.284 17915 4546 1 20 . 1 1 52 52 PHE N N 52 119.030 119.030 112.518 6.512 17915 4547 1 20 . 1 1 52 52 PHE C C 52 175.635 175.635 174.240 1.395 17915 4548 1 20 . 1 1 52 52 PHE CA C 52 58.724 58.724 58.597 0.127 17915 4549 1 20 . 1 1 52 52 PHE H H 52 9.098 9.098 6.729 2.369 17915 4550 1 20 . 1 1 53 53 VAL N N 53 110.897 110.897 117.615 -6.718 17915 4551 1 20 . 1 1 53 53 VAL CA C 53 58.108 58.108 59.236 -1.128 17915 4552 1 20 . 1 1 53 53 VAL H H 53 8.942 8.942 6.823 2.119 17915 4553 1 20 . 1 1 55 55 ALA N N 55 129.055 129.055 129.344 -0.289 17915 4554 1 20 . 1 1 55 55 ALA C C 55 178.565 178.565 178.847 -0.282 17915 4555 1 20 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.935 -0.306 17915 4556 1 20 . 1 1 55 55 ALA H H 55 7.355 7.355 8.678 -1.323 17915 4557 1 20 . 1 1 56 56 ALA N N 56 113.282 113.282 119.047 -5.765 17915 4558 1 20 . 1 1 56 56 ALA C C 56 178.214 178.214 177.801 0.413 17915 4559 1 20 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.903 -0.960 17915 4560 1 20 . 1 1 56 56 ALA H H 56 7.750 7.750 8.339 -0.589 17915 4561 1 20 . 1 1 57 57 TYR N N 57 116.083 116.083 117.518 -1.435 17915 4562 1 20 . 1 1 57 57 TYR C C 57 174.565 174.565 174.236 0.329 17915 4563 1 20 . 1 1 57 57 TYR CA C 57 56.422 56.422 58.335 -1.913 17915 4564 1 20 . 1 1 57 57 TYR H H 57 7.611 7.611 7.644 -0.033 17915 4565 1 20 . 1 1 58 58 VAL N N 58 110.965 110.965 111.175 -0.210 17915 4566 1 20 . 1 1 58 58 VAL C C 58 173.647 173.647 174.755 -1.108 17915 4567 1 20 . 1 1 58 58 VAL CA C 58 58.242 58.242 58.731 -0.489 17915 4568 1 20 . 1 1 58 58 VAL H H 58 7.301 7.301 7.095 0.206 17915 4569 1 20 . 1 1 59 59 LYS N N 59 118.586 118.586 121.168 -2.582 17915 4570 1 20 . 1 1 59 59 LYS C C 59 176.160 176.160 175.580 0.580 17915 4571 1 20 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.773 -0.732 17915 4572 1 20 . 1 1 59 59 LYS H H 59 8.515 8.515 7.812 0.703 17915 4573 1 20 . 1 1 60 60 LYS N N 60 125.734 125.734 125.999 -0.265 17915 4574 1 20 . 1 1 60 60 LYS C C 60 176.793 176.793 177.083 -0.290 17915 4575 1 20 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.555 3.062 17915 4576 1 20 . 1 1 60 60 LYS H H 60 9.135 9.135 8.639 0.496 17915 4577 1 20 . 1 1 61 61 LEU N N 61 125.061 125.061 124.009 1.052 17915 4578 1 20 . 1 1 61 61 LEU C C 61 174.106 174.106 175.002 -0.896 17915 4579 1 20 . 1 1 61 61 LEU CA C 61 54.977 54.977 56.125 -1.148 17915 4580 1 20 . 1 1 61 61 LEU H H 61 8.384 8.384 8.776 -0.392 17915 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 58 3.699 0.740 3.656 17915 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 17915 3 1 1 "Average Difference" C 55 1.116 -0.062 1.124 17915 4 1 1 "Average Difference" CA 58 1.321 0.085 1.330 17915 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17915 6 1 1 "Average Difference" HN 58 0.541 -0.128 0.530 17915 7 1 2 "Average Difference" N 58 3.893 0.071 3.926 17915 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 17915 9 1 2 "Average Difference" C 55 1.124 -0.151 1.124 17915 10 1 2 "Average Difference" CA 58 1.133 0.114 1.137 17915 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17915 12 1 2 "Average Difference" HN 58 0.579 -0.143 0.566 17915 13 1 3 "Average Difference" N 58 3.592 0.223 3.616 17915 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 17915 15 1 3 "Average Difference" C 55 1.076 -0.166 1.073 17915 16 1 3 "Average Difference" CA 58 1.184 -0.012 1.194 17915 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17915 18 1 3 "Average Difference" HN 58 0.530 -0.120 0.520 17915 19 1 4 "Average Difference" N 58 3.310 0.324 3.323 17915 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 17915 21 1 4 "Average Difference" C 55 1.183 -0.003 1.194 17915 22 1 4 "Average Difference" CA 58 1.353 0.336 1.323 17915 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17915 24 1 4 "Average Difference" HN 58 0.535 -0.124 0.525 17915 25 1 5 "Average Difference" N 58 3.045 0.120 3.070 17915 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 17915 27 1 5 "Average Difference" C 55 0.995 -0.095 0.999 17915 28 1 5 "Average Difference" CA 58 1.536 0.081 1.547 17915 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17915 30 1 5 "Average Difference" HN 58 0.552 -0.135 0.540 17915 31 1 6 "Average Difference" N 58 4.041 -0.244 4.069 17915 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 17915 33 1 6 "Average Difference" C 55 1.230 -0.107 1.236 17915 34 1 6 "Average Difference" CA 58 1.117 0.175 1.113 17915 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17915 36 1 6 "Average Difference" HN 58 0.549 -0.163 0.529 17915 37 1 7 "Average Difference" N 58 3.774 0.071 3.806 17915 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 17915 39 1 7 "Average Difference" C 55 1.218 -0.067 1.227 17915 40 1 7 "Average Difference" CA 58 1.183 0.171 1.181 17915 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17915 42 1 7 "Average Difference" HN 58 0.564 -0.110 0.558 17915 43 1 8 "Average Difference" N 58 3.750 0.875 3.679 17915 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 17915 45 1 8 "Average Difference" C 55 1.055 -0.176 1.050 17915 46 1 8 "Average Difference" CA 58 1.131 0.157 1.130 17915 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17915 48 1 8 "Average Difference" HN 58 0.562 -0.129 0.551 17915 49 1 9 "Average Difference" N 58 3.867 -0.017 3.901 17915 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 17915 51 1 9 "Average Difference" C 55 1.180 -0.036 1.190 17915 52 1 9 "Average Difference" CA 58 1.245 0.067 1.254 17915 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17915 54 1 9 "Average Difference" HN 58 0.556 -0.120 0.547 17915 55 1 10 "Average Difference" N 58 3.951 0.767 3.910 17915 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 17915 57 1 10 "Average Difference" C 55 1.095 -0.227 1.081 17915 58 1 10 "Average Difference" CA 58 1.151 0.257 1.131 17915 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17915 60 1 10 "Average Difference" HN 58 0.620 -0.150 0.607 17915 61 1 11 "Average Difference" N 58 3.725 0.213 3.751 17915 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 17915 63 1 11 "Average Difference" C 55 1.108 -0.103 1.113 17915 64 1 11 "Average Difference" CA 58 1.307 0.196 1.303 17915 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17915 66 1 11 "Average Difference" HN 58 0.563 -0.105 0.558 17915 67 1 12 "Average Difference" N 58 3.867 0.450 3.874 17915 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 17915 69 1 12 "Average Difference" C 55 1.028 -0.072 1.035 17915 70 1 12 "Average Difference" CA 58 1.306 0.305 1.281 17915 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17915 72 1 12 "Average Difference" HN 58 0.542 -0.143 0.527 17915 73 1 13 "Average Difference" N 58 3.730 -0.050 3.762 17915 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 17915 75 1 13 "Average Difference" C 55 1.105 -0.224 1.092 17915 76 1 13 "Average Difference" CA 58 1.154 0.100 1.159 17915 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17915 78 1 13 "Average Difference" HN 58 0.593 -0.158 0.576 17915 79 1 14 "Average Difference" N 58 3.877 0.548 3.871 17915 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 17915 81 1 14 "Average Difference" C 55 1.135 -0.178 1.131 17915 82 1 14 "Average Difference" CA 58 1.256 -0.010 1.267 17915 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17915 84 1 14 "Average Difference" HN 58 0.576 -0.177 0.553 17915 85 1 15 "Average Difference" N 58 3.478 0.001 3.508 17915 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 17915 87 1 15 "Average Difference" C 55 1.088 -0.123 1.091 17915 88 1 15 "Average Difference" CA 58 1.368 0.215 1.362 17915 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17915 90 1 15 "Average Difference" HN 58 0.538 -0.107 0.532 17915 91 1 16 "Average Difference" N 58 3.570 0.364 3.583 17915 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 17915 93 1 16 "Average Difference" C 55 1.174 -0.155 1.174 17915 94 1 16 "Average Difference" CA 58 1.113 0.257 1.093 17915 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 17915 96 1 16 "Average Difference" HN 58 0.553 -0.130 0.542 17915 97 1 17 "Average Difference" N 58 4.020 -0.035 4.055 17915 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 17915 99 1 17 "Average Difference" C 55 1.102 -0.172 1.099 17915 100 1 17 "Average Difference" CA 58 1.254 0.189 1.251 17915 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 17915 102 1 17 "Average Difference" HN 58 0.557 -0.173 0.534 17915 103 1 18 "Average Difference" N 58 3.959 -0.049 3.993 17915 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 17915 105 1 18 "Average Difference" C 55 1.064 0.047 1.072 17915 106 1 18 "Average Difference" CA 58 1.127 0.219 1.115 17915 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 17915 108 1 18 "Average Difference" HN 58 0.604 -0.129 0.595 17915 109 1 19 "Average Difference" N 58 3.850 0.517 3.848 17915 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 17915 111 1 19 "Average Difference" C 55 1.156 -0.145 1.157 17915 112 1 19 "Average Difference" CA 58 1.218 0.265 1.199 17915 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 17915 114 1 19 "Average Difference" HN 58 0.597 -0.148 0.583 17915 115 1 20 "Average Difference" N 58 3.569 0.518 3.562 17915 116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 17915 117 1 20 "Average Difference" C 55 1.247 -0.147 1.250 17915 118 1 20 "Average Difference" CA 58 1.059 0.250 1.038 17915 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 17915 120 1 20 "Average Difference" HN 58 0.740 -0.201 0.718 17915 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 17915 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 ASP N N 2 123.220 123.220 121.766 1.454 17915 2 1 . 1 1 2 2 ASP C C 2 175.703 175.703 175.298 0.405 17915 3 1 . 1 1 2 2 ASP CA C 2 54.041 54.041 54.555 -0.514 17915 4 1 . 1 1 2 2 ASP H H 2 8.738 8.738 8.423 0.315 17915 5 1 . 1 1 3 3 GLU N N 3 121.895 121.895 119.498 2.397 17915 6 1 . 1 1 3 3 GLU C C 3 176.480 176.480 175.043 1.437 17915 7 1 . 1 1 3 3 GLU CA C 3 56.128 56.128 56.623 -0.495 17915 8 1 . 1 1 3 3 GLU H H 3 8.570 8.570 8.518 0.052 17915 9 1 . 1 1 4 4 THR N N 4 114.607 114.607 113.870 0.737 17915 10 1 . 1 1 4 4 THR C C 4 175.417 175.417 173.726 1.691 17915 11 1 . 1 1 4 4 THR CA C 4 62.685 62.685 62.201 0.484 17915 12 1 . 1 1 4 4 THR H H 4 8.176 8.176 8.160 0.016 17915 13 1 . 1 1 5 5 GLY N N 5 111.430 111.430 111.172 0.258 17915 14 1 . 1 1 5 5 GLY C C 5 173.777 173.777 172.868 0.908 17915 15 1 . 1 1 5 5 GLY CA C 5 45.560 45.560 45.631 -0.071 17915 16 1 . 1 1 5 5 GLY H H 5 8.344 8.344 8.073 0.271 17915 17 1 . 1 1 6 6 LYS N N 6 119.850 119.850 123.419 -3.569 17915 18 1 . 1 1 6 6 LYS C C 6 176.049 176.049 176.371 -0.322 17915 19 1 . 1 1 6 6 LYS CA C 6 55.914 55.914 56.372 -0.458 17915 20 1 . 1 1 6 6 LYS H H 6 7.903 7.903 8.059 -0.156 17915 21 1 . 1 1 7 7 GLU N N 7 123.025 123.025 121.348 1.677 17915 22 1 . 1 1 7 7 GLU C C 7 174.172 174.172 174.679 -0.507 17915 23 1 . 1 1 7 7 GLU CA C 7 55.459 55.459 57.311 -1.852 17915 24 1 . 1 1 7 7 GLU H H 7 8.562 8.562 8.778 -0.216 17915 25 1 . 1 1 8 8 LEU N N 8 123.147 123.147 117.972 5.175 17915 26 1 . 1 1 8 8 LEU C C 8 177.495 177.495 174.812 2.683 17915 27 1 . 1 1 8 8 LEU CA C 8 53.425 53.425 53.719 -0.294 17915 28 1 . 1 1 8 8 LEU H H 8 8.292 8.292 7.525 0.767 17915 29 1 . 1 1 9 9 VAL N N 9 111.799 111.799 116.963 -5.164 17915 30 1 . 1 1 9 9 VAL CA C 9 57.894 57.894 59.949 -2.055 17915 31 1 . 1 1 9 9 VAL H H 9 9.051 9.051 8.203 0.848 17915 32 1 . 1 1 10 10 LEU N N 10 123.127 123.127 125.378 -2.251 17915 33 1 . 1 1 10 10 LEU C C 10 176.729 176.729 175.368 1.361 17915 34 1 . 1 1 10 10 LEU CA C 10 52.489 52.489 52.966 -0.477 17915 35 1 . 1 1 10 10 LEU H H 10 8.864 8.864 8.389 0.475 17915 36 1 . 1 1 11 11 ALA N N 11 126.907 126.907 125.343 1.564 17915 37 1 . 1 1 11 11 ALA C C 11 178.406 178.406 177.027 1.379 17915 38 1 . 1 1 11 11 ALA CA C 11 52.515 52.515 51.701 0.814 17915 39 1 . 1 1 11 11 ALA H H 11 8.988 8.988 8.529 0.459 17915 40 1 . 1 1 12 12 LEU N N 12 127.694 127.694 125.779 1.915 17915 41 1 . 1 1 12 12 LEU C C 12 175.046 175.046 176.148 -1.102 17915 42 1 . 1 1 12 12 LEU CA C 12 55.727 55.727 56.243 -0.516 17915 43 1 . 1 1 12 12 LEU H H 12 9.136 9.136 8.695 0.441 17915 44 1 . 1 1 13 13 TYR N N 13 111.415 111.415 115.967 -4.552 17915 45 1 . 1 1 13 13 TYR C C 13 173.844 173.844 174.053 -0.209 17915 46 1 . 1 1 13 13 TYR CA C 13 54.656 54.656 56.806 -2.150 17915 47 1 . 1 1 13 13 TYR H H 13 6.979 6.979 7.693 -0.714 17915 48 1 . 1 1 14 14 ASP N N 14 117.591 117.591 122.209 -4.618 17915 49 1 . 1 1 14 14 ASP C C 14 176.140 176.140 175.095 1.045 17915 50 1 . 1 1 14 14 ASP CA C 14 54.522 54.522 55.527 -1.005 17915 51 1 . 1 1 14 14 ASP H H 14 8.260 8.260 8.221 0.039 17915 52 1 . 1 1 15 15 TYR N N 15 119.917 119.917 120.220 -0.303 17915 53 1 . 1 1 15 15 TYR C C 15 172.859 172.859 174.284 -1.425 17915 54 1 . 1 1 15 15 TYR CA C 15 59.661 59.661 58.003 1.658 17915 55 1 . 1 1 15 15 TYR H H 15 8.580 8.580 8.331 0.249 17915 56 1 . 1 1 16 16 GLN N N 16 127.024 127.024 119.215 7.809 17915 57 1 . 1 1 16 16 GLN C C 16 176.377 176.377 174.660 1.717 17915 58 1 . 1 1 16 16 GLN CA C 16 53.666 53.666 54.996 -1.330 17915 59 1 . 1 1 16 16 GLN H H 16 7.450 7.450 8.155 -0.705 17915 60 1 . 1 1 17 17 GLU N N 17 122.837 122.837 123.048 -0.211 17915 61 1 . 1 1 17 17 GLU C C 17 176.140 176.140 175.978 0.162 17915 62 1 . 1 1 17 17 GLU CA C 17 56.075 56.075 56.664 -0.589 17915 63 1 . 1 1 17 17 GLU H H 17 7.899 7.899 8.734 -0.835 17915 64 1 . 1 1 18 18 LYS N N 18 120.622 120.622 121.540 -0.918 17915 65 1 . 1 1 18 18 LYS C C 18 176.267 176.267 175.295 0.972 17915 66 1 . 1 1 18 18 LYS CA C 18 55.245 55.245 56.503 -1.258 17915 67 1 . 1 1 18 18 LYS H H 18 8.649 8.649 8.418 0.231 17915 68 1 . 1 1 19 19 SER N N 19 115.184 115.184 113.915 1.269 17915 69 1 . 1 1 19 19 SER CA C 19 56.824 56.824 56.312 0.512 17915 70 1 . 1 1 19 19 SER H H 19 7.552 7.552 7.769 -0.217 17915 71 1 . 1 1 21 21 ARG N N 21 113.440 113.440 117.504 -4.064 17915 72 1 . 1 1 21 21 ARG C C 21 176.638 176.638 176.163 0.475 17915 73 1 . 1 1 21 21 ARG CA C 21 56.208 56.208 56.377 -0.169 17915 74 1 . 1 1 21 21 ARG H H 21 7.596 7.596 8.136 -0.540 17915 75 1 . 1 1 22 22 GLU N N 22 121.392 121.392 117.636 3.756 17915 76 1 . 1 1 22 22 GLU C C 22 174.500 174.500 175.102 -0.602 17915 77 1 . 1 1 22 22 GLU CA C 22 55.352 55.352 56.376 -1.024 17915 78 1 . 1 1 22 22 GLU H H 22 7.746 7.746 7.694 0.052 17915 79 1 . 1 1 23 23 VAL N N 23 114.115 114.115 116.876 -2.761 17915 80 1 . 1 1 23 23 VAL C C 23 172.337 172.337 174.487 -2.150 17915 81 1 . 1 1 23 23 VAL CA C 23 59.875 59.875 60.345 -0.470 17915 82 1 . 1 1 23 23 VAL H H 23 7.318 7.318 8.203 -0.885 17915 83 1 . 1 1 24 24 THR N N 24 118.996 118.996 118.559 0.437 17915 84 1 . 1 1 24 24 THR C C 24 174.451 174.451 173.601 0.850 17915 85 1 . 1 1 24 24 THR CA C 24 61.641 61.641 61.287 0.354 17915 86 1 . 1 1 24 24 THR H H 24 7.324 7.324 8.299 -0.975 17915 87 1 . 1 1 25 25 MET N N 25 121.901 121.901 124.216 -2.315 17915 88 1 . 1 1 25 25 MET C C 25 173.931 173.931 174.281 -0.350 17915 89 1 . 1 1 25 25 MET CA C 25 54.389 54.389 54.226 0.162 17915 90 1 . 1 1 25 25 MET H H 25 9.432 9.432 8.381 1.051 17915 91 1 . 1 1 26 26 LYS N N 26 124.169 124.169 122.071 2.098 17915 92 1 . 1 1 26 26 LYS C C 26 175.002 175.002 176.051 -1.049 17915 93 1 . 1 1 26 26 LYS CA C 26 53.666 53.666 54.974 -1.308 17915 94 1 . 1 1 26 26 LYS H H 26 8.634 8.634 8.587 0.047 17915 95 1 . 1 1 27 27 LYS N N 27 122.603 122.603 124.434 -1.831 17915 96 1 . 1 1 27 27 LYS C C 27 177.318 177.318 177.283 0.035 17915 97 1 . 1 1 27 27 LYS CA C 27 58.644 58.644 58.039 0.605 17915 98 1 . 1 1 27 27 LYS H H 27 8.919 8.919 8.816 0.103 17915 99 1 . 1 1 28 28 GLY N N 28 115.585 115.585 113.887 1.698 17915 100 1 . 1 1 28 28 GLY C C 28 174.193 174.193 174.582 -0.389 17915 101 1 . 1 1 28 28 GLY CA C 28 44.888 44.888 44.893 -0.005 17915 102 1 . 1 1 28 28 GLY H H 28 8.732 8.732 8.751 -0.019 17915 103 1 . 1 1 29 29 ASP N N 29 121.770 121.770 122.278 -0.508 17915 104 1 . 1 1 29 29 ASP C C 29 174.281 174.281 175.511 -1.230 17915 105 1 . 1 1 29 29 ASP CA C 29 55.486 55.486 54.549 0.937 17915 106 1 . 1 1 29 29 ASP H H 29 8.388 8.388 7.912 0.476 17915 107 1 . 1 1 30 30 ILE N N 30 120.469 120.469 117.841 2.628 17915 108 1 . 1 1 30 30 ILE C C 30 176.356 176.356 174.989 1.367 17915 109 1 . 1 1 30 30 ILE CA C 30 60.249 60.249 60.007 0.242 17915 110 1 . 1 1 30 30 ILE H H 30 8.033 8.033 8.100 -0.067 17915 111 1 . 1 1 31 31 LEU N N 31 127.129 127.129 127.449 -0.321 17915 112 1 . 1 1 31 31 LEU C C 31 175.745 175.745 176.038 -0.293 17915 113 1 . 1 1 31 31 LEU CA C 31 53.907 53.907 53.574 0.333 17915 114 1 . 1 1 31 31 LEU H H 31 9.223 9.223 8.748 0.475 17915 115 1 . 1 1 32 32 THR N N 32 117.055 117.055 117.266 -0.211 17915 116 1 . 1 1 32 32 THR C C 32 173.844 173.844 173.834 0.010 17915 117 1 . 1 1 32 32 THR CA C 32 63.247 63.247 61.376 1.871 17915 118 1 . 1 1 32 32 THR H H 32 8.360 8.360 8.446 -0.086 17915 119 1 . 1 1 33 33 LEU N N 33 128.815 128.815 125.258 3.557 17915 120 1 . 1 1 33 33 LEU C C 33 174.718 174.718 176.007 -1.289 17915 121 1 . 1 1 33 33 LEU CA C 33 54.870 54.870 54.600 0.270 17915 122 1 . 1 1 33 33 LEU H H 33 8.937 8.937 8.522 0.415 17915 123 1 . 1 1 34 34 LEU N N 34 126.230 126.230 125.652 0.578 17915 124 1 . 1 1 34 34 LEU C C 34 177.689 177.689 176.531 1.158 17915 125 1 . 1 1 34 34 LEU CA C 34 55.218 55.218 55.534 -0.316 17915 126 1 . 1 1 34 34 LEU H H 34 8.929 8.929 8.602 0.327 17915 127 1 . 1 1 35 35 ASN N N 35 113.879 113.879 115.823 -1.943 17915 128 1 . 1 1 35 35 ASN C C 35 174.565 174.565 173.302 1.263 17915 129 1 . 1 1 35 35 ASN CA C 35 54.576 54.576 53.185 1.391 17915 130 1 . 1 1 35 35 ASN H H 35 7.489 7.489 7.728 -0.239 17915 131 1 . 1 1 36 36 SER N N 36 123.684 123.684 117.929 5.755 17915 132 1 . 1 1 36 36 SER C C 36 173.503 173.503 174.309 -0.806 17915 133 1 . 1 1 36 36 SER CA C 36 56.904 56.904 57.981 -1.077 17915 134 1 . 1 1 36 36 SER H H 36 9.086 9.086 8.571 0.515 17915 135 1 . 1 1 37 37 THR N N 37 115.012 115.012 118.040 -3.028 17915 136 1 . 1 1 37 37 THR C C 37 175.417 175.417 174.548 0.869 17915 137 1 . 1 1 37 37 THR CA C 37 65.521 65.521 63.090 2.431 17915 138 1 . 1 1 37 37 THR H H 37 8.071 8.071 8.401 -0.330 17915 139 1 . 1 1 38 38 ASN N N 38 122.517 122.517 119.077 3.440 17915 140 1 . 1 1 38 38 ASN C C 38 174.696 174.696 174.575 0.121 17915 141 1 . 1 1 38 38 ASN CA C 38 53.479 53.479 52.818 0.661 17915 142 1 . 1 1 38 38 ASN H H 38 8.595 8.595 7.990 0.605 17915 143 1 . 1 1 39 39 LYS N N 39 120.851 120.851 120.376 0.475 17915 144 1 . 1 1 39 39 LYS C C 39 176.444 176.444 177.015 -0.571 17915 145 1 . 1 1 39 39 LYS CA C 39 58.403 58.403 58.484 -0.081 17915 146 1 . 1 1 39 39 LYS H H 39 8.416 8.416 8.535 -0.119 17915 147 1 . 1 1 40 40 ASP N N 40 114.427 114.427 117.786 -3.359 17915 148 1 . 1 1 40 40 ASP C C 40 176.960 176.960 175.567 1.393 17915 149 1 . 1 1 40 40 ASP CA C 40 55.352 55.352 55.332 0.020 17915 150 1 . 1 1 40 40 ASP H H 40 8.085 8.085 8.231 -0.146 17915 151 1 . 1 1 41 41 TRP N N 41 122.708 122.708 119.970 2.738 17915 152 1 . 1 1 41 41 TRP C C 41 174.303 174.303 174.658 -0.355 17915 153 1 . 1 1 41 41 TRP CA C 41 56.208 56.208 56.351 -0.143 17915 154 1 . 1 1 41 41 TRP H H 41 8.096 8.096 7.557 0.539 17915 155 1 . 1 1 42 42 TRP N N 42 124.707 124.707 124.464 0.243 17915 156 1 . 1 1 42 42 TRP C C 42 174.303 174.303 174.898 -0.595 17915 157 1 . 1 1 42 42 TRP CA C 42 53.987 53.987 55.709 -1.722 17915 158 1 . 1 1 42 42 TRP H H 42 9.245 9.245 8.068 1.177 17915 159 1 . 1 1 43 43 LYS N N 43 124.005 124.005 122.359 1.646 17915 160 1 . 1 1 43 43 LYS C C 43 175.482 175.482 174.916 0.565 17915 161 1 . 1 1 43 43 LYS CA C 43 55.379 55.379 55.367 0.012 17915 162 1 . 1 1 43 43 LYS H H 43 8.783 8.783 8.421 0.362 17915 163 1 . 1 1 44 44 VAL N N 44 122.139 122.139 121.215 0.925 17915 164 1 . 1 1 44 44 VAL C C 44 173.472 173.472 173.787 -0.315 17915 165 1 . 1 1 44 44 VAL CA C 44 59.072 59.072 59.743 -0.671 17915 166 1 . 1 1 44 44 VAL H H 44 9.287 9.287 8.429 0.858 17915 167 1 . 1 1 45 45 GLU N N 45 118.524 118.524 123.270 -4.746 17915 168 1 . 1 1 45 45 GLU C C 45 174.827 174.827 175.035 -0.208 17915 169 1 . 1 1 45 45 GLU CA C 45 54.174 54.174 54.904 -0.730 17915 170 1 . 1 1 45 45 GLU H H 45 8.566 8.566 8.115 0.451 17915 171 1 . 1 1 46 46 VAL N N 46 124.904 124.904 124.568 0.336 17915 172 1 . 1 1 46 46 VAL C C 46 174.608 174.608 175.341 -0.733 17915 173 1 . 1 1 46 46 VAL CA C 46 60.651 60.651 60.907 -0.256 17915 174 1 . 1 1 46 46 VAL H H 46 8.774 8.774 8.199 0.575 17915 175 1 . 1 1 47 47 ASN N N 47 126.530 126.530 126.222 0.308 17915 176 1 . 1 1 47 47 ASN C C 47 174.259 174.259 174.743 -0.484 17915 177 1 . 1 1 47 47 ASN CA C 47 55.245 55.245 54.935 0.310 17915 178 1 . 1 1 47 47 ASN H H 47 9.356 9.356 9.014 0.342 17915 179 1 . 1 1 48 48 ASP N N 48 112.420 112.420 117.457 -5.037 17915 180 1 . 1 1 48 48 ASP C C 48 174.521 174.521 174.953 -0.432 17915 181 1 . 1 1 48 48 ASP CA C 48 54.683 54.683 54.844 -0.161 17915 182 1 . 1 1 48 48 ASP H H 48 8.628 8.628 8.392 0.236 17915 183 1 . 1 1 49 49 ARG N N 49 120.379 120.379 118.981 1.398 17915 184 1 . 1 1 49 49 ARG C C 49 174.477 174.477 174.346 0.131 17915 185 1 . 1 1 49 49 ARG CA C 49 55.298 55.298 55.004 0.294 17915 186 1 . 1 1 49 49 ARG H H 49 8.069 8.069 7.809 0.260 17915 187 1 . 1 1 50 50 GLN N N 50 118.647 118.647 119.305 -0.658 17915 188 1 . 1 1 50 50 GLN C C 50 175.963 175.963 174.729 1.234 17915 189 1 . 1 1 50 50 GLN CA C 50 53.425 53.425 54.519 -1.094 17915 190 1 . 1 1 50 50 GLN H H 50 8.432 8.432 8.466 -0.034 17915 191 1 . 1 1 51 51 GLY N N 51 107.028 107.028 108.404 -1.376 17915 192 1 . 1 1 51 51 GLY C C 51 170.479 170.479 172.140 -1.661 17915 193 1 . 1 1 51 51 GLY CA C 51 45.638 45.638 45.402 0.236 17915 194 1 . 1 1 51 51 GLY H H 51 8.534 8.534 8.196 0.338 17915 195 1 . 1 1 52 52 PHE N N 52 119.030 119.030 119.541 -0.511 17915 196 1 . 1 1 52 52 PHE C C 52 175.635 175.635 174.400 1.235 17915 197 1 . 1 1 52 52 PHE CA C 52 58.724 58.724 57.098 1.626 17915 198 1 . 1 1 52 52 PHE H H 52 9.098 9.098 8.068 1.030 17915 199 1 . 1 1 53 53 VAL N N 53 110.897 110.897 122.195 -11.298 17915 200 1 . 1 1 53 53 VAL CA C 53 58.108 58.108 58.087 0.021 17915 201 1 . 1 1 53 53 VAL H H 53 8.942 8.942 8.217 0.725 17915 202 1 . 1 1 55 55 ALA N N 55 129.055 129.055 127.541 1.514 17915 203 1 . 1 1 55 55 ALA C C 55 178.565 178.565 178.672 -0.107 17915 204 1 . 1 1 55 55 ALA CA C 55 54.629 54.629 54.705 -0.076 17915 205 1 . 1 1 55 55 ALA H H 55 7.355 7.355 8.229 -0.874 17915 206 1 . 1 1 56 56 ALA N N 56 113.282 113.282 118.887 -5.605 17915 207 1 . 1 1 56 56 ALA C C 56 178.214 178.214 177.932 0.282 17915 208 1 . 1 1 56 56 ALA CA C 56 52.943 52.943 53.860 -0.917 17915 209 1 . 1 1 56 56 ALA H H 56 7.750 7.750 8.144 -0.394 17915 210 1 . 1 1 57 57 TYR N N 57 116.083 116.083 117.023 -0.940 17915 211 1 . 1 1 57 57 TYR C C 57 174.565 174.565 174.434 0.131 17915 212 1 . 1 1 57 57 TYR CA C 57 56.422 56.422 58.213 -1.791 17915 213 1 . 1 1 57 57 TYR H H 57 7.611 7.611 7.648 -0.037 17915 214 1 . 1 1 58 58 VAL N N 58 110.965 110.965 113.381 -2.416 17915 215 1 . 1 1 58 58 VAL C C 58 173.647 173.647 174.239 -0.592 17915 216 1 . 1 1 58 58 VAL CA C 58 58.242 58.242 59.474 -1.232 17915 217 1 . 1 1 58 58 VAL H H 58 7.301 7.301 7.328 -0.027 17915 218 1 . 1 1 59 59 LYS N N 59 118.586 118.586 122.472 -3.886 17915 219 1 . 1 1 59 59 LYS C C 59 176.160 176.160 175.254 0.906 17915 220 1 . 1 1 59 59 LYS CA C 59 54.041 54.041 54.948 -0.907 17915 221 1 . 1 1 59 59 LYS H H 59 8.515 8.515 8.143 0.372 17915 222 1 . 1 1 60 60 LYS N N 60 125.734 125.734 123.640 2.094 17915 223 1 . 1 1 60 60 LYS C C 60 176.793 176.793 176.775 0.018 17915 224 1 . 1 1 60 60 LYS CA C 60 58.617 58.617 55.770 2.847 17915 225 1 . 1 1 60 60 LYS H H 60 9.135 9.135 8.580 0.555 17915 226 1 . 1 1 61 61 LEU N N 61 125.061 125.061 122.223 2.838 17915 227 1 . 1 1 61 61 LEU C C 61 174.106 174.106 175.644 -1.538 17915 228 1 . 1 1 61 61 LEU CA C 61 54.977 54.977 55.766 -0.789 17915 229 1 . 1 1 61 61 LEU H H 61 8.384 8.384 8.713 -0.329 17915 stop_ save_