data_19707 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19707 _Entry.PDB_ID 2MJ6 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 19707 _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 SER N N 2 115.963 115.963 115.736 0.227 19707 2 1 1 . 1 1 2 2 SER HA H 2 4.408 4.408 4.504 -0.096 19707 3 1 1 . 1 1 2 2 SER C C 2 171.788 171.788 173.877 -2.089 19707 4 1 1 . 1 1 2 2 SER CA C 2 55.870 55.870 58.630 -2.760 19707 5 1 1 . 1 1 2 2 SER CB C 2 61.022 61.022 63.778 -2.756 19707 6 1 1 . 1 1 2 2 SER H H 2 8.661 8.661 8.318 0.343 19707 7 1 1 . 1 1 3 3 GLU N N 3 122.941 122.941 121.266 1.675 19707 8 1 1 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.581 -0.261 19707 9 1 1 . 1 1 3 3 GLU C C 3 173.817 173.817 175.329 -1.512 19707 10 1 1 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.881 -1.927 19707 11 1 1 . 1 1 3 3 GLU CB C 3 26.837 26.837 31.625 -4.788 19707 12 1 1 . 1 1 3 3 GLU H H 3 8.706 8.706 8.469 0.237 19707 13 1 1 . 1 1 4 4 THR N N 4 116.182 116.182 116.874 -0.692 19707 14 1 1 . 1 1 4 4 THR HA H 4 4.233 4.233 4.758 -0.525 19707 15 1 1 . 1 1 4 4 THR C C 4 171.719 171.719 174.470 -2.751 19707 16 1 1 . 1 1 4 4 THR CA C 4 59.414 59.414 61.867 -2.453 19707 17 1 1 . 1 1 4 4 THR CB C 4 67.009 67.009 69.627 -2.618 19707 18 1 1 . 1 1 4 4 THR H H 4 8.165 8.165 8.287 -0.122 19707 19 1 1 . 1 1 5 5 ARG N N 5 124.184 124.184 121.753 2.431 19707 20 1 1 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.630 -0.270 19707 21 1 1 . 1 1 5 5 ARG C C 5 173.520 173.520 175.400 -1.880 19707 22 1 1 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.060 -1.717 19707 23 1 1 . 1 1 5 5 ARG CB C 5 28.165 28.165 31.765 -3.600 19707 24 1 1 . 1 1 5 5 ARG H H 5 8.354 8.354 8.393 -0.039 19707 25 1 1 . 1 1 6 6 THR N N 6 116.652 116.652 117.066 -0.414 19707 26 1 1 . 1 1 6 6 THR HA H 6 4.263 4.263 4.558 -0.295 19707 27 1 1 . 1 1 6 6 THR C C 6 171.784 171.784 174.555 -2.771 19707 28 1 1 . 1 1 6 6 THR CA C 6 59.218 59.218 62.062 -2.844 19707 29 1 1 . 1 1 6 6 THR CB C 6 67.213 67.213 68.988 -1.775 19707 30 1 1 . 1 1 6 6 THR H H 6 8.224 8.224 8.325 -0.101 19707 31 1 1 . 1 1 7 7 ILE N N 7 123.882 123.882 126.299 -2.417 19707 32 1 1 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.229 -0.091 19707 33 1 1 . 1 1 7 7 ILE C C 7 173.572 173.572 176.594 -3.022 19707 34 1 1 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.404 -1.923 19707 35 1 1 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.606 -2.537 19707 36 1 1 . 1 1 7 7 ILE H H 7 8.247 8.247 8.413 -0.166 19707 37 1 1 . 1 1 8 8 SER N N 8 120.287 120.287 117.880 2.407 19707 38 1 1 . 1 1 8 8 SER HA H 8 4.445 4.445 4.592 -0.147 19707 39 1 1 . 1 1 8 8 SER C C 8 171.926 171.926 174.093 -2.167 19707 40 1 1 . 1 1 8 8 SER CA C 8 55.522 55.522 57.781 -2.259 19707 41 1 1 . 1 1 8 8 SER CB C 8 61.073 61.073 64.700 -3.627 19707 42 1 1 . 1 1 8 8 SER H H 8 8.402 8.402 8.290 0.112 19707 43 1 1 . 1 1 9 9 SER N N 9 118.425 118.425 121.170 -2.745 19707 44 1 1 . 1 1 9 9 SER HA H 9 4.525 4.525 4.784 -0.259 19707 45 1 1 . 1 1 9 9 SER C C 9 172.663 172.663 173.944 -1.281 19707 46 1 1 . 1 1 9 9 SER CA C 9 55.897 55.897 58.372 -2.475 19707 47 1 1 . 1 1 9 9 SER CB C 9 61.375 61.375 63.498 -2.123 19707 48 1 1 . 1 1 9 9 SER H H 9 8.362 8.362 8.644 -0.282 19707 49 1 1 . 1 1 10 10 THR N N 10 115.676 115.676 113.254 2.422 19707 50 1 1 . 1 1 10 10 THR HA H 10 4.232 4.232 4.655 -0.423 19707 51 1 1 . 1 1 10 10 THR C C 10 173.070 173.070 175.360 -2.290 19707 52 1 1 . 1 1 10 10 THR CA C 10 60.318 60.318 62.578 -2.260 19707 53 1 1 . 1 1 10 10 THR CB C 10 67.205 67.205 69.541 -2.336 19707 54 1 1 . 1 1 10 10 THR H H 10 8.274 8.274 7.985 0.289 19707 55 1 1 . 1 1 11 11 ALA N N 11 124.726 124.726 124.167 0.559 19707 56 1 1 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.025 -0.038 19707 57 1 1 . 1 1 11 11 ALA C C 11 176.825 176.825 179.295 -2.470 19707 58 1 1 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.138 -2.596 19707 59 1 1 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.284 -2.395 19707 60 1 1 . 1 1 11 11 ALA H H 11 8.347 8.347 8.190 0.157 19707 61 1 1 . 1 1 12 12 GLN N N 12 117.915 117.915 117.584 0.331 19707 62 1 1 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.100 -0.311 19707 63 1 1 . 1 1 12 12 GLN C C 12 174.697 174.697 177.398 -2.701 19707 64 1 1 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.051 -3.047 19707 65 1 1 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.636 -2.411 19707 66 1 1 . 1 1 12 12 GLN H H 12 8.194 8.194 7.817 0.377 19707 67 1 1 . 1 1 13 13 GLU N N 13 118.510 118.510 119.997 -1.487 19707 68 1 1 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.100 0.003 19707 69 1 1 . 1 1 13 13 GLU C C 13 176.192 176.192 178.979 -2.787 19707 70 1 1 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.748 -2.433 19707 71 1 1 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.535 -3.502 19707 72 1 1 . 1 1 13 13 GLU H H 13 7.917 7.917 8.318 -0.401 19707 73 1 1 . 1 1 14 14 ARG N N 14 118.193 118.193 119.744 -1.551 19707 74 1 1 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.081 -0.113 19707 75 1 1 . 1 1 14 14 ARG C C 14 176.764 176.764 178.573 -1.809 19707 76 1 1 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.081 -1.798 19707 77 1 1 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.663 -2.426 19707 78 1 1 . 1 1 14 14 ARG H H 14 7.907 7.907 8.349 -0.442 19707 79 1 1 . 1 1 15 15 VAL N N 15 117.991 117.991 115.975 2.016 19707 80 1 1 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.945 -0.042 19707 81 1 1 . 1 1 15 15 VAL C C 15 174.922 174.922 177.578 -2.656 19707 82 1 1 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.704 -1.873 19707 83 1 1 . 1 1 15 15 VAL CB C 15 28.723 28.723 30.787 -2.064 19707 84 1 1 . 1 1 15 15 VAL H H 15 7.658 7.658 7.504 0.154 19707 85 1 1 . 1 1 16 16 ASP N N 16 124.314 124.314 120.707 3.607 19707 86 1 1 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.421 -0.105 19707 87 1 1 . 1 1 16 16 ASP C C 16 176.462 176.462 177.741 -1.279 19707 88 1 1 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.448 -2.122 19707 89 1 1 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.325 -4.656 19707 90 1 1 . 1 1 16 16 ASP H H 16 8.291 8.291 8.055 0.236 19707 91 1 1 . 1 1 17 17 LEU N N 17 120.212 120.212 119.565 0.647 19707 92 1 1 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.125 -0.071 19707 93 1 1 . 1 1 17 17 LEU C C 17 177.171 177.171 179.048 -1.877 19707 94 1 1 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.597 -2.617 19707 95 1 1 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.265 -2.420 19707 96 1 1 . 1 1 17 17 LEU H H 17 8.172 8.172 7.539 0.633 19707 97 1 1 . 1 1 18 18 GLU N N 18 120.587 120.587 118.796 1.791 19707 98 1 1 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.981 0.212 19707 99 1 1 . 1 1 18 18 GLU C C 18 175.997 175.997 178.626 -2.629 19707 100 1 1 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.428 -3.326 19707 101 1 1 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.795 -2.723 19707 102 1 1 . 1 1 18 18 GLU H H 18 7.876 7.876 7.835 0.041 19707 103 1 1 . 1 1 19 19 ALA N N 19 121.800 121.800 122.807 -1.007 19707 104 1 1 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.112 -0.321 19707 105 1 1 . 1 1 19 19 ALA C C 19 175.708 175.708 179.627 -3.919 19707 106 1 1 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.882 -2.030 19707 107 1 1 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.473 -4.319 19707 108 1 1 . 1 1 19 19 ALA H H 19 7.792 7.792 7.453 0.339 19707 109 1 1 . 1 1 20 20 VAL N N 20 118.680 118.680 119.849 -1.169 19707 110 1 1 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.652 -0.352 19707 111 1 1 . 1 1 20 20 VAL C C 20 176.276 176.276 177.808 -1.532 19707 112 1 1 . 1 1 20 20 VAL CA C 20 63.807 63.807 67.079 -3.272 19707 113 1 1 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.222 -1.671 19707 114 1 1 . 1 1 20 20 VAL H H 20 7.712 7.712 8.090 -0.378 19707 115 1 1 . 1 1 21 21 ARG N N 21 121.935 121.935 120.660 1.275 19707 116 1 1 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.050 -0.055 19707 117 1 1 . 1 1 21 21 ARG C C 21 176.828 176.828 178.649 -1.821 19707 118 1 1 . 1 1 21 21 ARG CA C 21 56.660 56.660 59.378 -2.718 19707 119 1 1 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.927 -2.636 19707 120 1 1 . 1 1 21 21 ARG H H 21 8.444 8.444 8.333 0.111 19707 121 1 1 . 1 1 22 22 LEU N N 22 119.327 119.327 119.574 -0.247 19707 122 1 1 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.110 -0.115 19707 123 1 1 . 1 1 22 22 LEU C C 22 175.664 175.664 178.537 -2.873 19707 124 1 1 . 1 1 22 22 LEU CA C 22 54.868 54.868 57.844 -2.976 19707 125 1 1 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.549 -2.414 19707 126 1 1 . 1 1 22 22 LEU H H 22 8.248 8.248 7.992 0.256 19707 127 1 1 . 1 1 23 23 ALA N N 23 121.202 121.202 122.221 -1.019 19707 128 1 1 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.947 -0.212 19707 129 1 1 . 1 1 23 23 ALA C C 23 175.492 175.492 179.630 -4.138 19707 130 1 1 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.344 -2.275 19707 131 1 1 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.015 -3.948 19707 132 1 1 . 1 1 23 23 ALA H H 23 8.392 8.392 8.643 -0.251 19707 133 1 1 . 1 1 24 24 SER N N 24 112.377 112.377 114.747 -2.370 19707 134 1 1 . 1 1 24 24 SER HA H 24 4.214 4.214 4.284 -0.070 19707 135 1 1 . 1 1 24 24 SER C C 24 174.773 174.773 176.340 -1.567 19707 136 1 1 . 1 1 24 24 SER CA C 24 59.258 59.258 62.324 -3.066 19707 137 1 1 . 1 1 24 24 SER CB C 24 60.149 60.149 63.210 -3.061 19707 138 1 1 . 1 1 24 24 SER H H 24 7.690 7.690 8.134 -0.444 19707 139 1 1 . 1 1 25 25 ILE N N 25 123.886 123.886 121.561 2.325 19707 140 1 1 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.942 -0.100 19707 141 1 1 . 1 1 25 25 ILE C C 25 176.487 176.487 177.856 -1.369 19707 142 1 1 . 1 1 25 25 ILE CA C 25 61.993 61.993 61.710 0.283 19707 143 1 1 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.311 -0.379 19707 144 1 1 . 1 1 25 25 ILE H H 25 7.837 7.837 7.864 -0.027 19707 145 1 1 . 1 1 26 26 VAL N N 26 122.538 122.538 121.363 1.175 19707 146 1 1 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.610 -0.222 19707 147 1 1 . 1 1 26 26 VAL C C 26 174.624 174.624 177.454 -2.830 19707 148 1 1 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.504 -2.589 19707 149 1 1 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.536 -3.641 19707 150 1 1 . 1 1 26 26 VAL H H 26 8.804 8.804 8.676 0.128 19707 151 1 1 . 1 1 27 27 ASP N N 27 120.433 120.433 120.217 0.216 19707 152 1 1 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.261 -0.097 19707 153 1 1 . 1 1 27 27 ASP C C 27 174.966 174.966 178.294 -3.328 19707 154 1 1 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.658 -2.329 19707 155 1 1 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.690 -2.836 19707 156 1 1 . 1 1 27 27 ASP H H 27 8.719 8.719 8.272 0.447 19707 157 1 1 . 1 1 28 28 SER N N 28 112.397 112.397 114.132 -1.735 19707 158 1 1 . 1 1 28 28 SER HA H 28 4.073 4.073 4.211 -0.138 19707 159 1 1 . 1 1 28 28 SER C C 28 174.405 174.405 176.680 -2.275 19707 160 1 1 . 1 1 28 28 SER CA C 28 59.115 59.115 61.392 -2.277 19707 161 1 1 . 1 1 28 28 SER CB C 28 60.125 60.125 63.366 -3.241 19707 162 1 1 . 1 1 28 28 SER H H 28 7.599 7.599 7.856 -0.257 19707 163 1 1 . 1 1 29 29 ARG N N 29 123.945 123.945 122.143 1.802 19707 164 1 1 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.950 0.077 19707 165 1 1 . 1 1 29 29 ARG C C 29 175.902 175.902 178.258 -2.356 19707 166 1 1 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.870 -3.596 19707 167 1 1 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.071 -1.331 19707 168 1 1 . 1 1 29 29 ARG H H 29 7.769 7.769 7.618 0.151 19707 169 1 1 . 1 1 30 30 LEU N N 30 121.580 121.580 120.659 0.921 19707 170 1 1 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.990 -0.241 19707 171 1 1 . 1 1 30 30 LEU C C 30 177.474 177.474 179.607 -2.133 19707 172 1 1 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.877 -2.564 19707 173 1 1 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.844 -2.815 19707 174 1 1 . 1 1 30 30 LEU H H 30 8.665 8.665 8.386 0.279 19707 175 1 1 . 1 1 31 31 ILE N N 31 119.330 119.330 117.202 2.128 19707 176 1 1 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.791 -0.100 19707 177 1 1 . 1 1 31 31 ILE C C 31 175.341 175.341 177.839 -2.498 19707 178 1 1 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.019 -2.507 19707 179 1 1 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.941 -2.374 19707 180 1 1 . 1 1 31 31 ILE H H 31 8.226 8.226 8.357 -0.131 19707 181 1 1 . 1 1 32 32 GLY N N 32 106.092 106.092 105.917 0.175 19707 182 1 1 . 1 1 32 32 GLY C C 32 172.413 172.413 174.874 -2.461 19707 183 1 1 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.585 -3.088 19707 184 1 1 . 1 1 32 32 GLY H H 32 7.767 7.767 7.760 0.007 19707 185 1 1 . 1 1 33 33 THR N N 33 110.966 110.966 112.573 -1.607 19707 186 1 1 . 1 1 33 33 THR HA H 33 4.455 4.455 4.346 0.109 19707 187 1 1 . 1 1 33 33 THR C C 33 172.714 172.714 174.718 -2.004 19707 188 1 1 . 1 1 33 33 THR CA C 33 60.032 60.032 62.379 -2.347 19707 189 1 1 . 1 1 33 33 THR CB C 33 68.287 68.287 69.758 -1.471 19707 190 1 1 . 1 1 33 33 THR H H 33 8.102 8.102 7.862 0.240 19707 191 1 1 . 1 1 34 34 GLY N N 34 110.320 110.320 111.324 -1.004 19707 192 1 1 . 1 1 34 34 GLY C C 34 170.505 170.505 173.383 -2.878 19707 193 1 1 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.021 -2.438 19707 194 1 1 . 1 1 34 34 GLY H H 34 8.072 8.072 8.229 -0.157 19707 195 1 1 . 1 1 35 35 SER N N 35 112.944 112.944 113.576 -0.632 19707 196 1 1 . 1 1 35 35 SER HA H 35 4.385 4.385 4.829 -0.444 19707 197 1 1 . 1 1 35 35 SER C C 35 169.537 169.537 172.967 -3.430 19707 198 1 1 . 1 1 35 35 SER CA C 35 54.794 54.794 57.319 -2.525 19707 199 1 1 . 1 1 35 35 SER CB C 35 62.029 62.029 65.850 -3.821 19707 200 1 1 . 1 1 35 35 SER H H 35 7.719 7.719 7.501 0.218 19707 201 1 1 . 1 1 36 36 VAL N N 36 118.566 118.566 123.225 -4.659 19707 202 1 1 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.052 -0.019 19707 203 1 1 . 1 1 36 36 VAL C C 36 169.876 169.876 174.824 -4.948 19707 204 1 1 . 1 1 36 36 VAL CA C 36 58.565 58.565 62.208 -3.643 19707 205 1 1 . 1 1 36 36 VAL CB C 36 30.952 30.952 32.904 -1.952 19707 206 1 1 . 1 1 36 36 VAL H H 36 8.490 8.490 8.529 -0.039 19707 207 1 1 . 1 1 37 37 ASP N N 37 121.640 121.640 125.671 -4.031 19707 208 1 1 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.908 -0.106 19707 209 1 1 . 1 1 37 37 ASP C C 37 172.806 172.806 176.854 -4.048 19707 210 1 1 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.652 -3.609 19707 211 1 1 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.648 -3.442 19707 212 1 1 . 1 1 37 37 ASP H H 37 7.195 7.195 8.164 -0.969 19707 213 1 1 . 1 1 38 38 GLU N N 38 120.018 120.018 121.034 -1.016 19707 214 1 1 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.975 -0.318 19707 215 1 1 . 1 1 38 38 GLU C C 38 174.753 174.753 178.097 -3.344 19707 216 1 1 . 1 1 38 38 GLU CA C 38 57.492 57.492 59.920 -2.428 19707 217 1 1 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.948 -3.869 19707 218 1 1 . 1 1 38 38 GLU H H 38 8.908 8.908 8.736 0.172 19707 219 1 1 . 1 1 39 39 ASP N N 39 118.668 118.668 117.545 1.123 19707 220 1 1 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.474 -0.228 19707 221 1 1 . 1 1 39 39 ASP C C 39 175.393 175.393 177.689 -2.296 19707 222 1 1 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.237 -1.373 19707 223 1 1 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.490 -3.521 19707 224 1 1 . 1 1 39 39 ASP H H 39 8.242 8.242 8.628 -0.386 19707 225 1 1 . 1 1 40 40 PHE N N 40 119.851 119.851 119.015 0.836 19707 226 1 1 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.398 -0.194 19707 227 1 1 . 1 1 40 40 PHE C C 40 174.929 174.929 176.380 -1.451 19707 228 1 1 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.491 -2.320 19707 229 1 1 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.840 -3.007 19707 230 1 1 . 1 1 40 40 PHE H H 40 8.037 8.037 7.772 0.265 19707 231 1 1 . 1 1 41 41 LEU N N 41 117.882 117.882 117.830 0.052 19707 232 1 1 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.081 -0.559 19707 233 1 1 . 1 1 41 41 LEU C C 41 175.938 175.938 178.855 -2.917 19707 234 1 1 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.569 -1.709 19707 235 1 1 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.383 -3.152 19707 236 1 1 . 1 1 41 41 LEU H H 41 7.816 7.816 7.655 0.161 19707 237 1 1 . 1 1 42 42 ARG N N 42 118.360 118.360 118.976 -0.616 19707 238 1 1 . 1 1 42 42 ARG HA H 42 3.740 3.740 3.997 -0.257 19707 239 1 1 . 1 1 42 42 ARG C C 42 175.435 175.435 177.115 -1.680 19707 240 1 1 . 1 1 42 42 ARG CA C 42 56.971 56.971 58.999 -2.028 19707 241 1 1 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.802 -2.538 19707 242 1 1 . 1 1 42 42 ARG H H 42 8.540 8.540 7.907 0.633 19707 243 1 1 . 1 1 43 43 GLU N N 43 114.947 114.947 117.000 -2.053 19707 244 1 1 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.253 -0.203 19707 245 1 1 . 1 1 43 43 GLU C C 43 174.518 174.518 177.648 -3.130 19707 246 1 1 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.672 -3.100 19707 247 1 1 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.078 -3.037 19707 248 1 1 . 1 1 43 43 GLU H H 43 7.223 7.223 8.225 -1.002 19707 249 1 1 . 1 1 44 44 GLN N N 44 114.109 114.109 117.381 -3.272 19707 250 1 1 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.403 -0.297 19707 251 1 1 . 1 1 44 44 GLN C C 44 173.777 173.777 177.940 -4.163 19707 252 1 1 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.826 -3.645 19707 253 1 1 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.152 -3.282 19707 254 1 1 . 1 1 44 44 GLN H H 44 7.372 7.372 8.197 -0.825 19707 255 1 1 . 1 1 45 45 ILE N N 45 117.470 117.470 118.548 -1.078 19707 256 1 1 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.619 0.329 19707 257 1 1 . 1 1 45 45 ILE C C 45 172.305 172.305 177.479 -5.174 19707 258 1 1 . 1 1 45 45 ILE CA C 45 58.505 58.505 65.425 -6.920 19707 259 1 1 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.433 -1.733 19707 260 1 1 . 1 1 45 45 ILE H H 45 7.235 7.235 7.297 -0.062 19707 261 1 1 . 1 1 46 46 ARG N N 46 122.996 122.996 115.478 7.518 19707 262 1 1 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.000 0.190 19707 263 1 1 . 1 1 46 46 ARG C C 46 172.992 172.992 175.202 -2.210 19707 264 1 1 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.303 -4.542 19707 265 1 1 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.307 -0.355 19707 266 1 1 . 1 1 46 46 ARG H H 46 8.336 8.336 8.659 -0.323 19707 267 1 1 . 1 1 47 47 ASP N N 47 118.676 118.676 115.491 3.185 19707 268 1 1 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.686 -0.238 19707 269 1 1 . 1 1 47 47 ASP C C 47 172.520 172.520 174.890 -2.370 19707 270 1 1 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.651 -2.760 19707 271 1 1 . 1 1 47 47 ASP CB C 47 37.657 37.657 44.024 -6.367 19707 272 1 1 . 1 1 47 47 ASP H H 47 8.313 8.313 8.226 0.087 19707 273 1 1 . 1 1 48 48 ALA N N 48 120.922 120.922 122.985 -2.063 19707 274 1 1 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.484 -0.115 19707 275 1 1 . 1 1 48 48 ALA C C 48 174.295 174.295 176.719 -2.424 19707 276 1 1 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.335 -1.698 19707 277 1 1 . 1 1 48 48 ALA CB C 48 16.214 16.214 20.341 -4.127 19707 278 1 1 . 1 1 48 48 ALA H H 48 7.824 7.824 7.236 0.588 19707 279 1 1 . 1 1 49 49 ARG N N 49 118.644 118.644 119.218 -0.574 19707 280 1 1 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.032 0.310 19707 281 1 1 . 1 1 49 49 ARG C C 49 172.504 172.504 176.318 -3.814 19707 282 1 1 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.490 -3.581 19707 283 1 1 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.544 -2.201 19707 284 1 1 . 1 1 49 49 ARG H H 49 7.911 7.911 8.493 -0.582 19707 285 1 1 . 1 1 50 50 TYR N N 50 119.470 119.470 114.472 4.998 19707 286 1 1 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.014 0.277 19707 287 1 1 . 1 1 50 50 TYR C C 50 170.470 170.470 174.294 -3.824 19707 288 1 1 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.256 -1.988 19707 289 1 1 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.401 -0.888 19707 290 1 1 . 1 1 50 50 TYR H H 50 7.639 7.639 8.018 -0.379 19707 291 1 1 . 1 1 51 51 ALA N N 51 127.418 127.418 125.365 2.053 19707 292 1 1 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.099 0.122 19707 293 1 1 . 1 1 51 51 ALA C C 51 171.328 171.328 175.460 -4.132 19707 294 1 1 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.293 -2.860 19707 295 1 1 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.863 -1.551 19707 296 1 1 . 1 1 51 51 ALA H H 51 8.222 8.222 8.770 -0.548 19707 297 1 1 . 1 1 52 52 VAL N N 52 117.832 117.832 120.396 -2.564 19707 298 1 1 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.244 -0.577 19707 299 1 1 . 1 1 52 52 VAL C C 52 172.436 172.436 174.327 -1.891 19707 300 1 1 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.661 -2.904 19707 301 1 1 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.268 -4.165 19707 302 1 1 . 1 1 52 52 VAL H H 52 8.753 8.753 9.120 -0.367 19707 303 1 1 . 1 1 53 53 ILE N N 53 128.027 128.027 126.069 1.958 19707 304 1 1 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.542 0.300 19707 305 1 1 . 1 1 53 53 ILE C C 53 172.110 172.110 174.276 -2.166 19707 306 1 1 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.320 -2.567 19707 307 1 1 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.827 -3.668 19707 308 1 1 . 1 1 53 53 ILE H H 53 9.261 9.261 8.965 0.296 19707 309 1 1 . 1 1 54 54 ARG N N 54 127.885 127.885 127.629 0.256 19707 310 1 1 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.704 0.049 19707 311 1 1 . 1 1 54 54 ARG C C 54 172.285 172.285 174.412 -2.127 19707 312 1 1 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.657 -1.397 19707 313 1 1 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.465 -2.573 19707 314 1 1 . 1 1 54 54 ARG H H 54 8.686 8.686 8.786 -0.100 19707 315 1 1 . 1 1 55 55 ILE N N 55 129.907 129.907 123.792 6.115 19707 316 1 1 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.389 -0.236 19707 317 1 1 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.954 -2.359 19707 318 1 1 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.197 -1.585 19707 319 1 1 . 1 1 55 55 ILE H H 55 9.292 9.292 8.268 1.024 19707 320 1 1 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.369 -0.177 19707 321 1 1 . 1 1 56 56 PRO C C 56 174.787 174.787 177.711 -2.924 19707 322 1 1 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.857 -2.123 19707 323 1 1 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.882 -2.969 19707 324 1 1 . 1 1 57 57 GLY N N 57 111.828 111.828 111.314 0.514 19707 325 1 1 . 1 1 57 57 GLY C C 57 171.039 171.039 173.542 -2.503 19707 326 1 1 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.912 -2.095 19707 327 1 1 . 1 1 57 57 GLY H H 57 8.708 8.708 8.912 -0.204 19707 328 1 1 . 1 1 58 58 GLN N N 58 118.457 118.457 119.769 -1.312 19707 329 1 1 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.856 0.044 19707 330 1 1 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.020 -2.748 19707 331 1 1 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.808 -2.654 19707 332 1 1 . 1 1 58 58 GLN H H 58 7.909 7.909 7.579 0.330 19707 333 1 1 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.423 0.013 19707 334 1 1 . 1 1 59 59 PRO C C 59 174.607 174.607 176.488 -1.881 19707 335 1 1 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.658 -2.603 19707 336 1 1 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.222 -3.045 19707 337 1 1 . 1 1 60 60 VAL N N 60 122.695 122.695 121.224 1.471 19707 338 1 1 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.118 -0.163 19707 339 1 1 . 1 1 60 60 VAL C C 60 172.403 172.403 175.384 -2.981 19707 340 1 1 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.649 -1.754 19707 341 1 1 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.740 -3.098 19707 342 1 1 . 1 1 60 60 VAL H H 60 8.364 8.364 8.230 0.134 19707 343 1 1 . 1 1 61 61 VAL N N 61 126.097 126.097 128.492 -2.395 19707 344 1 1 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.327 -0.027 19707 345 1 1 . 1 1 61 61 VAL C C 61 170.891 170.891 174.351 -3.460 19707 346 1 1 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.562 -2.748 19707 347 1 1 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.181 -2.983 19707 348 1 1 . 1 1 61 61 VAL H H 61 8.023 8.023 8.127 -0.104 19707 349 1 1 . 1 1 62 62 GLU N N 62 126.097 126.097 125.475 0.622 19707 350 1 1 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.081 0.078 19707 351 1 1 . 1 1 62 62 GLU C C 62 172.252 172.252 175.398 -3.146 19707 352 1 1 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.067 -3.527 19707 353 1 1 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.909 -2.609 19707 354 1 1 . 1 1 62 62 GLU H H 62 8.591 8.591 8.527 0.064 19707 355 1 1 . 1 1 63 63 VAL N N 63 120.374 120.374 123.589 -3.215 19707 356 1 1 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.316 0.077 19707 357 1 1 . 1 1 63 63 VAL C C 63 171.040 171.040 176.459 -5.419 19707 358 1 1 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.379 -3.546 19707 359 1 1 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.690 -0.112 19707 360 1 1 . 1 1 63 63 VAL H H 63 8.732 8.732 8.926 -0.194 19707 361 1 1 . 1 1 64 64 GLY N N 64 109.935 109.935 114.137 -4.202 19707 362 1 1 . 1 1 64 64 GLY C C 64 171.656 171.656 174.083 -2.427 19707 363 1 1 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.300 -5.123 19707 364 1 1 . 1 1 64 64 GLY H H 64 8.259 8.259 8.433 -0.174 19707 365 1 1 . 1 1 65 65 THR N N 65 115.478 115.478 116.061 -0.583 19707 366 1 1 . 1 1 65 65 THR HA H 65 4.342 4.342 4.331 0.011 19707 367 1 1 . 1 1 65 65 THR C C 65 170.663 170.663 172.735 -2.072 19707 368 1 1 . 1 1 65 65 THR CA C 65 58.357 58.357 60.283 -1.926 19707 369 1 1 . 1 1 65 65 THR CB C 65 67.923 67.923 72.001 -4.078 19707 370 1 1 . 1 1 65 65 THR H H 65 8.123 8.123 7.540 0.583 19707 371 1 1 . 1 1 66 66 LYS N N 66 130.775 130.775 124.211 6.564 19707 372 1 1 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.141 -1.211 19707 373 1 1 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.968 -2.778 19707 374 1 1 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.805 -3.115 19707 375 1 1 . 1 1 66 66 LYS H H 66 8.472 8.472 8.133 0.339 19707 376 1 1 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.582 -0.171 19707 377 1 1 . 1 1 67 67 PRO C C 67 173.211 173.211 176.829 -3.618 19707 378 1 1 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.323 -2.757 19707 379 1 1 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.757 -3.354 19707 380 1 1 . 1 1 68 68 THR N N 68 111.983 111.983 114.381 -2.398 19707 381 1 1 . 1 1 68 68 THR HA H 68 4.277 4.277 4.285 -0.008 19707 382 1 1 . 1 1 68 68 THR C C 68 171.720 171.720 175.778 -4.058 19707 383 1 1 . 1 1 68 68 THR CA C 68 58.193 58.193 62.192 -3.999 19707 384 1 1 . 1 1 68 68 THR CB C 68 67.723 67.723 69.512 -1.789 19707 385 1 1 . 1 1 68 68 THR H H 68 8.091 8.091 8.421 -0.330 19707 386 1 1 . 1 1 69 69 GLY N N 69 109.918 109.918 108.378 1.540 19707 387 1 1 . 1 1 69 69 GLY C C 69 170.783 170.783 174.175 -3.392 19707 388 1 1 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.747 -2.691 19707 389 1 1 . 1 1 69 69 GLY H H 69 8.119 8.119 7.768 0.351 19707 390 1 1 . 1 1 70 70 ASP N N 70 123.294 123.294 125.125 -1.831 19707 391 1 1 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.850 -0.301 19707 392 1 1 . 1 1 70 70 ASP C C 70 173.651 173.651 175.141 -1.490 19707 393 1 1 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.950 -3.089 19707 394 1 1 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.142 -1.409 19707 395 1 1 . 1 1 70 70 ASP H H 70 8.444 8.444 8.746 -0.302 19707 396 1 1 . 1 1 71 71 VAL N N 71 117.772 117.772 113.321 4.451 19707 397 1 1 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.128 -0.421 19707 398 1 1 . 1 1 71 71 VAL C C 71 172.992 172.992 174.292 -1.300 19707 399 1 1 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.260 -1.883 19707 400 1 1 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.685 -2.663 19707 401 1 1 . 1 1 71 71 VAL H H 71 8.173 8.173 7.740 0.433 19707 402 1 1 . 1 1 72 72 LEU N N 72 123.435 123.435 122.945 0.490 19707 403 1 1 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.597 0.039 19707 404 1 1 . 1 1 72 72 LEU C C 72 173.189 173.189 175.978 -2.789 19707 405 1 1 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.272 -3.065 19707 406 1 1 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.604 -1.966 19707 407 1 1 . 1 1 72 72 LEU H H 72 8.859 8.859 8.845 0.014 19707 408 1 1 . 1 1 73 73 GLN N N 73 119.520 119.520 120.654 -1.134 19707 409 1 1 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.252 0.093 19707 410 1 1 . 1 1 73 73 GLN C C 73 172.249 172.249 175.639 -3.390 19707 411 1 1 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.431 -3.098 19707 412 1 1 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.757 -1.987 19707 413 1 1 . 1 1 73 73 GLN H H 73 9.196 9.196 8.250 0.946 19707 414 1 1 . 1 1 74 74 GLY N N 74 113.513 113.513 111.540 1.973 19707 415 1 1 . 1 1 74 74 GLY C C 74 169.072 169.072 172.050 -2.978 19707 416 1 1 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.698 -2.401 19707 417 1 1 . 1 1 74 74 GLY H H 74 9.373 9.373 9.130 0.243 19707 418 1 1 . 1 1 75 75 ARG N N 75 122.479 122.479 122.583 -0.104 19707 419 1 1 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.281 0.221 19707 420 1 1 . 1 1 75 75 ARG C C 75 172.348 172.348 173.964 -1.616 19707 421 1 1 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.860 -4.102 19707 422 1 1 . 1 1 75 75 ARG CB C 75 31.818 31.818 33.940 -2.122 19707 423 1 1 . 1 1 75 75 ARG H H 75 8.615 8.615 8.355 0.260 19707 424 1 1 . 1 1 76 76 ALA N N 76 122.346 122.346 128.247 -5.901 19707 425 1 1 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.815 -0.279 19707 426 1 1 . 1 1 76 76 ALA C C 76 172.704 172.704 174.860 -2.156 19707 427 1 1 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.305 -2.278 19707 428 1 1 . 1 1 76 76 ALA CB C 76 20.025 20.025 23.120 -3.095 19707 429 1 1 . 1 1 76 76 ALA H H 76 8.590 8.590 9.074 -0.484 19707 430 1 1 . 1 1 77 77 THR N N 77 116.961 116.961 116.960 0.001 19707 431 1 1 . 1 1 77 77 THR HA H 77 4.988 4.988 5.105 -0.117 19707 432 1 1 . 1 1 77 77 THR C C 77 172.800 172.800 174.692 -1.892 19707 433 1 1 . 1 1 77 77 THR CA C 77 58.344 58.344 61.031 -2.687 19707 434 1 1 . 1 1 77 77 THR CB C 77 67.712 67.712 70.378 -2.666 19707 435 1 1 . 1 1 77 77 THR H H 77 8.491 8.491 8.305 0.186 19707 436 1 1 . 1 1 78 78 GLY N N 78 111.103 111.103 112.917 -1.814 19707 437 1 1 . 1 1 78 78 GLY C C 78 172.567 172.567 174.726 -2.159 19707 438 1 1 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.675 -2.366 19707 439 1 1 . 1 1 78 78 GLY H H 78 8.649 8.649 8.652 -0.003 19707 440 1 1 . 1 1 79 79 GLU N N 79 123.423 123.423 119.413 4.010 19707 441 1 1 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.337 -0.341 19707 442 1 1 . 1 1 79 79 GLU C C 79 175.466 175.466 177.080 -1.614 19707 443 1 1 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.028 -2.569 19707 444 1 1 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.731 -3.664 19707 445 1 1 . 1 1 79 79 GLU H H 79 10.375 10.375 8.805 1.570 19707 446 1 1 . 1 1 80 80 GLU N N 80 113.846 113.846 117.604 -3.758 19707 447 1 1 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.431 -0.073 19707 448 1 1 . 1 1 80 80 GLU C C 80 173.293 173.293 176.835 -3.542 19707 449 1 1 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.955 -4.179 19707 450 1 1 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.606 -4.875 19707 451 1 1 . 1 1 80 80 GLU H H 80 7.679 7.679 8.501 -0.822 19707 452 1 1 . 1 1 81 81 GLY N N 81 105.493 105.493 109.106 -3.613 19707 453 1 1 . 1 1 81 81 GLY C C 81 170.427 170.427 174.186 -3.759 19707 454 1 1 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.083 -2.471 19707 455 1 1 . 1 1 81 81 GLY H H 81 7.476 7.476 7.680 -0.204 19707 456 1 1 . 1 1 82 82 GLU N N 82 122.160 122.160 119.036 3.124 19707 457 1 1 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.364 0.590 19707 458 1 1 . 1 1 82 82 GLU C C 82 171.004 171.004 175.607 -4.603 19707 459 1 1 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.592 -4.271 19707 460 1 1 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.148 -5.082 19707 461 1 1 . 1 1 82 82 GLU H H 82 9.585 9.585 7.978 1.607 19707 462 1 1 . 1 1 83 83 THR N N 83 114.756 114.756 115.899 -1.143 19707 463 1 1 . 1 1 83 83 THR HA H 83 4.990 4.990 5.132 -0.142 19707 464 1 1 . 1 1 83 83 THR C C 83 170.909 170.909 173.168 -2.259 19707 465 1 1 . 1 1 83 83 THR CA C 83 57.957 57.957 61.827 -3.870 19707 466 1 1 . 1 1 83 83 THR CB C 83 68.271 68.271 71.378 -3.107 19707 467 1 1 . 1 1 83 83 THR H H 83 8.490 8.490 8.458 0.032 19707 468 1 1 . 1 1 84 84 VAL N N 84 122.639 122.639 125.544 -2.905 19707 469 1 1 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.837 -0.182 19707 470 1 1 . 1 1 84 84 VAL C C 84 170.962 170.962 173.865 -2.903 19707 471 1 1 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.689 -2.392 19707 472 1 1 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.666 -2.442 19707 473 1 1 . 1 1 84 84 VAL H H 84 9.001 9.001 9.071 -0.070 19707 474 1 1 . 1 1 85 85 LEU N N 85 129.903 129.903 127.825 2.078 19707 475 1 1 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.448 -0.056 19707 476 1 1 . 1 1 85 85 LEU C C 85 172.346 172.346 174.464 -2.118 19707 477 1 1 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.169 -2.372 19707 478 1 1 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.596 -4.081 19707 479 1 1 . 1 1 85 85 LEU H H 85 8.610 8.610 8.998 -0.388 19707 480 1 1 . 1 1 86 86 VAL N N 86 122.778 122.778 123.167 -0.389 19707 481 1 1 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.877 0.164 19707 482 1 1 . 1 1 86 86 VAL C C 86 172.570 172.570 174.410 -1.840 19707 483 1 1 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.173 -3.973 19707 484 1 1 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.790 -3.515 19707 485 1 1 . 1 1 86 86 VAL H H 86 9.228 9.228 9.036 0.192 19707 486 1 1 . 1 1 87 87 GLU N N 87 120.437 120.437 125.713 -5.276 19707 487 1 1 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.541 0.190 19707 488 1 1 . 1 1 87 87 GLU C C 87 172.267 172.267 175.102 -2.835 19707 489 1 1 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.341 -2.992 19707 490 1 1 . 1 1 87 87 GLU CB C 87 31.124 31.124 34.063 -2.939 19707 491 1 1 . 1 1 87 87 GLU H H 87 8.851 8.851 9.355 -0.504 19707 492 1 1 . 1 1 88 88 GLU N N 88 118.525 118.525 121.244 -2.719 19707 493 1 1 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.782 0.219 19707 494 1 1 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.217 -3.300 19707 495 1 1 . 1 1 88 88 GLU CB C 88 29.947 29.947 33.130 -3.183 19707 496 1 1 . 1 1 88 88 GLU H H 88 8.380 8.380 8.552 -0.172 19707 497 1 1 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.468 0.060 19707 498 1 1 . 1 1 89 89 PRO C C 89 172.774 172.774 176.573 -3.799 19707 499 1 1 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.062 -2.681 19707 500 1 1 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.227 -2.893 19707 501 1 2 . 1 1 2 2 SER N N 2 115.963 115.963 115.650 0.313 19707 502 1 2 . 1 1 2 2 SER HA H 2 4.408 4.408 4.362 0.046 19707 503 1 2 . 1 1 2 2 SER C C 2 171.788 171.788 175.178 -3.390 19707 504 1 2 . 1 1 2 2 SER CA C 2 55.870 55.870 58.692 -2.822 19707 505 1 2 . 1 1 2 2 SER CB C 2 61.022 61.022 63.402 -2.380 19707 506 1 2 . 1 1 2 2 SER H H 2 8.661 8.661 8.675 -0.014 19707 507 1 2 . 1 1 3 3 GLU N N 3 122.941 122.941 122.305 0.636 19707 508 1 2 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.282 0.038 19707 509 1 2 . 1 1 3 3 GLU C C 3 173.817 173.817 175.506 -1.689 19707 510 1 2 . 1 1 3 3 GLU CA C 3 53.954 53.954 57.679 -3.725 19707 511 1 2 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.097 -3.260 19707 512 1 2 . 1 1 3 3 GLU H H 3 8.706 8.706 8.198 0.508 19707 513 1 2 . 1 1 4 4 THR N N 4 116.182 116.182 117.788 -1.606 19707 514 1 2 . 1 1 4 4 THR HA H 4 4.233 4.233 4.653 -0.420 19707 515 1 2 . 1 1 4 4 THR C C 4 171.719 171.719 172.951 -1.232 19707 516 1 2 . 1 1 4 4 THR CA C 4 59.414 59.414 61.202 -1.788 19707 517 1 2 . 1 1 4 4 THR CB C 4 67.009 67.009 69.358 -2.349 19707 518 1 2 . 1 1 4 4 THR H H 4 8.165 8.165 8.192 -0.027 19707 519 1 2 . 1 1 5 5 ARG N N 5 124.184 124.184 123.353 0.831 19707 520 1 2 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.731 -0.371 19707 521 1 2 . 1 1 5 5 ARG C C 5 173.520 173.520 174.897 -1.377 19707 522 1 2 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.327 -1.984 19707 523 1 2 . 1 1 5 5 ARG CB C 5 28.165 28.165 31.960 -3.795 19707 524 1 2 . 1 1 5 5 ARG H H 5 8.354 8.354 8.386 -0.032 19707 525 1 2 . 1 1 6 6 THR N N 6 116.652 116.652 116.458 0.194 19707 526 1 2 . 1 1 6 6 THR HA H 6 4.263 4.263 4.641 -0.378 19707 527 1 2 . 1 1 6 6 THR C C 6 171.784 171.784 174.439 -2.655 19707 528 1 2 . 1 1 6 6 THR CA C 6 59.218 59.218 61.327 -2.109 19707 529 1 2 . 1 1 6 6 THR CB C 6 67.213 67.213 69.792 -2.579 19707 530 1 2 . 1 1 6 6 THR H H 6 8.224 8.224 8.238 -0.014 19707 531 1 2 . 1 1 7 7 ILE N N 7 123.882 123.882 125.554 -1.672 19707 532 1 2 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.250 -0.112 19707 533 1 2 . 1 1 7 7 ILE C C 7 173.572 173.572 177.225 -3.653 19707 534 1 2 . 1 1 7 7 ILE CA C 7 58.482 58.482 61.058 -2.576 19707 535 1 2 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.853 -2.784 19707 536 1 2 . 1 1 7 7 ILE H H 7 8.247 8.247 8.439 -0.192 19707 537 1 2 . 1 1 8 8 SER N N 8 120.287 120.287 123.815 -3.528 19707 538 1 2 . 1 1 8 8 SER HA H 8 4.445 4.445 4.484 -0.039 19707 539 1 2 . 1 1 8 8 SER C C 8 171.926 171.926 174.488 -2.562 19707 540 1 2 . 1 1 8 8 SER CA C 8 55.522 55.522 58.306 -2.784 19707 541 1 2 . 1 1 8 8 SER CB C 8 61.073 61.073 61.802 -0.729 19707 542 1 2 . 1 1 8 8 SER H H 8 8.402 8.402 8.914 -0.512 19707 543 1 2 . 1 1 9 9 SER N N 9 118.425 118.425 118.446 -0.021 19707 544 1 2 . 1 1 9 9 SER HA H 9 4.525 4.525 4.269 0.256 19707 545 1 2 . 1 1 9 9 SER C C 9 172.663 172.663 174.446 -1.783 19707 546 1 2 . 1 1 9 9 SER CA C 9 55.897 55.897 59.644 -3.747 19707 547 1 2 . 1 1 9 9 SER CB C 9 61.375 61.375 61.792 -0.417 19707 548 1 2 . 1 1 9 9 SER H H 9 8.362 8.362 8.114 0.248 19707 549 1 2 . 1 1 10 10 THR N N 10 115.676 115.676 111.729 3.947 19707 550 1 2 . 1 1 10 10 THR HA H 10 4.232 4.232 4.432 -0.200 19707 551 1 2 . 1 1 10 10 THR C C 10 173.070 173.070 175.690 -2.620 19707 552 1 2 . 1 1 10 10 THR CA C 10 60.318 60.318 62.744 -2.426 19707 553 1 2 . 1 1 10 10 THR CB C 10 67.205 67.205 69.299 -2.094 19707 554 1 2 . 1 1 10 10 THR H H 10 8.274 8.274 8.143 0.131 19707 555 1 2 . 1 1 11 11 ALA N N 11 124.726 124.726 125.302 -0.576 19707 556 1 2 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.111 -0.124 19707 557 1 2 . 1 1 11 11 ALA C C 11 176.825 176.825 179.530 -2.705 19707 558 1 2 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.038 -2.497 19707 559 1 2 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.154 -2.265 19707 560 1 2 . 1 1 11 11 ALA H H 11 8.347 8.347 8.269 0.078 19707 561 1 2 . 1 1 12 12 GLN N N 12 117.915 117.915 117.727 0.188 19707 562 1 2 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.071 -0.282 19707 563 1 2 . 1 1 12 12 GLN C C 12 174.697 174.697 177.640 -2.943 19707 564 1 2 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.113 -3.109 19707 565 1 2 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.552 -2.327 19707 566 1 2 . 1 1 12 12 GLN H H 12 8.194 8.194 8.248 -0.054 19707 567 1 2 . 1 1 13 13 GLU N N 13 118.510 118.510 118.914 -0.404 19707 568 1 2 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.117 -0.014 19707 569 1 2 . 1 1 13 13 GLU C C 13 176.192 176.192 179.209 -3.017 19707 570 1 2 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.774 -2.459 19707 571 1 2 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.687 -3.654 19707 572 1 2 . 1 1 13 13 GLU H H 13 7.917 7.917 7.772 0.145 19707 573 1 2 . 1 1 14 14 ARG N N 14 118.193 118.193 119.712 -1.519 19707 574 1 2 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.132 -0.164 19707 575 1 2 . 1 1 14 14 ARG C C 14 176.764 176.764 178.636 -1.872 19707 576 1 2 . 1 1 14 14 ARG CA C 14 57.283 57.283 58.944 -1.661 19707 577 1 2 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.621 -2.384 19707 578 1 2 . 1 1 14 14 ARG H H 14 7.907 7.907 8.220 -0.313 19707 579 1 2 . 1 1 15 15 VAL N N 15 117.991 117.991 114.650 3.341 19707 580 1 2 . 1 1 15 15 VAL HA H 15 3.903 3.903 4.040 -0.137 19707 581 1 2 . 1 1 15 15 VAL C C 15 174.922 174.922 176.948 -2.026 19707 582 1 2 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.593 -1.762 19707 583 1 2 . 1 1 15 15 VAL CB C 15 28.723 28.723 30.678 -1.955 19707 584 1 2 . 1 1 15 15 VAL H H 15 7.658 7.658 7.420 0.238 19707 585 1 2 . 1 1 16 16 ASP N N 16 124.314 124.314 120.974 3.340 19707 586 1 2 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.397 -0.081 19707 587 1 2 . 1 1 16 16 ASP C C 16 176.462 176.462 178.033 -1.571 19707 588 1 2 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.780 -2.454 19707 589 1 2 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.137 -4.468 19707 590 1 2 . 1 1 16 16 ASP H H 16 8.291 8.291 8.160 0.131 19707 591 1 2 . 1 1 17 17 LEU N N 17 120.212 120.212 119.593 0.619 19707 592 1 2 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.062 -0.008 19707 593 1 2 . 1 1 17 17 LEU C C 17 177.171 177.171 178.845 -1.674 19707 594 1 2 . 1 1 17 17 LEU CA C 17 54.980 54.980 58.178 -3.198 19707 595 1 2 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.878 -3.033 19707 596 1 2 . 1 1 17 17 LEU H H 17 8.172 8.172 7.543 0.629 19707 597 1 2 . 1 1 18 18 GLU N N 18 120.587 120.587 119.212 1.375 19707 598 1 2 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.941 0.252 19707 599 1 2 . 1 1 18 18 GLU C C 18 175.997 175.997 178.419 -2.422 19707 600 1 2 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.495 -3.393 19707 601 1 2 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.883 -2.811 19707 602 1 2 . 1 1 18 18 GLU H H 18 7.876 7.876 7.769 0.107 19707 603 1 2 . 1 1 19 19 ALA N N 19 121.800 121.800 123.002 -1.202 19707 604 1 2 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.087 -0.296 19707 605 1 2 . 1 1 19 19 ALA C C 19 175.708 175.708 179.669 -3.961 19707 606 1 2 . 1 1 19 19 ALA CA C 19 52.852 52.852 55.052 -2.200 19707 607 1 2 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.517 -4.363 19707 608 1 2 . 1 1 19 19 ALA H H 19 7.792 7.792 7.533 0.259 19707 609 1 2 . 1 1 20 20 VAL N N 20 118.680 118.680 119.195 -0.515 19707 610 1 2 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.719 -0.419 19707 611 1 2 . 1 1 20 20 VAL C C 20 176.276 176.276 178.132 -1.856 19707 612 1 2 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.317 -2.510 19707 613 1 2 . 1 1 20 20 VAL CB C 20 29.551 29.551 30.977 -1.426 19707 614 1 2 . 1 1 20 20 VAL H H 20 7.712 7.712 8.142 -0.430 19707 615 1 2 . 1 1 21 21 ARG N N 21 121.935 121.935 121.010 0.925 19707 616 1 2 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.084 -0.089 19707 617 1 2 . 1 1 21 21 ARG C C 21 176.828 176.828 178.778 -1.950 19707 618 1 2 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.511 -1.851 19707 619 1 2 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.559 -2.269 19707 620 1 2 . 1 1 21 21 ARG H H 21 8.444 8.444 8.392 0.052 19707 621 1 2 . 1 1 22 22 LEU N N 22 119.327 119.327 119.572 -0.245 19707 622 1 2 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.108 -0.113 19707 623 1 2 . 1 1 22 22 LEU C C 22 175.664 175.664 178.600 -2.936 19707 624 1 2 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.162 -3.294 19707 625 1 2 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.566 -2.431 19707 626 1 2 . 1 1 22 22 LEU H H 22 8.248 8.248 8.284 -0.036 19707 627 1 2 . 1 1 23 23 ALA N N 23 121.202 121.202 122.230 -1.028 19707 628 1 2 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.950 -0.215 19707 629 1 2 . 1 1 23 23 ALA C C 23 175.492 175.492 179.615 -4.123 19707 630 1 2 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.359 -2.290 19707 631 1 2 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.023 -3.956 19707 632 1 2 . 1 1 23 23 ALA H H 23 8.392 8.392 8.550 -0.158 19707 633 1 2 . 1 1 24 24 SER N N 24 112.377 112.377 115.096 -2.719 19707 634 1 2 . 1 1 24 24 SER HA H 24 4.214 4.214 4.286 -0.072 19707 635 1 2 . 1 1 24 24 SER C C 24 174.773 174.773 176.625 -1.852 19707 636 1 2 . 1 1 24 24 SER CA C 24 59.258 59.258 62.568 -3.310 19707 637 1 2 . 1 1 24 24 SER CB C 24 60.149 60.149 63.029 -2.880 19707 638 1 2 . 1 1 24 24 SER H H 24 7.690 7.690 8.042 -0.352 19707 639 1 2 . 1 1 25 25 ILE N N 25 123.886 123.886 122.383 1.503 19707 640 1 2 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.015 -0.173 19707 641 1 2 . 1 1 25 25 ILE C C 25 176.487 176.487 178.167 -1.680 19707 642 1 2 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.474 -0.481 19707 643 1 2 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.425 -0.493 19707 644 1 2 . 1 1 25 25 ILE H H 25 7.837 7.837 8.147 -0.310 19707 645 1 2 . 1 1 26 26 VAL N N 26 122.538 122.538 121.161 1.377 19707 646 1 2 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.658 -0.270 19707 647 1 2 . 1 1 26 26 VAL C C 26 174.624 174.624 177.722 -3.098 19707 648 1 2 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.479 -2.564 19707 649 1 2 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.309 -3.414 19707 650 1 2 . 1 1 26 26 VAL H H 26 8.804 8.804 8.643 0.161 19707 651 1 2 . 1 1 27 27 ASP N N 27 120.433 120.433 120.256 0.177 19707 652 1 2 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.306 -0.142 19707 653 1 2 . 1 1 27 27 ASP C C 27 174.966 174.966 178.413 -3.447 19707 654 1 2 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.557 -2.228 19707 655 1 2 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.668 -2.814 19707 656 1 2 . 1 1 27 27 ASP H H 27 8.719 8.719 8.508 0.211 19707 657 1 2 . 1 1 28 28 SER N N 28 112.397 112.397 115.577 -3.180 19707 658 1 2 . 1 1 28 28 SER HA H 28 4.073 4.073 4.183 -0.110 19707 659 1 2 . 1 1 28 28 SER C C 28 174.405 174.405 176.738 -2.333 19707 660 1 2 . 1 1 28 28 SER CA C 28 59.115 59.115 61.928 -2.813 19707 661 1 2 . 1 1 28 28 SER CB C 28 60.125 60.125 63.096 -2.971 19707 662 1 2 . 1 1 28 28 SER H H 28 7.599 7.599 8.185 -0.586 19707 663 1 2 . 1 1 29 29 ARG N N 29 123.945 123.945 122.419 1.526 19707 664 1 2 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.991 0.036 19707 665 1 2 . 1 1 29 29 ARG C C 29 175.902 175.902 178.111 -2.209 19707 666 1 2 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.811 -3.537 19707 667 1 2 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.052 -1.312 19707 668 1 2 . 1 1 29 29 ARG H H 29 7.769 7.769 7.701 0.068 19707 669 1 2 . 1 1 30 30 LEU N N 30 121.580 121.580 120.698 0.882 19707 670 1 2 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.989 -0.240 19707 671 1 2 . 1 1 30 30 LEU C C 30 177.474 177.474 179.614 -2.140 19707 672 1 2 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.854 -2.541 19707 673 1 2 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.825 -2.796 19707 674 1 2 . 1 1 30 30 LEU H H 30 8.665 8.665 8.319 0.346 19707 675 1 2 . 1 1 31 31 ILE N N 31 119.330 119.330 117.259 2.071 19707 676 1 2 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.770 -0.079 19707 677 1 2 . 1 1 31 31 ILE C C 31 175.341 175.341 177.763 -2.422 19707 678 1 2 . 1 1 31 31 ILE CA C 31 61.512 61.512 63.984 -2.473 19707 679 1 2 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.908 -2.341 19707 680 1 2 . 1 1 31 31 ILE H H 31 8.226 8.226 8.413 -0.187 19707 681 1 2 . 1 1 32 32 GLY N N 32 106.092 106.092 105.877 0.215 19707 682 1 2 . 1 1 32 32 GLY C C 32 172.413 172.413 174.889 -2.476 19707 683 1 2 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.591 -3.094 19707 684 1 2 . 1 1 32 32 GLY H H 32 7.767 7.767 7.711 0.056 19707 685 1 2 . 1 1 33 33 THR N N 33 110.966 110.966 112.522 -1.556 19707 686 1 2 . 1 1 33 33 THR HA H 33 4.455 4.455 4.353 0.102 19707 687 1 2 . 1 1 33 33 THR C C 33 172.714 172.714 174.743 -2.029 19707 688 1 2 . 1 1 33 33 THR CA C 33 60.032 60.032 62.385 -2.353 19707 689 1 2 . 1 1 33 33 THR CB C 33 68.287 68.287 69.758 -1.471 19707 690 1 2 . 1 1 33 33 THR H H 33 8.102 8.102 7.880 0.222 19707 691 1 2 . 1 1 34 34 GLY N N 34 110.320 110.320 110.568 -0.248 19707 692 1 2 . 1 1 34 34 GLY C C 34 170.505 170.505 173.628 -3.123 19707 693 1 2 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.034 -2.451 19707 694 1 2 . 1 1 34 34 GLY H H 34 8.072 8.072 8.166 -0.095 19707 695 1 2 . 1 1 35 35 SER N N 35 112.944 112.944 115.239 -2.295 19707 696 1 2 . 1 1 35 35 SER HA H 35 4.385 4.385 4.865 -0.480 19707 697 1 2 . 1 1 35 35 SER C C 35 169.537 169.537 172.453 -2.916 19707 698 1 2 . 1 1 35 35 SER CA C 35 54.794 54.794 57.854 -3.060 19707 699 1 2 . 1 1 35 35 SER CB C 35 62.029 62.029 66.261 -4.232 19707 700 1 2 . 1 1 35 35 SER H H 35 7.719 7.719 7.667 0.052 19707 701 1 2 . 1 1 36 36 VAL N N 36 118.566 118.566 122.778 -4.212 19707 702 1 2 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.220 -0.187 19707 703 1 2 . 1 1 36 36 VAL C C 36 169.876 169.876 173.756 -3.880 19707 704 1 2 . 1 1 36 36 VAL CA C 36 58.565 58.565 59.673 -1.108 19707 705 1 2 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.739 -2.787 19707 706 1 2 . 1 1 36 36 VAL H H 36 8.490 8.490 8.365 0.125 19707 707 1 2 . 1 1 37 37 ASP N N 37 121.640 121.640 127.386 -5.746 19707 708 1 2 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.932 -0.130 19707 709 1 2 . 1 1 37 37 ASP C C 37 172.806 172.806 176.156 -3.350 19707 710 1 2 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.764 -3.721 19707 711 1 2 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.716 -3.510 19707 712 1 2 . 1 1 37 37 ASP H H 37 7.195 7.195 8.029 -0.834 19707 713 1 2 . 1 1 38 38 GLU N N 38 120.018 120.018 120.928 -0.910 19707 714 1 2 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.922 -0.265 19707 715 1 2 . 1 1 38 38 GLU C C 38 174.753 174.753 177.964 -3.211 19707 716 1 2 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.532 -3.040 19707 717 1 2 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.809 -3.730 19707 718 1 2 . 1 1 38 38 GLU H H 38 8.908 8.908 8.800 0.108 19707 719 1 2 . 1 1 39 39 ASP N N 39 118.668 118.668 117.463 1.205 19707 720 1 2 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.480 -0.234 19707 721 1 2 . 1 1 39 39 ASP C C 39 175.393 175.393 177.500 -2.107 19707 722 1 2 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.241 -1.377 19707 723 1 2 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.530 -3.560 19707 724 1 2 . 1 1 39 39 ASP H H 39 8.242 8.242 8.637 -0.395 19707 725 1 2 . 1 1 40 40 PHE N N 40 119.851 119.851 118.881 0.970 19707 726 1 2 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.377 -0.173 19707 727 1 2 . 1 1 40 40 PHE C C 40 174.929 174.929 176.631 -1.702 19707 728 1 2 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.711 -2.540 19707 729 1 2 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.988 -3.155 19707 730 1 2 . 1 1 40 40 PHE H H 40 8.037 8.037 7.722 0.315 19707 731 1 2 . 1 1 41 41 LEU N N 41 117.882 117.882 118.707 -0.825 19707 732 1 2 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.058 -0.536 19707 733 1 2 . 1 1 41 41 LEU C C 41 175.938 175.938 178.923 -2.985 19707 734 1 2 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.984 -2.124 19707 735 1 2 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.145 -2.914 19707 736 1 2 . 1 1 41 41 LEU H H 41 7.816 7.816 7.893 -0.077 19707 737 1 2 . 1 1 42 42 ARG N N 42 118.360 118.360 118.625 -0.265 19707 738 1 2 . 1 1 42 42 ARG HA H 42 3.740 3.740 3.998 -0.258 19707 739 1 2 . 1 1 42 42 ARG C C 42 175.435 175.435 177.274 -1.839 19707 740 1 2 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.051 -2.080 19707 741 1 2 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.701 -2.437 19707 742 1 2 . 1 1 42 42 ARG H H 42 8.540 8.540 8.094 0.446 19707 743 1 2 . 1 1 43 43 GLU N N 43 114.947 114.947 117.222 -2.275 19707 744 1 2 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.269 -0.219 19707 745 1 2 . 1 1 43 43 GLU C C 43 174.518 174.518 177.460 -2.942 19707 746 1 2 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.530 -2.959 19707 747 1 2 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.307 -3.266 19707 748 1 2 . 1 1 43 43 GLU H H 43 7.223 7.223 7.886 -0.663 19707 749 1 2 . 1 1 44 44 GLN N N 44 114.109 114.109 116.979 -2.870 19707 750 1 2 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.342 -0.236 19707 751 1 2 . 1 1 44 44 GLN C C 44 173.777 173.777 177.467 -3.690 19707 752 1 2 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.440 -3.259 19707 753 1 2 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.585 -3.715 19707 754 1 2 . 1 1 44 44 GLN H H 44 7.372 7.372 7.962 -0.590 19707 755 1 2 . 1 1 45 45 ILE N N 45 117.470 117.470 115.607 1.863 19707 756 1 2 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.784 0.164 19707 757 1 2 . 1 1 45 45 ILE C C 45 172.305 172.305 177.242 -4.937 19707 758 1 2 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.975 -5.470 19707 759 1 2 . 1 1 45 45 ILE CB C 45 35.700 35.700 38.037 -2.337 19707 760 1 2 . 1 1 45 45 ILE H H 45 7.235 7.235 7.373 -0.138 19707 761 1 2 . 1 1 46 46 ARG N N 46 122.996 122.996 114.747 8.249 19707 762 1 2 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.040 0.150 19707 763 1 2 . 1 1 46 46 ARG C C 46 172.992 172.992 175.374 -2.382 19707 764 1 2 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.410 -4.649 19707 765 1 2 . 1 1 46 46 ARG CB C 46 27.952 27.952 27.791 0.161 19707 766 1 2 . 1 1 46 46 ARG H H 46 8.336 8.336 8.694 -0.358 19707 767 1 2 . 1 1 47 47 ASP N N 47 118.676 118.676 116.487 2.189 19707 768 1 2 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.701 -0.253 19707 769 1 2 . 1 1 47 47 ASP C C 47 172.520 172.520 174.756 -2.236 19707 770 1 2 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.698 -2.808 19707 771 1 2 . 1 1 47 47 ASP CB C 47 37.657 37.657 43.502 -5.845 19707 772 1 2 . 1 1 47 47 ASP H H 47 8.313 8.313 8.264 0.049 19707 773 1 2 . 1 1 48 48 ALA N N 48 120.922 120.922 123.334 -2.412 19707 774 1 2 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.230 0.139 19707 775 1 2 . 1 1 48 48 ALA C C 48 174.295 174.295 176.762 -2.467 19707 776 1 2 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.493 -2.856 19707 777 1 2 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.773 -3.559 19707 778 1 2 . 1 1 48 48 ALA H H 48 7.824 7.824 7.290 0.534 19707 779 1 2 . 1 1 49 49 ARG N N 49 118.644 118.644 120.329 -1.685 19707 780 1 2 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.141 0.201 19707 781 1 2 . 1 1 49 49 ARG C C 49 172.504 172.504 176.098 -3.594 19707 782 1 2 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.346 -3.437 19707 783 1 2 . 1 1 49 49 ARG CB C 49 28.343 28.343 31.037 -2.694 19707 784 1 2 . 1 1 49 49 ARG H H 49 7.911 7.911 8.106 -0.195 19707 785 1 2 . 1 1 50 50 TYR N N 50 119.470 119.470 115.549 3.921 19707 786 1 2 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.013 0.278 19707 787 1 2 . 1 1 50 50 TYR C C 50 170.470 170.470 174.186 -3.716 19707 788 1 2 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.065 -1.796 19707 789 1 2 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.028 -0.515 19707 790 1 2 . 1 1 50 50 TYR H H 50 7.639 7.639 7.955 -0.316 19707 791 1 2 . 1 1 51 51 ALA N N 51 127.418 127.418 126.393 1.025 19707 792 1 2 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.115 0.106 19707 793 1 2 . 1 1 51 51 ALA C C 51 171.328 171.328 175.645 -4.317 19707 794 1 2 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.488 -3.055 19707 795 1 2 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.236 -0.924 19707 796 1 2 . 1 1 51 51 ALA H H 51 8.222 8.222 8.762 -0.540 19707 797 1 2 . 1 1 52 52 VAL N N 52 117.832 117.832 121.353 -3.521 19707 798 1 2 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.212 -0.545 19707 799 1 2 . 1 1 52 52 VAL C C 52 172.436 172.436 174.219 -1.783 19707 800 1 2 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.820 -3.063 19707 801 1 2 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.311 -4.208 19707 802 1 2 . 1 1 52 52 VAL H H 52 8.753 8.753 9.059 -0.306 19707 803 1 2 . 1 1 53 53 ILE N N 53 128.027 128.027 125.701 2.326 19707 804 1 2 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.591 0.251 19707 805 1 2 . 1 1 53 53 ILE C C 53 172.110 172.110 174.235 -2.125 19707 806 1 2 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.224 -2.471 19707 807 1 2 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.398 -4.239 19707 808 1 2 . 1 1 53 53 ILE H H 53 9.261 9.261 9.014 0.247 19707 809 1 2 . 1 1 54 54 ARG N N 54 127.885 127.885 127.359 0.526 19707 810 1 2 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.700 0.053 19707 811 1 2 . 1 1 54 54 ARG C C 54 172.285 172.285 174.345 -2.060 19707 812 1 2 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.740 -1.480 19707 813 1 2 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.606 -2.714 19707 814 1 2 . 1 1 54 54 ARG H H 54 8.686 8.686 8.869 -0.183 19707 815 1 2 . 1 1 55 55 ILE N N 55 129.907 129.907 124.291 5.616 19707 816 1 2 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.394 -0.241 19707 817 1 2 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.938 -2.343 19707 818 1 2 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.166 -1.553 19707 819 1 2 . 1 1 55 55 ILE H H 55 9.292 9.292 8.334 0.958 19707 820 1 2 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.330 -0.138 19707 821 1 2 . 1 1 56 56 PRO C C 56 174.787 174.787 177.724 -2.937 19707 822 1 2 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.078 -2.344 19707 823 1 2 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.831 -2.918 19707 824 1 2 . 1 1 57 57 GLY N N 57 111.828 111.828 111.614 0.214 19707 825 1 2 . 1 1 57 57 GLY C C 57 171.039 171.039 173.563 -2.524 19707 826 1 2 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.925 -2.108 19707 827 1 2 . 1 1 57 57 GLY H H 57 8.708 8.708 8.891 -0.183 19707 828 1 2 . 1 1 58 58 GLN N N 58 118.457 118.457 119.674 -1.217 19707 829 1 2 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.770 0.130 19707 830 1 2 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.148 -2.876 19707 831 1 2 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.713 -2.559 19707 832 1 2 . 1 1 58 58 GLN H H 58 7.909 7.909 7.553 0.356 19707 833 1 2 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.409 0.027 19707 834 1 2 . 1 1 59 59 PRO C C 59 174.607 174.607 176.304 -1.697 19707 835 1 2 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.908 -2.853 19707 836 1 2 . 1 1 59 59 PRO CB C 59 29.177 29.177 31.927 -2.751 19707 837 1 2 . 1 1 60 60 VAL N N 60 122.695 122.695 122.167 0.528 19707 838 1 2 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.029 -0.074 19707 839 1 2 . 1 1 60 60 VAL C C 60 172.403 172.403 176.255 -3.852 19707 840 1 2 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.746 -1.851 19707 841 1 2 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.233 -2.591 19707 842 1 2 . 1 1 60 60 VAL H H 60 8.364 8.364 8.310 0.054 19707 843 1 2 . 1 1 61 61 VAL N N 61 126.097 126.097 127.912 -1.815 19707 844 1 2 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.287 0.013 19707 845 1 2 . 1 1 61 61 VAL C C 61 170.891 170.891 174.603 -3.712 19707 846 1 2 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.693 -2.879 19707 847 1 2 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.799 -3.601 19707 848 1 2 . 1 1 61 61 VAL H H 61 8.023 8.023 8.278 -0.255 19707 849 1 2 . 1 1 62 62 GLU N N 62 126.097 126.097 125.105 0.992 19707 850 1 2 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.030 0.129 19707 851 1 2 . 1 1 62 62 GLU C C 62 172.252 172.252 175.288 -3.036 19707 852 1 2 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.100 -3.560 19707 853 1 2 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.516 -2.216 19707 854 1 2 . 1 1 62 62 GLU H H 62 8.591 8.591 8.436 0.155 19707 855 1 2 . 1 1 63 63 VAL N N 63 120.374 120.374 123.502 -3.128 19707 856 1 2 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.196 0.197 19707 857 1 2 . 1 1 63 63 VAL C C 63 171.040 171.040 176.965 -5.925 19707 858 1 2 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.387 -3.554 19707 859 1 2 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.696 -0.119 19707 860 1 2 . 1 1 63 63 VAL H H 63 8.732 8.732 8.873 -0.141 19707 861 1 2 . 1 1 64 64 GLY N N 64 109.935 109.935 114.634 -4.699 19707 862 1 2 . 1 1 64 64 GLY C C 64 171.656 171.656 173.942 -2.286 19707 863 1 2 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.020 -4.843 19707 864 1 2 . 1 1 64 64 GLY H H 64 8.259 8.259 8.429 -0.170 19707 865 1 2 . 1 1 65 65 THR N N 65 115.478 115.478 116.442 -0.964 19707 866 1 2 . 1 1 65 65 THR HA H 65 4.342 4.342 4.404 -0.062 19707 867 1 2 . 1 1 65 65 THR C C 65 170.663 170.663 172.265 -1.602 19707 868 1 2 . 1 1 65 65 THR CA C 65 58.357 58.357 60.514 -2.157 19707 869 1 2 . 1 1 65 65 THR CB C 65 67.923 67.923 72.196 -4.273 19707 870 1 2 . 1 1 65 65 THR H H 65 8.123 8.123 7.686 0.437 19707 871 1 2 . 1 1 66 66 LYS N N 66 130.775 130.775 124.516 6.259 19707 872 1 2 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.116 -1.186 19707 873 1 2 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.484 -2.295 19707 874 1 2 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.809 -3.119 19707 875 1 2 . 1 1 66 66 LYS H H 66 8.472 8.472 8.257 0.215 19707 876 1 2 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.569 -0.158 19707 877 1 2 . 1 1 67 67 PRO C C 67 173.211 173.211 176.900 -3.689 19707 878 1 2 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.305 -2.739 19707 879 1 2 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.777 -3.374 19707 880 1 2 . 1 1 68 68 THR N N 68 111.983 111.983 114.729 -2.746 19707 881 1 2 . 1 1 68 68 THR HA H 68 4.277 4.277 4.258 0.019 19707 882 1 2 . 1 1 68 68 THR C C 68 171.720 171.720 175.816 -4.096 19707 883 1 2 . 1 1 68 68 THR CA C 68 58.193 58.193 62.093 -3.900 19707 884 1 2 . 1 1 68 68 THR CB C 68 67.723 67.723 69.399 -1.676 19707 885 1 2 . 1 1 68 68 THR H H 68 8.091 8.091 8.424 -0.333 19707 886 1 2 . 1 1 69 69 GLY N N 69 109.918 109.918 108.466 1.452 19707 887 1 2 . 1 1 69 69 GLY C C 69 170.783 170.783 174.381 -3.598 19707 888 1 2 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.731 -2.675 19707 889 1 2 . 1 1 69 69 GLY H H 69 8.119 8.119 7.809 0.310 19707 890 1 2 . 1 1 70 70 ASP N N 70 123.294 123.294 124.661 -1.367 19707 891 1 2 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.856 -0.307 19707 892 1 2 . 1 1 70 70 ASP C C 70 173.651 173.651 175.085 -1.434 19707 893 1 2 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.683 -2.822 19707 894 1 2 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.539 -1.806 19707 895 1 2 . 1 1 70 70 ASP H H 70 8.444 8.444 8.704 -0.260 19707 896 1 2 . 1 1 71 71 VAL N N 71 117.772 117.772 114.345 3.427 19707 897 1 2 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.076 -0.369 19707 898 1 2 . 1 1 71 71 VAL C C 71 172.992 172.992 174.212 -1.220 19707 899 1 2 . 1 1 71 71 VAL CA C 71 57.376 57.376 58.923 -1.547 19707 900 1 2 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.443 -2.421 19707 901 1 2 . 1 1 71 71 VAL H H 71 8.173 8.173 7.807 0.366 19707 902 1 2 . 1 1 72 72 LEU N N 72 123.435 123.435 122.472 0.963 19707 903 1 2 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.710 -0.074 19707 904 1 2 . 1 1 72 72 LEU C C 72 173.189 173.189 176.009 -2.820 19707 905 1 2 . 1 1 72 72 LEU CA C 72 51.207 51.207 53.972 -2.765 19707 906 1 2 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.953 -1.315 19707 907 1 2 . 1 1 72 72 LEU H H 72 8.859 8.859 8.949 -0.090 19707 908 1 2 . 1 1 73 73 GLN N N 73 119.520 119.520 122.792 -3.272 19707 909 1 2 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.164 0.181 19707 910 1 2 . 1 1 73 73 GLN C C 73 172.249 172.249 175.928 -3.679 19707 911 1 2 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.446 -3.113 19707 912 1 2 . 1 1 73 73 GLN CB C 73 29.770 29.770 30.681 -0.911 19707 913 1 2 . 1 1 73 73 GLN H H 73 9.196 9.196 8.328 0.868 19707 914 1 2 . 1 1 74 74 GLY N N 74 113.513 113.513 111.988 1.525 19707 915 1 2 . 1 1 74 74 GLY C C 74 169.072 169.072 172.048 -2.976 19707 916 1 2 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.972 -2.675 19707 917 1 2 . 1 1 74 74 GLY H H 74 9.373 9.373 8.994 0.379 19707 918 1 2 . 1 1 75 75 ARG N N 75 122.479 122.479 123.448 -0.969 19707 919 1 2 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.286 0.216 19707 920 1 2 . 1 1 75 75 ARG C C 75 172.348 172.348 173.986 -1.638 19707 921 1 2 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.805 -4.047 19707 922 1 2 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.006 -2.188 19707 923 1 2 . 1 1 75 75 ARG H H 75 8.615 8.615 8.318 0.297 19707 924 1 2 . 1 1 76 76 ALA N N 76 122.346 122.346 128.161 -5.815 19707 925 1 2 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.810 -0.274 19707 926 1 2 . 1 1 76 76 ALA C C 76 172.704 172.704 174.851 -2.147 19707 927 1 2 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.350 -2.323 19707 928 1 2 . 1 1 76 76 ALA CB C 76 20.025 20.025 23.064 -3.039 19707 929 1 2 . 1 1 76 76 ALA H H 76 8.590 8.590 9.147 -0.557 19707 930 1 2 . 1 1 77 77 THR N N 77 116.961 116.961 116.722 0.239 19707 931 1 2 . 1 1 77 77 THR HA H 77 4.988 4.988 5.086 -0.098 19707 932 1 2 . 1 1 77 77 THR C C 77 172.800 172.800 174.810 -2.010 19707 933 1 2 . 1 1 77 77 THR CA C 77 58.344 58.344 60.872 -2.528 19707 934 1 2 . 1 1 77 77 THR CB C 77 67.712 67.712 70.499 -2.787 19707 935 1 2 . 1 1 77 77 THR H H 77 8.491 8.491 8.317 0.174 19707 936 1 2 . 1 1 78 78 GLY N N 78 111.103 111.103 112.411 -1.308 19707 937 1 2 . 1 1 78 78 GLY C C 78 172.567 172.567 174.928 -2.361 19707 938 1 2 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.764 -2.455 19707 939 1 2 . 1 1 78 78 GLY H H 78 8.649 8.649 8.643 0.006 19707 940 1 2 . 1 1 79 79 GLU N N 79 123.423 123.423 119.393 4.030 19707 941 1 2 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.329 -0.333 19707 942 1 2 . 1 1 79 79 GLU C C 79 175.466 175.466 177.388 -1.922 19707 943 1 2 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.959 -2.500 19707 944 1 2 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.592 -3.525 19707 945 1 2 . 1 1 79 79 GLU H H 79 10.375 10.375 8.775 1.600 19707 946 1 2 . 1 1 80 80 GLU N N 80 113.846 113.846 117.290 -3.444 19707 947 1 2 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.439 -0.081 19707 948 1 2 . 1 1 80 80 GLU C C 80 173.293 173.293 176.981 -3.688 19707 949 1 2 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.953 -4.177 19707 950 1 2 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.568 -4.837 19707 951 1 2 . 1 1 80 80 GLU H H 80 7.679 7.679 8.474 -0.795 19707 952 1 2 . 1 1 81 81 GLY N N 81 105.493 105.493 109.057 -3.564 19707 953 1 2 . 1 1 81 81 GLY C C 81 170.427 170.427 174.179 -3.752 19707 954 1 2 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.080 -2.468 19707 955 1 2 . 1 1 81 81 GLY H H 81 7.476 7.476 7.686 -0.210 19707 956 1 2 . 1 1 82 82 GLU N N 82 122.160 122.160 118.974 3.186 19707 957 1 2 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.400 0.554 19707 958 1 2 . 1 1 82 82 GLU C C 82 171.004 171.004 175.648 -4.644 19707 959 1 2 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.579 -4.258 19707 960 1 2 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.227 -5.161 19707 961 1 2 . 1 1 82 82 GLU H H 82 9.585 9.585 7.962 1.623 19707 962 1 2 . 1 1 83 83 THR N N 83 114.756 114.756 115.718 -0.962 19707 963 1 2 . 1 1 83 83 THR HA H 83 4.990 4.990 5.105 -0.115 19707 964 1 2 . 1 1 83 83 THR C C 83 170.909 170.909 173.027 -2.118 19707 965 1 2 . 1 1 83 83 THR CA C 83 57.957 57.957 61.935 -3.978 19707 966 1 2 . 1 1 83 83 THR CB C 83 68.271 68.271 71.608 -3.337 19707 967 1 2 . 1 1 83 83 THR H H 83 8.490 8.490 8.514 -0.024 19707 968 1 2 . 1 1 84 84 VAL N N 84 122.639 122.639 126.432 -3.793 19707 969 1 2 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.769 -0.114 19707 970 1 2 . 1 1 84 84 VAL C C 84 170.962 170.962 173.956 -2.994 19707 971 1 2 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.180 -2.883 19707 972 1 2 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.470 -2.246 19707 973 1 2 . 1 1 84 84 VAL H H 84 9.001 9.001 9.028 -0.027 19707 974 1 2 . 1 1 85 85 LEU N N 85 129.903 129.903 127.647 2.256 19707 975 1 2 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.504 -0.112 19707 976 1 2 . 1 1 85 85 LEU C C 85 172.346 172.346 174.631 -2.285 19707 977 1 2 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.218 -2.421 19707 978 1 2 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.889 -4.374 19707 979 1 2 . 1 1 85 85 LEU H H 85 8.610 8.610 8.980 -0.370 19707 980 1 2 . 1 1 86 86 VAL N N 86 122.778 122.778 124.009 -1.231 19707 981 1 2 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.923 0.118 19707 982 1 2 . 1 1 86 86 VAL C C 86 172.570 172.570 174.544 -1.974 19707 983 1 2 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.051 -3.851 19707 984 1 2 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.299 -3.024 19707 985 1 2 . 1 1 86 86 VAL H H 86 9.228 9.228 9.084 0.144 19707 986 1 2 . 1 1 87 87 GLU N N 87 120.437 120.437 126.350 -5.913 19707 987 1 2 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.588 0.143 19707 988 1 2 . 1 1 87 87 GLU C C 87 172.267 172.267 174.878 -2.611 19707 989 1 2 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.452 -3.103 19707 990 1 2 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.983 -2.860 19707 991 1 2 . 1 1 87 87 GLU H H 87 8.851 8.851 9.122 -0.271 19707 992 1 2 . 1 1 88 88 GLU N N 88 118.525 118.525 120.325 -1.800 19707 993 1 2 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.671 0.330 19707 994 1 2 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.879 -2.962 19707 995 1 2 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.189 -1.242 19707 996 1 2 . 1 1 88 88 GLU H H 88 8.380 8.380 8.468 -0.088 19707 997 1 2 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.334 0.195 19707 998 1 2 . 1 1 89 89 PRO C C 89 172.774 172.774 176.851 -4.077 19707 999 1 2 . 1 1 89 89 PRO CA C 89 60.381 60.381 62.900 -2.519 19707 1000 1 2 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.238 -2.904 19707 1001 1 3 . 1 1 2 2 SER N N 2 115.963 115.963 115.429 0.534 19707 1002 1 3 . 1 1 2 2 SER HA H 2 4.408 4.408 4.589 -0.181 19707 1003 1 3 . 1 1 2 2 SER C C 2 171.788 171.788 173.704 -1.916 19707 1004 1 3 . 1 1 2 2 SER CA C 2 55.870 55.870 57.512 -1.642 19707 1005 1 3 . 1 1 2 2 SER CB C 2 61.022 61.022 64.973 -3.951 19707 1006 1 3 . 1 1 2 2 SER H H 2 8.661 8.661 8.211 0.450 19707 1007 1 3 . 1 1 3 3 GLU N N 3 122.941 122.941 121.799 1.142 19707 1008 1 3 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.398 -0.078 19707 1009 1 3 . 1 1 3 3 GLU C C 3 173.817 173.817 176.679 -2.862 19707 1010 1 3 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.131 -2.177 19707 1011 1 3 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.162 -3.325 19707 1012 1 3 . 1 1 3 3 GLU H H 3 8.706 8.706 8.393 0.313 19707 1013 1 3 . 1 1 4 4 THR N N 4 116.182 116.182 116.348 -0.166 19707 1014 1 3 . 1 1 4 4 THR HA H 4 4.233 4.233 4.254 -0.021 19707 1015 1 3 . 1 1 4 4 THR C C 4 171.719 171.719 175.103 -3.384 19707 1016 1 3 . 1 1 4 4 THR CA C 4 59.414 59.414 62.742 -3.328 19707 1017 1 3 . 1 1 4 4 THR CB C 4 67.009 67.009 69.225 -2.216 19707 1018 1 3 . 1 1 4 4 THR H H 4 8.165 8.165 8.333 -0.168 19707 1019 1 3 . 1 1 5 5 ARG N N 5 124.184 124.184 125.124 -0.940 19707 1020 1 3 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.338 0.022 19707 1021 1 3 . 1 1 5 5 ARG C C 5 173.520 173.520 175.971 -2.451 19707 1022 1 3 . 1 1 5 5 ARG CA C 5 53.343 53.343 56.115 -2.772 19707 1023 1 3 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.351 -2.186 19707 1024 1 3 . 1 1 5 5 ARG H H 5 8.354 8.354 8.379 -0.025 19707 1025 1 3 . 1 1 6 6 THR N N 6 116.652 116.652 119.859 -3.207 19707 1026 1 3 . 1 1 6 6 THR HA H 6 4.263 4.263 4.163 0.100 19707 1027 1 3 . 1 1 6 6 THR C C 6 171.784 171.784 175.251 -3.467 19707 1028 1 3 . 1 1 6 6 THR CA C 6 59.218 59.218 63.177 -3.959 19707 1029 1 3 . 1 1 6 6 THR CB C 6 67.213 67.213 69.361 -2.147 19707 1030 1 3 . 1 1 6 6 THR H H 6 8.224 8.224 8.359 -0.135 19707 1031 1 3 . 1 1 7 7 ILE N N 7 123.882 123.882 124.412 -0.530 19707 1032 1 3 . 1 1 7 7 ILE HA H 7 4.138 4.138 3.986 0.152 19707 1033 1 3 . 1 1 7 7 ILE C C 7 173.572 173.572 176.970 -3.398 19707 1034 1 3 . 1 1 7 7 ILE CA C 7 58.482 58.482 62.000 -3.518 19707 1035 1 3 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.556 -2.487 19707 1036 1 3 . 1 1 7 7 ILE H H 7 8.247 8.247 8.155 0.092 19707 1037 1 3 . 1 1 8 8 SER N N 8 120.287 120.287 121.500 -1.213 19707 1038 1 3 . 1 1 8 8 SER HA H 8 4.445 4.445 4.470 -0.025 19707 1039 1 3 . 1 1 8 8 SER C C 8 171.926 171.926 174.754 -2.828 19707 1040 1 3 . 1 1 8 8 SER CA C 8 55.522 55.522 57.715 -2.193 19707 1041 1 3 . 1 1 8 8 SER CB C 8 61.073 61.073 63.132 -2.059 19707 1042 1 3 . 1 1 8 8 SER H H 8 8.402 8.402 8.634 -0.232 19707 1043 1 3 . 1 1 9 9 SER N N 9 118.425 118.425 118.882 -0.457 19707 1044 1 3 . 1 1 9 9 SER HA H 9 4.525 4.525 4.376 0.149 19707 1045 1 3 . 1 1 9 9 SER C C 9 172.663 172.663 174.279 -1.616 19707 1046 1 3 . 1 1 9 9 SER CA C 9 55.897 55.897 59.907 -4.010 19707 1047 1 3 . 1 1 9 9 SER CB C 9 61.375 61.375 61.510 -0.134 19707 1048 1 3 . 1 1 9 9 SER H H 9 8.362 8.362 8.619 -0.257 19707 1049 1 3 . 1 1 10 10 THR N N 10 115.676 115.676 112.130 3.546 19707 1050 1 3 . 1 1 10 10 THR HA H 10 4.232 4.232 4.525 -0.293 19707 1051 1 3 . 1 1 10 10 THR C C 10 173.070 173.070 175.243 -2.173 19707 1052 1 3 . 1 1 10 10 THR CA C 10 60.318 60.318 62.712 -2.393 19707 1053 1 3 . 1 1 10 10 THR CB C 10 67.205 67.205 69.484 -2.279 19707 1054 1 3 . 1 1 10 10 THR H H 10 8.274 8.274 8.200 0.074 19707 1055 1 3 . 1 1 11 11 ALA N N 11 124.726 124.726 125.274 -0.548 19707 1056 1 3 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.034 -0.047 19707 1057 1 3 . 1 1 11 11 ALA C C 11 176.825 176.825 179.334 -2.509 19707 1058 1 3 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.081 -2.541 19707 1059 1 3 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.284 -2.395 19707 1060 1 3 . 1 1 11 11 ALA H H 11 8.347 8.347 8.515 -0.168 19707 1061 1 3 . 1 1 12 12 GLN N N 12 117.915 117.915 118.332 -0.417 19707 1062 1 3 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.066 -0.277 19707 1063 1 3 . 1 1 12 12 GLN C C 12 174.697 174.697 178.232 -3.535 19707 1064 1 3 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.248 -3.244 19707 1065 1 3 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.508 -2.283 19707 1066 1 3 . 1 1 12 12 GLN H H 12 8.194 8.194 8.363 -0.169 19707 1067 1 3 . 1 1 13 13 GLU N N 13 118.510 118.510 120.210 -1.700 19707 1068 1 3 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.052 0.051 19707 1069 1 3 . 1 1 13 13 GLU C C 13 176.192 176.192 178.786 -2.594 19707 1070 1 3 . 1 1 13 13 GLU CA C 13 56.315 56.315 59.172 -2.857 19707 1071 1 3 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.508 -3.474 19707 1072 1 3 . 1 1 13 13 GLU H H 13 7.917 7.917 7.806 0.111 19707 1073 1 3 . 1 1 14 14 ARG N N 14 118.193 118.193 119.094 -0.901 19707 1074 1 3 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.054 -0.086 19707 1075 1 3 . 1 1 14 14 ARG C C 14 176.764 176.764 178.678 -1.914 19707 1076 1 3 . 1 1 14 14 ARG CA C 14 57.283 57.283 58.971 -1.688 19707 1077 1 3 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.553 -2.316 19707 1078 1 3 . 1 1 14 14 ARG H H 14 7.907 7.907 8.190 -0.283 19707 1079 1 3 . 1 1 15 15 VAL N N 15 117.991 117.991 119.165 -1.174 19707 1080 1 3 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.878 0.025 19707 1081 1 3 . 1 1 15 15 VAL C C 15 174.922 174.922 178.164 -3.242 19707 1082 1 3 . 1 1 15 15 VAL CA C 15 62.831 62.831 66.464 -3.633 19707 1083 1 3 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.356 -2.633 19707 1084 1 3 . 1 1 15 15 VAL H H 15 7.658 7.658 7.913 -0.255 19707 1085 1 3 . 1 1 16 16 ASP N N 16 124.314 124.314 120.496 3.818 19707 1086 1 3 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.486 -0.170 19707 1087 1 3 . 1 1 16 16 ASP C C 16 176.462 176.462 178.300 -1.838 19707 1088 1 3 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.132 -1.806 19707 1089 1 3 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.114 -4.445 19707 1090 1 3 . 1 1 16 16 ASP H H 16 8.291 8.291 7.696 0.595 19707 1091 1 3 . 1 1 17 17 LEU N N 17 120.212 120.212 119.327 0.885 19707 1092 1 3 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.188 -0.134 19707 1093 1 3 . 1 1 17 17 LEU C C 17 177.171 177.171 178.905 -1.734 19707 1094 1 3 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.351 -2.371 19707 1095 1 3 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.532 -2.687 19707 1096 1 3 . 1 1 17 17 LEU H H 17 8.172 8.172 7.487 0.685 19707 1097 1 3 . 1 1 18 18 GLU N N 18 120.587 120.587 119.736 0.851 19707 1098 1 3 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.998 0.195 19707 1099 1 3 . 1 1 18 18 GLU C C 18 175.997 175.997 178.547 -2.550 19707 1100 1 3 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.529 -3.427 19707 1101 1 3 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.814 -2.742 19707 1102 1 3 . 1 1 18 18 GLU H H 18 7.876 7.876 8.208 -0.332 19707 1103 1 3 . 1 1 19 19 ALA N N 19 121.800 121.800 122.562 -0.762 19707 1104 1 3 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.126 -0.335 19707 1105 1 3 . 1 1 19 19 ALA C C 19 175.708 175.708 179.346 -3.638 19707 1106 1 3 . 1 1 19 19 ALA CA C 19 52.852 52.852 55.486 -2.634 19707 1107 1 3 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.016 -3.862 19707 1108 1 3 . 1 1 19 19 ALA H H 19 7.792 7.792 7.682 0.110 19707 1109 1 3 . 1 1 20 20 VAL N N 20 118.680 118.680 119.209 -0.529 19707 1110 1 3 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.750 -0.450 19707 1111 1 3 . 1 1 20 20 VAL C C 20 176.276 176.276 177.943 -1.667 19707 1112 1 3 . 1 1 20 20 VAL CA C 20 63.807 63.807 65.650 -1.843 19707 1113 1 3 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.030 -1.479 19707 1114 1 3 . 1 1 20 20 VAL H H 20 7.712 7.712 7.659 0.053 19707 1115 1 3 . 1 1 21 21 ARG N N 21 121.935 121.935 121.248 0.687 19707 1116 1 3 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.086 -0.091 19707 1117 1 3 . 1 1 21 21 ARG C C 21 176.828 176.828 178.776 -1.948 19707 1118 1 3 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.658 -1.998 19707 1119 1 3 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.609 -2.319 19707 1120 1 3 . 1 1 21 21 ARG H H 21 8.444 8.444 8.298 0.146 19707 1121 1 3 . 1 1 22 22 LEU N N 22 119.327 119.327 119.450 -0.123 19707 1122 1 3 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.121 -0.126 19707 1123 1 3 . 1 1 22 22 LEU C C 22 175.664 175.664 178.618 -2.954 19707 1124 1 3 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.134 -3.266 19707 1125 1 3 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.562 -2.427 19707 1126 1 3 . 1 1 22 22 LEU H H 22 8.248 8.248 8.297 -0.049 19707 1127 1 3 . 1 1 23 23 ALA N N 23 121.202 121.202 122.192 -0.990 19707 1128 1 3 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.976 -0.241 19707 1129 1 3 . 1 1 23 23 ALA C C 23 175.492 175.492 179.630 -4.138 19707 1130 1 3 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.305 -2.236 19707 1131 1 3 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.019 -3.952 19707 1132 1 3 . 1 1 23 23 ALA H H 23 8.392 8.392 8.513 -0.121 19707 1133 1 3 . 1 1 24 24 SER N N 24 112.377 112.377 114.929 -2.552 19707 1134 1 3 . 1 1 24 24 SER HA H 24 4.214 4.214 4.283 -0.069 19707 1135 1 3 . 1 1 24 24 SER C C 24 174.773 174.773 176.291 -1.518 19707 1136 1 3 . 1 1 24 24 SER CA C 24 59.258 59.258 62.574 -3.316 19707 1137 1 3 . 1 1 24 24 SER CB C 24 60.149 60.149 63.140 -2.991 19707 1138 1 3 . 1 1 24 24 SER H H 24 7.690 7.690 7.943 -0.253 19707 1139 1 3 . 1 1 25 25 ILE N N 25 123.886 123.886 122.677 1.209 19707 1140 1 3 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.003 -0.161 19707 1141 1 3 . 1 1 25 25 ILE C C 25 176.487 176.487 178.059 -1.572 19707 1142 1 3 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.373 -0.380 19707 1143 1 3 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.453 -0.521 19707 1144 1 3 . 1 1 25 25 ILE H H 25 7.837 7.837 8.179 -0.342 19707 1145 1 3 . 1 1 26 26 VAL N N 26 122.538 122.538 121.559 0.979 19707 1146 1 3 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.528 -0.140 19707 1147 1 3 . 1 1 26 26 VAL C C 26 174.624 174.624 177.477 -2.853 19707 1148 1 3 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.583 -2.668 19707 1149 1 3 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.439 -3.544 19707 1150 1 3 . 1 1 26 26 VAL H H 26 8.804 8.804 8.695 0.109 19707 1151 1 3 . 1 1 27 27 ASP N N 27 120.433 120.433 119.819 0.614 19707 1152 1 3 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.311 -0.147 19707 1153 1 3 . 1 1 27 27 ASP C C 27 174.966 174.966 178.455 -3.489 19707 1154 1 3 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.485 -2.156 19707 1155 1 3 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.728 -2.874 19707 1156 1 3 . 1 1 27 27 ASP H H 27 8.719 8.719 8.396 0.323 19707 1157 1 3 . 1 1 28 28 SER N N 28 112.397 112.397 115.964 -3.567 19707 1158 1 3 . 1 1 28 28 SER HA H 28 4.073 4.073 4.157 -0.084 19707 1159 1 3 . 1 1 28 28 SER C C 28 174.405 174.405 176.732 -2.327 19707 1160 1 3 . 1 1 28 28 SER CA C 28 59.115 59.115 62.053 -2.938 19707 1161 1 3 . 1 1 28 28 SER CB C 28 60.125 60.125 63.102 -2.977 19707 1162 1 3 . 1 1 28 28 SER H H 28 7.599 7.599 8.131 -0.532 19707 1163 1 3 . 1 1 29 29 ARG N N 29 123.945 123.945 122.383 1.562 19707 1164 1 3 . 1 1 29 29 ARG HA H 29 4.027 4.027 4.048 -0.021 19707 1165 1 3 . 1 1 29 29 ARG C C 29 175.902 175.902 178.156 -2.254 19707 1166 1 3 . 1 1 29 29 ARG CA C 29 54.274 54.274 58.065 -3.791 19707 1167 1 3 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.259 -1.519 19707 1168 1 3 . 1 1 29 29 ARG H H 29 7.769 7.769 7.939 -0.170 19707 1169 1 3 . 1 1 30 30 LEU N N 30 121.580 121.580 120.149 1.431 19707 1170 1 3 . 1 1 30 30 LEU HA H 30 3.749 3.749 4.057 -0.308 19707 1171 1 3 . 1 1 30 30 LEU C C 30 177.474 177.474 179.672 -2.198 19707 1172 1 3 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.731 -2.418 19707 1173 1 3 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.790 -2.761 19707 1174 1 3 . 1 1 30 30 LEU H H 30 8.665 8.665 8.309 0.356 19707 1175 1 3 . 1 1 31 31 ILE N N 31 119.330 119.330 117.801 1.529 19707 1176 1 3 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.753 -0.062 19707 1177 1 3 . 1 1 31 31 ILE C C 31 175.341 175.341 177.794 -2.453 19707 1178 1 3 . 1 1 31 31 ILE CA C 31 61.512 61.512 63.974 -2.462 19707 1179 1 3 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.926 -2.359 19707 1180 1 3 . 1 1 31 31 ILE H H 31 8.226 8.226 8.318 -0.092 19707 1181 1 3 . 1 1 32 32 GLY N N 32 106.092 106.092 106.060 0.032 19707 1182 1 3 . 1 1 32 32 GLY C C 32 172.413 172.413 174.931 -2.518 19707 1183 1 3 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.654 -3.157 19707 1184 1 3 . 1 1 32 32 GLY H H 32 7.767 7.767 7.846 -0.079 19707 1185 1 3 . 1 1 33 33 THR N N 33 110.966 110.966 112.879 -1.913 19707 1186 1 3 . 1 1 33 33 THR HA H 33 4.455 4.455 4.365 0.090 19707 1187 1 3 . 1 1 33 33 THR C C 33 172.714 172.714 174.796 -2.082 19707 1188 1 3 . 1 1 33 33 THR CA C 33 60.032 60.032 62.349 -2.317 19707 1189 1 3 . 1 1 33 33 THR CB C 33 68.287 68.287 69.815 -1.528 19707 1190 1 3 . 1 1 33 33 THR H H 33 8.102 8.102 7.908 0.194 19707 1191 1 3 . 1 1 34 34 GLY N N 34 110.320 110.320 110.642 -0.322 19707 1192 1 3 . 1 1 34 34 GLY C C 34 170.505 170.505 173.837 -3.332 19707 1193 1 3 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.117 -2.534 19707 1194 1 3 . 1 1 34 34 GLY H H 34 8.072 8.072 8.065 0.007 19707 1195 1 3 . 1 1 35 35 SER N N 35 112.944 112.944 114.772 -1.828 19707 1196 1 3 . 1 1 35 35 SER HA H 35 4.385 4.385 4.765 -0.380 19707 1197 1 3 . 1 1 35 35 SER C C 35 169.537 169.537 172.240 -2.703 19707 1198 1 3 . 1 1 35 35 SER CA C 35 54.794 54.794 57.949 -3.155 19707 1199 1 3 . 1 1 35 35 SER CB C 35 62.029 62.029 66.510 -4.481 19707 1200 1 3 . 1 1 35 35 SER H H 35 7.719 7.719 7.676 0.043 19707 1201 1 3 . 1 1 36 36 VAL N N 36 118.566 118.566 121.622 -3.056 19707 1202 1 3 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.224 -0.191 19707 1203 1 3 . 1 1 36 36 VAL C C 36 169.876 169.876 173.894 -4.018 19707 1204 1 3 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.222 -1.657 19707 1205 1 3 . 1 1 36 36 VAL CB C 36 30.952 30.952 34.356 -3.404 19707 1206 1 3 . 1 1 36 36 VAL H H 36 8.490 8.490 8.392 0.098 19707 1207 1 3 . 1 1 37 37 ASP N N 37 121.640 121.640 125.438 -3.798 19707 1208 1 3 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.908 -0.106 19707 1209 1 3 . 1 1 37 37 ASP C C 37 172.806 172.806 176.176 -3.370 19707 1210 1 3 . 1 1 37 37 ASP CA C 37 49.043 49.043 53.061 -4.018 19707 1211 1 3 . 1 1 37 37 ASP CB C 37 40.206 40.206 44.350 -4.144 19707 1212 1 3 . 1 1 37 37 ASP H H 37 7.195 7.195 8.321 -1.126 19707 1213 1 3 . 1 1 38 38 GLU N N 38 120.018 120.018 121.200 -1.182 19707 1214 1 3 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.884 -0.227 19707 1215 1 3 . 1 1 38 38 GLU C C 38 174.753 174.753 177.668 -2.915 19707 1216 1 3 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.489 -2.997 19707 1217 1 3 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.880 -3.801 19707 1218 1 3 . 1 1 38 38 GLU H H 38 8.908 8.908 8.947 -0.039 19707 1219 1 3 . 1 1 39 39 ASP N N 39 118.668 118.668 117.363 1.305 19707 1220 1 3 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.481 -0.235 19707 1221 1 3 . 1 1 39 39 ASP C C 39 175.393 175.393 177.298 -1.905 19707 1222 1 3 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.218 -1.354 19707 1223 1 3 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.547 -3.577 19707 1224 1 3 . 1 1 39 39 ASP H H 39 8.242 8.242 8.645 -0.403 19707 1225 1 3 . 1 1 40 40 PHE N N 40 119.851 119.851 118.355 1.496 19707 1226 1 3 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.417 -0.213 19707 1227 1 3 . 1 1 40 40 PHE C C 40 174.929 174.929 176.489 -1.560 19707 1228 1 3 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.517 -2.346 19707 1229 1 3 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.033 -3.200 19707 1230 1 3 . 1 1 40 40 PHE H H 40 8.037 8.037 7.715 0.322 19707 1231 1 3 . 1 1 41 41 LEU N N 41 117.882 117.882 118.861 -0.979 19707 1232 1 3 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.130 -0.608 19707 1233 1 3 . 1 1 41 41 LEU C C 41 175.938 175.938 178.849 -2.911 19707 1234 1 3 . 1 1 41 41 LEU CA C 41 54.860 54.860 57.154 -2.294 19707 1235 1 3 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.285 -3.054 19707 1236 1 3 . 1 1 41 41 LEU H H 41 7.816 7.816 8.020 -0.204 19707 1237 1 3 . 1 1 42 42 ARG N N 42 118.360 118.360 118.721 -0.361 19707 1238 1 3 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.008 -0.268 19707 1239 1 3 . 1 1 42 42 ARG C C 42 175.435 175.435 177.169 -1.734 19707 1240 1 3 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.046 -2.075 19707 1241 1 3 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.772 -2.508 19707 1242 1 3 . 1 1 42 42 ARG H H 42 8.540 8.540 8.148 0.392 19707 1243 1 3 . 1 1 43 43 GLU N N 43 114.947 114.947 117.075 -2.128 19707 1244 1 3 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.246 -0.196 19707 1245 1 3 . 1 1 43 43 GLU C C 43 174.518 174.518 177.768 -3.250 19707 1246 1 3 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.614 -3.043 19707 1247 1 3 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.080 -3.039 19707 1248 1 3 . 1 1 43 43 GLU H H 43 7.223 7.223 7.937 -0.714 19707 1249 1 3 . 1 1 44 44 GLN N N 44 114.109 114.109 117.223 -3.114 19707 1250 1 3 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.303 -0.197 19707 1251 1 3 . 1 1 44 44 GLN C C 44 173.777 173.777 177.579 -3.802 19707 1252 1 3 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.762 -3.581 19707 1253 1 3 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.345 -3.475 19707 1254 1 3 . 1 1 44 44 GLN H H 44 7.372 7.372 8.090 -0.718 19707 1255 1 3 . 1 1 45 45 ILE N N 45 117.470 117.470 116.105 1.365 19707 1256 1 3 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.828 0.120 19707 1257 1 3 . 1 1 45 45 ILE C C 45 172.305 172.305 177.500 -5.195 19707 1258 1 3 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.760 -5.255 19707 1259 1 3 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.762 -2.062 19707 1260 1 3 . 1 1 45 45 ILE H H 45 7.235 7.235 7.499 -0.264 19707 1261 1 3 . 1 1 46 46 ARG N N 46 122.996 122.996 115.432 7.564 19707 1262 1 3 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.983 0.207 19707 1263 1 3 . 1 1 46 46 ARG C C 46 172.992 172.992 175.595 -2.603 19707 1264 1 3 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.129 -4.368 19707 1265 1 3 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.613 -0.661 19707 1266 1 3 . 1 1 46 46 ARG H H 46 8.336 8.336 8.634 -0.298 19707 1267 1 3 . 1 1 47 47 ASP N N 47 118.676 118.676 116.160 2.516 19707 1268 1 3 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.660 -0.212 19707 1269 1 3 . 1 1 47 47 ASP C C 47 172.520 172.520 175.002 -2.482 19707 1270 1 3 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.235 -2.345 19707 1271 1 3 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.706 -5.049 19707 1272 1 3 . 1 1 47 47 ASP H H 47 8.313 8.313 8.049 0.264 19707 1273 1 3 . 1 1 48 48 ALA N N 48 120.922 120.922 123.589 -2.667 19707 1274 1 3 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.472 -0.103 19707 1275 1 3 . 1 1 48 48 ALA C C 48 174.295 174.295 177.216 -2.921 19707 1276 1 3 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.159 -2.522 19707 1277 1 3 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.519 -3.305 19707 1278 1 3 . 1 1 48 48 ALA H H 48 7.824 7.824 7.300 0.524 19707 1279 1 3 . 1 1 49 49 ARG N N 49 118.644 118.644 119.808 -1.164 19707 1280 1 3 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.051 0.291 19707 1281 1 3 . 1 1 49 49 ARG C C 49 172.504 172.504 176.541 -4.037 19707 1282 1 3 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.605 -3.696 19707 1283 1 3 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.499 -2.156 19707 1284 1 3 . 1 1 49 49 ARG H H 49 7.911 7.911 8.678 -0.767 19707 1285 1 3 . 1 1 50 50 TYR N N 50 119.470 119.470 114.685 4.785 19707 1286 1 3 . 1 1 50 50 TYR HA H 50 5.291 5.291 4.968 0.323 19707 1287 1 3 . 1 1 50 50 TYR C C 50 170.470 170.470 174.303 -3.833 19707 1288 1 3 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.092 -1.824 19707 1289 1 3 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.000 -0.487 19707 1290 1 3 . 1 1 50 50 TYR H H 50 7.639 7.639 7.853 -0.214 19707 1291 1 3 . 1 1 51 51 ALA N N 51 127.418 127.418 125.514 1.904 19707 1292 1 3 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.078 0.143 19707 1293 1 3 . 1 1 51 51 ALA C C 51 171.328 171.328 175.601 -4.273 19707 1294 1 3 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.461 -3.028 19707 1295 1 3 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.883 -1.571 19707 1296 1 3 . 1 1 51 51 ALA H H 51 8.222 8.222 8.511 -0.289 19707 1297 1 3 . 1 1 52 52 VAL N N 52 117.832 117.832 121.518 -3.686 19707 1298 1 3 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.162 -0.495 19707 1299 1 3 . 1 1 52 52 VAL C C 52 172.436 172.436 174.294 -1.858 19707 1300 1 3 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.365 -3.608 19707 1301 1 3 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.483 -4.380 19707 1302 1 3 . 1 1 52 52 VAL H H 52 8.753 8.753 9.074 -0.321 19707 1303 1 3 . 1 1 53 53 ILE N N 53 128.027 128.027 126.142 1.885 19707 1304 1 3 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.613 0.229 19707 1305 1 3 . 1 1 53 53 ILE C C 53 172.110 172.110 174.080 -1.970 19707 1306 1 3 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.210 -2.457 19707 1307 1 3 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.305 -4.146 19707 1308 1 3 . 1 1 53 53 ILE H H 53 9.261 9.261 9.094 0.167 19707 1309 1 3 . 1 1 54 54 ARG N N 54 127.885 127.885 127.625 0.260 19707 1310 1 3 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.720 0.033 19707 1311 1 3 . 1 1 54 54 ARG C C 54 172.285 172.285 174.296 -2.011 19707 1312 1 3 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.657 -1.397 19707 1313 1 3 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.601 -2.709 19707 1314 1 3 . 1 1 54 54 ARG H H 54 8.686 8.686 8.758 -0.072 19707 1315 1 3 . 1 1 55 55 ILE N N 55 129.907 129.907 124.133 5.774 19707 1316 1 3 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.458 -0.305 19707 1317 1 3 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.716 -2.121 19707 1318 1 3 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.741 -2.128 19707 1319 1 3 . 1 1 55 55 ILE H H 55 9.292 9.292 8.402 0.890 19707 1320 1 3 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.429 -0.237 19707 1321 1 3 . 1 1 56 56 PRO C C 56 174.787 174.787 177.899 -3.112 19707 1322 1 3 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.804 -2.070 19707 1323 1 3 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.681 -2.768 19707 1324 1 3 . 1 1 57 57 GLY N N 57 111.828 111.828 111.166 0.662 19707 1325 1 3 . 1 1 57 57 GLY C C 57 171.039 171.039 173.660 -2.621 19707 1326 1 3 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.828 -2.011 19707 1327 1 3 . 1 1 57 57 GLY H H 57 8.708 8.708 8.730 -0.022 19707 1328 1 3 . 1 1 58 58 GLN N N 58 118.457 118.457 119.931 -1.474 19707 1329 1 3 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.870 0.030 19707 1330 1 3 . 1 1 58 58 GLN CA C 58 50.272 50.272 52.999 -2.727 19707 1331 1 3 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.738 -2.584 19707 1332 1 3 . 1 1 58 58 GLN H H 58 7.909 7.909 7.591 0.318 19707 1333 1 3 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.392 0.044 19707 1334 1 3 . 1 1 59 59 PRO C C 59 174.607 174.607 177.058 -2.451 19707 1335 1 3 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.768 -2.713 19707 1336 1 3 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.075 -2.898 19707 1337 1 3 . 1 1 60 60 VAL N N 60 122.695 122.695 120.640 2.055 19707 1338 1 3 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.210 -0.255 19707 1339 1 3 . 1 1 60 60 VAL C C 60 172.403 172.403 175.871 -3.468 19707 1340 1 3 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.703 -1.808 19707 1341 1 3 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.689 -3.047 19707 1342 1 3 . 1 1 60 60 VAL H H 60 8.364 8.364 8.241 0.123 19707 1343 1 3 . 1 1 61 61 VAL N N 61 126.097 126.097 128.627 -2.530 19707 1344 1 3 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.376 -0.076 19707 1345 1 3 . 1 1 61 61 VAL C C 61 170.891 170.891 174.302 -3.411 19707 1346 1 3 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.528 -2.714 19707 1347 1 3 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.511 -3.313 19707 1348 1 3 . 1 1 61 61 VAL H H 61 8.023 8.023 8.067 -0.044 19707 1349 1 3 . 1 1 62 62 GLU N N 62 126.097 126.097 125.630 0.467 19707 1350 1 3 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.013 0.146 19707 1351 1 3 . 1 1 62 62 GLU C C 62 172.252 172.252 175.311 -3.059 19707 1352 1 3 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.078 -3.538 19707 1353 1 3 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.758 -2.458 19707 1354 1 3 . 1 1 62 62 GLU H H 62 8.591 8.591 8.495 0.096 19707 1355 1 3 . 1 1 63 63 VAL N N 63 120.374 120.374 123.357 -2.983 19707 1356 1 3 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.150 0.243 19707 1357 1 3 . 1 1 63 63 VAL C C 63 171.040 171.040 176.346 -5.306 19707 1358 1 3 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.659 -3.826 19707 1359 1 3 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.877 -0.300 19707 1360 1 3 . 1 1 63 63 VAL H H 63 8.732 8.732 8.815 -0.083 19707 1361 1 3 . 1 1 64 64 GLY N N 64 109.935 109.935 114.293 -4.358 19707 1362 1 3 . 1 1 64 64 GLY C C 64 171.656 171.656 173.669 -2.013 19707 1363 1 3 . 1 1 64 64 GLY CA C 64 41.177 41.177 45.755 -4.578 19707 1364 1 3 . 1 1 64 64 GLY H H 64 8.259 8.259 8.354 -0.096 19707 1365 1 3 . 1 1 65 65 THR N N 65 115.478 115.478 116.129 -0.651 19707 1366 1 3 . 1 1 65 65 THR HA H 65 4.342 4.342 4.304 0.038 19707 1367 1 3 . 1 1 65 65 THR C C 65 170.663 170.663 172.565 -1.902 19707 1368 1 3 . 1 1 65 65 THR CA C 65 58.357 58.357 59.938 -1.581 19707 1369 1 3 . 1 1 65 65 THR CB C 65 67.923 67.923 71.204 -3.281 19707 1370 1 3 . 1 1 65 65 THR H H 65 8.123 8.123 7.700 0.423 19707 1371 1 3 . 1 1 66 66 LYS N N 66 130.775 130.775 125.802 4.973 19707 1372 1 3 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.182 -1.252 19707 1373 1 3 . 1 1 66 66 LYS CA C 66 52.190 52.190 55.053 -2.863 19707 1374 1 3 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.795 -3.105 19707 1375 1 3 . 1 1 66 66 LYS H H 66 8.472 8.472 8.197 0.275 19707 1376 1 3 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.592 -0.181 19707 1377 1 3 . 1 1 67 67 PRO C C 67 173.211 173.211 177.013 -3.802 19707 1378 1 3 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.239 -2.673 19707 1379 1 3 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.385 -2.982 19707 1380 1 3 . 1 1 68 68 THR N N 68 111.983 111.983 114.524 -2.541 19707 1381 1 3 . 1 1 68 68 THR HA H 68 4.277 4.277 4.235 0.042 19707 1382 1 3 . 1 1 68 68 THR C C 68 171.720 171.720 175.594 -3.874 19707 1383 1 3 . 1 1 68 68 THR CA C 68 58.193 58.193 63.205 -5.012 19707 1384 1 3 . 1 1 68 68 THR CB C 68 67.723 67.723 69.140 -1.417 19707 1385 1 3 . 1 1 68 68 THR H H 68 8.091 8.091 8.219 -0.128 19707 1386 1 3 . 1 1 69 69 GLY N N 69 109.918 109.918 108.733 1.185 19707 1387 1 3 . 1 1 69 69 GLY C C 69 170.783 170.783 174.567 -3.784 19707 1388 1 3 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.741 -2.685 19707 1389 1 3 . 1 1 69 69 GLY H H 69 8.119 8.119 8.080 0.039 19707 1390 1 3 . 1 1 70 70 ASP N N 70 123.294 123.294 124.271 -0.977 19707 1391 1 3 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.798 -0.249 19707 1392 1 3 . 1 1 70 70 ASP C C 70 173.651 173.651 175.101 -1.450 19707 1393 1 3 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.710 -2.849 19707 1394 1 3 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.264 -1.530 19707 1395 1 3 . 1 1 70 70 ASP H H 70 8.444 8.444 8.715 -0.271 19707 1396 1 3 . 1 1 71 71 VAL N N 71 117.772 117.772 114.688 3.084 19707 1397 1 3 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.101 -0.394 19707 1398 1 3 . 1 1 71 71 VAL C C 71 172.992 172.992 174.088 -1.096 19707 1399 1 3 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.774 -2.398 19707 1400 1 3 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.812 -2.790 19707 1401 1 3 . 1 1 71 71 VAL H H 71 8.173 8.173 7.794 0.379 19707 1402 1 3 . 1 1 72 72 LEU N N 72 123.435 123.435 122.335 1.100 19707 1403 1 3 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.614 0.022 19707 1404 1 3 . 1 1 72 72 LEU C C 72 173.189 173.189 176.312 -3.123 19707 1405 1 3 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.354 -3.147 19707 1406 1 3 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.046 -1.408 19707 1407 1 3 . 1 1 72 72 LEU H H 72 8.859 8.859 8.723 0.136 19707 1408 1 3 . 1 1 73 73 GLN N N 73 119.520 119.520 121.027 -1.507 19707 1409 1 3 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.228 0.117 19707 1410 1 3 . 1 1 73 73 GLN C C 73 172.249 172.249 175.475 -3.226 19707 1411 1 3 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.506 -3.173 19707 1412 1 3 . 1 1 73 73 GLN CB C 73 29.770 29.770 32.094 -2.324 19707 1413 1 3 . 1 1 73 73 GLN H H 73 9.196 9.196 8.279 0.917 19707 1414 1 3 . 1 1 74 74 GLY N N 74 113.513 113.513 111.380 2.133 19707 1415 1 3 . 1 1 74 74 GLY C C 74 169.072 169.072 171.931 -2.859 19707 1416 1 3 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.715 -2.418 19707 1417 1 3 . 1 1 74 74 GLY H H 74 9.373 9.373 9.219 0.154 19707 1418 1 3 . 1 1 75 75 ARG N N 75 122.479 122.479 123.256 -0.777 19707 1419 1 3 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.412 0.090 19707 1420 1 3 . 1 1 75 75 ARG C C 75 172.348 172.348 173.956 -1.608 19707 1421 1 3 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.675 -3.917 19707 1422 1 3 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.243 -2.425 19707 1423 1 3 . 1 1 75 75 ARG H H 75 8.615 8.615 7.843 0.772 19707 1424 1 3 . 1 1 76 76 ALA N N 76 122.346 122.346 128.358 -6.012 19707 1425 1 3 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.805 -0.269 19707 1426 1 3 . 1 1 76 76 ALA C C 76 172.704 172.704 175.031 -2.327 19707 1427 1 3 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.320 -2.293 19707 1428 1 3 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.863 -2.838 19707 1429 1 3 . 1 1 76 76 ALA H H 76 8.590 8.590 9.170 -0.580 19707 1430 1 3 . 1 1 77 77 THR N N 77 116.961 116.961 117.040 -0.079 19707 1431 1 3 . 1 1 77 77 THR HA H 77 4.988 4.988 5.061 -0.073 19707 1432 1 3 . 1 1 77 77 THR C C 77 172.800 172.800 174.972 -2.172 19707 1433 1 3 . 1 1 77 77 THR CA C 77 58.344 58.344 60.948 -2.604 19707 1434 1 3 . 1 1 77 77 THR CB C 77 67.712 67.712 70.235 -2.523 19707 1435 1 3 . 1 1 77 77 THR H H 77 8.491 8.491 8.337 0.154 19707 1436 1 3 . 1 1 78 78 GLY N N 78 111.103 111.103 112.842 -1.739 19707 1437 1 3 . 1 1 78 78 GLY C C 78 172.567 172.567 174.638 -2.071 19707 1438 1 3 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.769 -2.460 19707 1439 1 3 . 1 1 78 78 GLY H H 78 8.649 8.649 8.651 -0.002 19707 1440 1 3 . 1 1 79 79 GLU N N 79 123.423 123.423 119.704 3.719 19707 1441 1 3 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.284 -0.288 19707 1442 1 3 . 1 1 79 79 GLU C C 79 175.466 175.466 177.394 -1.928 19707 1443 1 3 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.317 -2.858 19707 1444 1 3 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.845 -3.778 19707 1445 1 3 . 1 1 79 79 GLU H H 79 10.375 10.375 8.821 1.554 19707 1446 1 3 . 1 1 80 80 GLU N N 80 113.846 113.846 117.669 -3.823 19707 1447 1 3 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.386 -0.028 19707 1448 1 3 . 1 1 80 80 GLU C C 80 173.293 173.293 176.916 -3.623 19707 1449 1 3 . 1 1 80 80 GLU CA C 80 51.776 51.776 56.035 -4.259 19707 1450 1 3 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.534 -4.803 19707 1451 1 3 . 1 1 80 80 GLU H H 80 7.679 7.679 8.314 -0.635 19707 1452 1 3 . 1 1 81 81 GLY N N 81 105.493 105.493 108.852 -3.359 19707 1453 1 3 . 1 1 81 81 GLY C C 81 170.427 170.427 174.171 -3.744 19707 1454 1 3 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.046 -2.434 19707 1455 1 3 . 1 1 81 81 GLY H H 81 7.476 7.476 7.673 -0.197 19707 1456 1 3 . 1 1 82 82 GLU N N 82 122.160 122.160 118.989 3.171 19707 1457 1 3 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.426 0.528 19707 1458 1 3 . 1 1 82 82 GLU C C 82 171.004 171.004 175.561 -4.557 19707 1459 1 3 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.623 -4.302 19707 1460 1 3 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.873 -4.807 19707 1461 1 3 . 1 1 82 82 GLU H H 82 9.585 9.585 7.964 1.621 19707 1462 1 3 . 1 1 83 83 THR N N 83 114.756 114.756 115.691 -0.935 19707 1463 1 3 . 1 1 83 83 THR HA H 83 4.990 4.990 5.178 -0.188 19707 1464 1 3 . 1 1 83 83 THR C C 83 170.909 170.909 173.438 -2.529 19707 1465 1 3 . 1 1 83 83 THR CA C 83 57.957 57.957 62.096 -4.139 19707 1466 1 3 . 1 1 83 83 THR CB C 83 68.271 68.271 71.799 -3.529 19707 1467 1 3 . 1 1 83 83 THR H H 83 8.490 8.490 8.611 -0.121 19707 1468 1 3 . 1 1 84 84 VAL N N 84 122.639 122.639 125.625 -2.986 19707 1469 1 3 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.813 -0.158 19707 1470 1 3 . 1 1 84 84 VAL C C 84 170.962 170.962 173.534 -2.572 19707 1471 1 3 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.825 -2.528 19707 1472 1 3 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.001 -2.777 19707 1473 1 3 . 1 1 84 84 VAL H H 84 9.001 9.001 9.035 -0.034 19707 1474 1 3 . 1 1 85 85 LEU N N 85 129.903 129.903 128.041 1.862 19707 1475 1 3 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.541 -0.149 19707 1476 1 3 . 1 1 85 85 LEU C C 85 172.346 172.346 174.447 -2.101 19707 1477 1 3 . 1 1 85 85 LEU CA C 85 50.797 50.797 52.974 -2.177 19707 1478 1 3 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.904 -4.389 19707 1479 1 3 . 1 1 85 85 LEU H H 85 8.610 8.610 9.046 -0.436 19707 1480 1 3 . 1 1 86 86 VAL N N 86 122.778 122.778 124.025 -1.247 19707 1481 1 3 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.875 0.166 19707 1482 1 3 . 1 1 86 86 VAL C C 86 172.570 172.570 174.511 -1.941 19707 1483 1 3 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.200 -4.000 19707 1484 1 3 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.234 -2.959 19707 1485 1 3 . 1 1 86 86 VAL H H 86 9.228 9.228 9.065 0.163 19707 1486 1 3 . 1 1 87 87 GLU N N 87 120.437 120.437 126.318 -5.881 19707 1487 1 3 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.538 0.193 19707 1488 1 3 . 1 1 87 87 GLU C C 87 172.267 172.267 175.196 -2.929 19707 1489 1 3 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.379 -3.030 19707 1490 1 3 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.737 -2.613 19707 1491 1 3 . 1 1 87 87 GLU H H 87 8.851 8.851 9.176 -0.325 19707 1492 1 3 . 1 1 88 88 GLU N N 88 118.525 118.525 122.078 -3.553 19707 1493 1 3 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.781 0.220 19707 1494 1 3 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.095 -3.178 19707 1495 1 3 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.476 -2.529 19707 1496 1 3 . 1 1 88 88 GLU H H 88 8.380 8.380 8.583 -0.203 19707 1497 1 3 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.409 0.120 19707 1498 1 3 . 1 1 89 89 PRO C C 89 172.774 172.774 176.618 -3.844 19707 1499 1 3 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.223 -2.842 19707 1500 1 3 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.140 -2.806 19707 1501 1 4 . 1 1 2 2 SER N N 2 115.963 115.963 114.877 1.086 19707 1502 1 4 . 1 1 2 2 SER HA H 2 4.408 4.408 4.672 -0.264 19707 1503 1 4 . 1 1 2 2 SER C C 2 171.788 171.788 174.673 -2.885 19707 1504 1 4 . 1 1 2 2 SER CA C 2 55.870 55.870 58.075 -2.205 19707 1505 1 4 . 1 1 2 2 SER CB C 2 61.022 61.022 63.406 -2.384 19707 1506 1 4 . 1 1 2 2 SER H H 2 8.661 8.661 8.749 -0.088 19707 1507 1 4 . 1 1 3 3 GLU N N 3 122.941 122.941 121.120 1.821 19707 1508 1 4 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.529 -0.209 19707 1509 1 4 . 1 1 3 3 GLU C C 3 173.817 173.817 175.137 -1.320 19707 1510 1 4 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.442 -1.488 19707 1511 1 4 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.937 -4.100 19707 1512 1 4 . 1 1 3 3 GLU H H 3 8.706 8.706 7.987 0.719 19707 1513 1 4 . 1 1 4 4 THR N N 4 116.182 116.182 116.434 -0.252 19707 1514 1 4 . 1 1 4 4 THR HA H 4 4.233 4.233 4.574 -0.341 19707 1515 1 4 . 1 1 4 4 THR C C 4 171.719 171.719 174.547 -2.828 19707 1516 1 4 . 1 1 4 4 THR CA C 4 59.414 59.414 62.042 -2.628 19707 1517 1 4 . 1 1 4 4 THR CB C 4 67.009 67.009 69.859 -2.850 19707 1518 1 4 . 1 1 4 4 THR H H 4 8.165 8.165 8.394 -0.229 19707 1519 1 4 . 1 1 5 5 ARG N N 5 124.184 124.184 124.001 0.183 19707 1520 1 4 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.174 0.186 19707 1521 1 4 . 1 1 5 5 ARG C C 5 173.520 173.520 177.131 -3.611 19707 1522 1 4 . 1 1 5 5 ARG CA C 5 53.343 53.343 57.915 -4.572 19707 1523 1 4 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.322 -2.157 19707 1524 1 4 . 1 1 5 5 ARG H H 5 8.354 8.354 8.738 -0.384 19707 1525 1 4 . 1 1 6 6 THR N N 6 116.652 116.652 112.082 4.570 19707 1526 1 4 . 1 1 6 6 THR HA H 6 4.263 4.263 4.418 -0.155 19707 1527 1 4 . 1 1 6 6 THR C C 6 171.784 171.784 173.062 -1.278 19707 1528 1 4 . 1 1 6 6 THR CA C 6 59.218 59.218 60.071 -0.853 19707 1529 1 4 . 1 1 6 6 THR CB C 6 67.213 67.213 70.071 -2.858 19707 1530 1 4 . 1 1 6 6 THR H H 6 8.224 8.224 7.540 0.684 19707 1531 1 4 . 1 1 7 7 ILE N N 7 123.882 123.882 121.051 2.831 19707 1532 1 4 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.355 -0.217 19707 1533 1 4 . 1 1 7 7 ILE C C 7 173.572 173.572 176.073 -2.501 19707 1534 1 4 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.985 -2.503 19707 1535 1 4 . 1 1 7 7 ILE CB C 7 36.069 36.069 39.971 -3.902 19707 1536 1 4 . 1 1 7 7 ILE H H 7 8.247 8.247 8.431 -0.184 19707 1537 1 4 . 1 1 8 8 SER N N 8 120.287 120.287 121.181 -0.894 19707 1538 1 4 . 1 1 8 8 SER HA H 8 4.445 4.445 4.549 -0.104 19707 1539 1 4 . 1 1 8 8 SER C C 8 171.926 171.926 175.034 -3.108 19707 1540 1 4 . 1 1 8 8 SER CA C 8 55.522 55.522 57.958 -2.436 19707 1541 1 4 . 1 1 8 8 SER CB C 8 61.073 61.073 63.116 -2.043 19707 1542 1 4 . 1 1 8 8 SER H H 8 8.402 8.402 8.704 -0.302 19707 1543 1 4 . 1 1 9 9 SER N N 9 118.425 118.425 117.585 0.840 19707 1544 1 4 . 1 1 9 9 SER HA H 9 4.525 4.525 4.472 0.053 19707 1545 1 4 . 1 1 9 9 SER C C 9 172.663 172.663 174.539 -1.876 19707 1546 1 4 . 1 1 9 9 SER CA C 9 55.897 55.897 58.718 -2.821 19707 1547 1 4 . 1 1 9 9 SER CB C 9 61.375 61.375 62.240 -0.865 19707 1548 1 4 . 1 1 9 9 SER H H 9 8.362 8.362 8.498 -0.136 19707 1549 1 4 . 1 1 10 10 THR N N 10 115.676 115.676 113.539 2.137 19707 1550 1 4 . 1 1 10 10 THR HA H 10 4.232 4.232 4.406 -0.174 19707 1551 1 4 . 1 1 10 10 THR C C 10 173.070 173.070 175.691 -2.621 19707 1552 1 4 . 1 1 10 10 THR CA C 10 60.318 60.318 63.145 -2.827 19707 1553 1 4 . 1 1 10 10 THR CB C 10 67.205 67.205 69.163 -1.958 19707 1554 1 4 . 1 1 10 10 THR H H 10 8.274 8.274 8.268 0.006 19707 1555 1 4 . 1 1 11 11 ALA N N 11 124.726 124.726 125.931 -1.205 19707 1556 1 4 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.092 -0.105 19707 1557 1 4 . 1 1 11 11 ALA C C 11 176.825 176.825 179.405 -2.580 19707 1558 1 4 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.148 -2.607 19707 1559 1 4 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.078 -2.189 19707 1560 1 4 . 1 1 11 11 ALA H H 11 8.347 8.347 8.292 0.055 19707 1561 1 4 . 1 1 12 12 GLN N N 12 117.915 117.915 117.509 0.406 19707 1562 1 4 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.109 -0.320 19707 1563 1 4 . 1 1 12 12 GLN C C 12 174.697 174.697 177.532 -2.835 19707 1564 1 4 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.857 -2.853 19707 1565 1 4 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.619 -2.394 19707 1566 1 4 . 1 1 12 12 GLN H H 12 8.194 8.194 8.213 -0.019 19707 1567 1 4 . 1 1 13 13 GLU N N 13 118.510 118.510 119.039 -0.529 19707 1568 1 4 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.152 -0.049 19707 1569 1 4 . 1 1 13 13 GLU C C 13 176.192 176.192 179.256 -3.064 19707 1570 1 4 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.691 -2.376 19707 1571 1 4 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.775 -3.742 19707 1572 1 4 . 1 1 13 13 GLU H H 13 7.917 7.917 7.863 0.054 19707 1573 1 4 . 1 1 14 14 ARG N N 14 118.193 118.193 119.997 -1.804 19707 1574 1 4 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.067 -0.099 19707 1575 1 4 . 1 1 14 14 ARG C C 14 176.764 176.764 178.568 -1.804 19707 1576 1 4 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.125 -1.842 19707 1577 1 4 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.681 -2.444 19707 1578 1 4 . 1 1 14 14 ARG H H 14 7.907 7.907 8.237 -0.330 19707 1579 1 4 . 1 1 15 15 VAL N N 15 117.991 117.991 114.243 3.748 19707 1580 1 4 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.833 0.070 19707 1581 1 4 . 1 1 15 15 VAL C C 15 174.922 174.922 177.114 -2.192 19707 1582 1 4 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.919 -2.088 19707 1583 1 4 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.357 -2.634 19707 1584 1 4 . 1 1 15 15 VAL H H 15 7.658 7.658 7.412 0.246 19707 1585 1 4 . 1 1 16 16 ASP N N 16 124.314 124.314 120.308 4.006 19707 1586 1 4 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.452 -0.136 19707 1587 1 4 . 1 1 16 16 ASP C C 16 176.462 176.462 178.117 -1.655 19707 1588 1 4 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.560 -2.234 19707 1589 1 4 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.279 -4.610 19707 1590 1 4 . 1 1 16 16 ASP H H 16 8.291 8.291 7.999 0.292 19707 1591 1 4 . 1 1 17 17 LEU N N 17 120.212 120.212 119.412 0.800 19707 1592 1 4 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.066 -0.012 19707 1593 1 4 . 1 1 17 17 LEU C C 17 177.171 177.171 178.874 -1.703 19707 1594 1 4 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.610 -2.630 19707 1595 1 4 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.808 -2.963 19707 1596 1 4 . 1 1 17 17 LEU H H 17 8.172 8.172 7.515 0.657 19707 1597 1 4 . 1 1 18 18 GLU N N 18 120.587 120.587 118.592 1.995 19707 1598 1 4 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.965 0.228 19707 1599 1 4 . 1 1 18 18 GLU C C 18 175.997 175.997 178.675 -2.678 19707 1600 1 4 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.414 -3.312 19707 1601 1 4 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.803 -2.731 19707 1602 1 4 . 1 1 18 18 GLU H H 18 7.876 7.876 7.947 -0.071 19707 1603 1 4 . 1 1 19 19 ALA N N 19 121.800 121.800 122.822 -1.022 19707 1604 1 4 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.085 -0.294 19707 1605 1 4 . 1 1 19 19 ALA C C 19 175.708 175.708 179.718 -4.010 19707 1606 1 4 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.959 -2.107 19707 1607 1 4 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.414 -4.260 19707 1608 1 4 . 1 1 19 19 ALA H H 19 7.792 7.792 7.556 0.236 19707 1609 1 4 . 1 1 20 20 VAL N N 20 118.680 118.680 119.569 -0.889 19707 1610 1 4 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.692 -0.392 19707 1611 1 4 . 1 1 20 20 VAL C C 20 176.276 176.276 177.923 -1.647 19707 1612 1 4 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.969 -3.162 19707 1613 1 4 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.438 -1.887 19707 1614 1 4 . 1 1 20 20 VAL H H 20 7.712 7.712 8.093 -0.381 19707 1615 1 4 . 1 1 21 21 ARG N N 21 121.935 121.935 120.826 1.109 19707 1616 1 4 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.096 -0.101 19707 1617 1 4 . 1 1 21 21 ARG C C 21 176.828 176.828 178.653 -1.825 19707 1618 1 4 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.364 -1.704 19707 1619 1 4 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.536 -2.246 19707 1620 1 4 . 1 1 21 21 ARG H H 21 8.444 8.444 8.258 0.186 19707 1621 1 4 . 1 1 22 22 LEU N N 22 119.327 119.327 119.585 -0.258 19707 1622 1 4 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.114 -0.119 19707 1623 1 4 . 1 1 22 22 LEU C C 22 175.664 175.664 178.607 -2.943 19707 1624 1 4 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.192 -3.324 19707 1625 1 4 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.551 -2.416 19707 1626 1 4 . 1 1 22 22 LEU H H 22 8.248 8.248 8.446 -0.198 19707 1627 1 4 . 1 1 23 23 ALA N N 23 121.202 121.202 122.136 -0.934 19707 1628 1 4 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.964 -0.229 19707 1629 1 4 . 1 1 23 23 ALA C C 23 175.492 175.492 179.620 -4.128 19707 1630 1 4 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.328 -2.259 19707 1631 1 4 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.017 -3.950 19707 1632 1 4 . 1 1 23 23 ALA H H 23 8.392 8.392 8.515 -0.123 19707 1633 1 4 . 1 1 24 24 SER N N 24 112.377 112.377 115.166 -2.789 19707 1634 1 4 . 1 1 24 24 SER HA H 24 4.214 4.214 4.297 -0.083 19707 1635 1 4 . 1 1 24 24 SER C C 24 174.773 174.773 176.609 -1.836 19707 1636 1 4 . 1 1 24 24 SER CA C 24 59.258 59.258 62.529 -3.271 19707 1637 1 4 . 1 1 24 24 SER CB C 24 60.149 60.149 63.034 -2.885 19707 1638 1 4 . 1 1 24 24 SER H H 24 7.690 7.690 8.029 -0.339 19707 1639 1 4 . 1 1 25 25 ILE N N 25 123.886 123.886 122.682 1.204 19707 1640 1 4 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.999 -0.157 19707 1641 1 4 . 1 1 25 25 ILE C C 25 176.487 176.487 178.114 -1.627 19707 1642 1 4 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.369 -0.376 19707 1643 1 4 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.458 -0.526 19707 1644 1 4 . 1 1 25 25 ILE H H 25 7.837 7.837 8.208 -0.371 19707 1645 1 4 . 1 1 26 26 VAL N N 26 122.538 122.538 121.447 1.091 19707 1646 1 4 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.551 -0.163 19707 1647 1 4 . 1 1 26 26 VAL C C 26 174.624 174.624 177.510 -2.886 19707 1648 1 4 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.510 -2.595 19707 1649 1 4 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.476 -3.581 19707 1650 1 4 . 1 1 26 26 VAL H H 26 8.804 8.804 8.686 0.118 19707 1651 1 4 . 1 1 27 27 ASP N N 27 120.433 120.433 120.105 0.328 19707 1652 1 4 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.319 -0.155 19707 1653 1 4 . 1 1 27 27 ASP C C 27 174.966 174.966 178.465 -3.499 19707 1654 1 4 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.417 -2.088 19707 1655 1 4 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.690 -2.836 19707 1656 1 4 . 1 1 27 27 ASP H H 27 8.719 8.719 8.484 0.235 19707 1657 1 4 . 1 1 28 28 SER N N 28 112.397 112.397 115.795 -3.398 19707 1658 1 4 . 1 1 28 28 SER HA H 28 4.073 4.073 4.168 -0.095 19707 1659 1 4 . 1 1 28 28 SER C C 28 174.405 174.405 176.769 -2.364 19707 1660 1 4 . 1 1 28 28 SER CA C 28 59.115 59.115 62.012 -2.897 19707 1661 1 4 . 1 1 28 28 SER CB C 28 60.125 60.125 63.109 -2.984 19707 1662 1 4 . 1 1 28 28 SER H H 28 7.599 7.599 8.140 -0.541 19707 1663 1 4 . 1 1 29 29 ARG N N 29 123.945 123.945 122.293 1.652 19707 1664 1 4 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.993 0.034 19707 1665 1 4 . 1 1 29 29 ARG C C 29 175.902 175.902 178.122 -2.220 19707 1666 1 4 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.893 -3.619 19707 1667 1 4 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.065 -1.325 19707 1668 1 4 . 1 1 29 29 ARG H H 29 7.769 7.769 7.827 -0.058 19707 1669 1 4 . 1 1 30 30 LEU N N 30 121.580 121.580 120.383 1.197 19707 1670 1 4 . 1 1 30 30 LEU HA H 30 3.749 3.749 4.050 -0.301 19707 1671 1 4 . 1 1 30 30 LEU C C 30 177.474 177.474 179.676 -2.202 19707 1672 1 4 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.789 -2.476 19707 1673 1 4 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.790 -2.761 19707 1674 1 4 . 1 1 30 30 LEU H H 30 8.665 8.665 8.300 0.365 19707 1675 1 4 . 1 1 31 31 ILE N N 31 119.330 119.330 117.538 1.792 19707 1676 1 4 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.748 -0.057 19707 1677 1 4 . 1 1 31 31 ILE C C 31 175.341 175.341 177.785 -2.444 19707 1678 1 4 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.053 -2.541 19707 1679 1 4 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.893 -2.326 19707 1680 1 4 . 1 1 31 31 ILE H H 31 8.226 8.226 8.366 -0.140 19707 1681 1 4 . 1 1 32 32 GLY N N 32 106.092 106.092 106.013 0.079 19707 1682 1 4 . 1 1 32 32 GLY C C 32 172.413 172.413 175.206 -2.793 19707 1683 1 4 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.773 -3.276 19707 1684 1 4 . 1 1 32 32 GLY H H 32 7.767 7.767 7.803 -0.036 19707 1685 1 4 . 1 1 33 33 THR N N 33 110.966 110.966 112.908 -1.942 19707 1686 1 4 . 1 1 33 33 THR HA H 33 4.455 4.455 4.376 0.079 19707 1687 1 4 . 1 1 33 33 THR C C 33 172.714 172.714 174.920 -2.206 19707 1688 1 4 . 1 1 33 33 THR CA C 33 60.032 60.032 62.852 -2.820 19707 1689 1 4 . 1 1 33 33 THR CB C 33 68.287 68.287 70.096 -1.808 19707 1690 1 4 . 1 1 33 33 THR H H 33 8.102 8.102 7.873 0.229 19707 1691 1 4 . 1 1 34 34 GLY N N 34 110.320 110.320 111.055 -0.735 19707 1692 1 4 . 1 1 34 34 GLY C C 34 170.505 170.505 173.599 -3.094 19707 1693 1 4 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.100 -2.517 19707 1694 1 4 . 1 1 34 34 GLY H H 34 8.072 8.072 8.038 0.034 19707 1695 1 4 . 1 1 35 35 SER N N 35 112.944 112.944 115.450 -2.506 19707 1696 1 4 . 1 1 35 35 SER HA H 35 4.385 4.385 4.865 -0.480 19707 1697 1 4 . 1 1 35 35 SER C C 35 169.537 169.537 172.474 -2.937 19707 1698 1 4 . 1 1 35 35 SER CA C 35 54.794 54.794 57.848 -3.054 19707 1699 1 4 . 1 1 35 35 SER CB C 35 62.029 62.029 66.465 -4.436 19707 1700 1 4 . 1 1 35 35 SER H H 35 7.719 7.719 7.657 0.062 19707 1701 1 4 . 1 1 36 36 VAL N N 36 118.566 118.566 122.763 -4.197 19707 1702 1 4 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.141 -0.108 19707 1703 1 4 . 1 1 36 36 VAL C C 36 169.876 169.876 173.786 -3.910 19707 1704 1 4 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.058 -1.493 19707 1705 1 4 . 1 1 36 36 VAL CB C 36 30.952 30.952 34.080 -3.128 19707 1706 1 4 . 1 1 36 36 VAL H H 36 8.490 8.490 8.084 0.406 19707 1707 1 4 . 1 1 37 37 ASP N N 37 121.640 121.640 125.337 -3.697 19707 1708 1 4 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.896 -0.094 19707 1709 1 4 . 1 1 37 37 ASP C C 37 172.806 172.806 176.210 -3.404 19707 1710 1 4 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.978 -3.935 19707 1711 1 4 . 1 1 37 37 ASP CB C 37 40.206 40.206 44.480 -4.274 19707 1712 1 4 . 1 1 37 37 ASP H H 37 7.195 7.195 8.265 -1.070 19707 1713 1 4 . 1 1 38 38 GLU N N 38 120.018 120.018 121.091 -1.073 19707 1714 1 4 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.919 -0.262 19707 1715 1 4 . 1 1 38 38 GLU C C 38 174.753 174.753 176.931 -2.178 19707 1716 1 4 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.824 -3.332 19707 1717 1 4 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.738 -3.659 19707 1718 1 4 . 1 1 38 38 GLU H H 38 8.908 8.908 8.993 -0.085 19707 1719 1 4 . 1 1 39 39 ASP N N 39 118.668 118.668 115.944 2.724 19707 1720 1 4 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.449 -0.203 19707 1721 1 4 . 1 1 39 39 ASP C C 39 175.393 175.393 177.964 -2.571 19707 1722 1 4 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.112 -1.248 19707 1723 1 4 . 1 1 39 39 ASP CB C 39 36.970 36.970 39.914 -2.944 19707 1724 1 4 . 1 1 39 39 ASP H H 39 8.242 8.242 8.760 -0.518 19707 1725 1 4 . 1 1 40 40 PHE N N 40 119.851 119.851 120.695 -0.844 19707 1726 1 4 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.377 -0.173 19707 1727 1 4 . 1 1 40 40 PHE C C 40 174.929 174.929 176.250 -1.321 19707 1728 1 4 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.326 -2.155 19707 1729 1 4 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.083 -3.250 19707 1730 1 4 . 1 1 40 40 PHE H H 40 8.037 8.037 7.774 0.263 19707 1731 1 4 . 1 1 41 41 LEU N N 41 117.882 117.882 118.423 -0.541 19707 1732 1 4 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.211 -0.689 19707 1733 1 4 . 1 1 41 41 LEU C C 41 175.938 175.938 178.838 -2.900 19707 1734 1 4 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.946 -2.086 19707 1735 1 4 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.495 -3.264 19707 1736 1 4 . 1 1 41 41 LEU H H 41 7.816 7.816 7.938 -0.122 19707 1737 1 4 . 1 1 42 42 ARG N N 42 118.360 118.360 118.692 -0.332 19707 1738 1 4 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.040 -0.300 19707 1739 1 4 . 1 1 42 42 ARG C C 42 175.435 175.435 177.058 -1.623 19707 1740 1 4 . 1 1 42 42 ARG CA C 42 56.971 56.971 58.945 -1.974 19707 1741 1 4 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.855 -2.591 19707 1742 1 4 . 1 1 42 42 ARG H H 42 8.540 8.540 8.128 0.412 19707 1743 1 4 . 1 1 43 43 GLU N N 43 114.947 114.947 117.154 -2.207 19707 1744 1 4 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.271 -0.221 19707 1745 1 4 . 1 1 43 43 GLU C C 43 174.518 174.518 177.406 -2.888 19707 1746 1 4 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.719 -3.148 19707 1747 1 4 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.251 -3.210 19707 1748 1 4 . 1 1 43 43 GLU H H 43 7.223 7.223 8.136 -0.913 19707 1749 1 4 . 1 1 44 44 GLN N N 44 114.109 114.109 117.244 -3.135 19707 1750 1 4 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.326 -0.220 19707 1751 1 4 . 1 1 44 44 GLN C C 44 173.777 173.777 177.577 -3.800 19707 1752 1 4 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.588 -3.407 19707 1753 1 4 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.381 -3.511 19707 1754 1 4 . 1 1 44 44 GLN H H 44 7.372 7.372 8.064 -0.692 19707 1755 1 4 . 1 1 45 45 ILE N N 45 117.470 117.470 116.124 1.346 19707 1756 1 4 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.854 0.094 19707 1757 1 4 . 1 1 45 45 ILE C C 45 172.305 172.305 177.411 -5.106 19707 1758 1 4 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.801 -5.296 19707 1759 1 4 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.961 -2.261 19707 1760 1 4 . 1 1 45 45 ILE H H 45 7.235 7.235 7.447 -0.212 19707 1761 1 4 . 1 1 46 46 ARG N N 46 122.996 122.996 114.793 8.203 19707 1762 1 4 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.045 0.145 19707 1763 1 4 . 1 1 46 46 ARG C C 46 172.992 172.992 175.609 -2.617 19707 1764 1 4 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.114 -4.354 19707 1765 1 4 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.009 -0.057 19707 1766 1 4 . 1 1 46 46 ARG H H 46 8.336 8.336 8.623 -0.287 19707 1767 1 4 . 1 1 47 47 ASP N N 47 118.676 118.676 116.511 2.165 19707 1768 1 4 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.647 -0.199 19707 1769 1 4 . 1 1 47 47 ASP C C 47 172.520 172.520 175.085 -2.565 19707 1770 1 4 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.322 -2.433 19707 1771 1 4 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.647 -4.989 19707 1772 1 4 . 1 1 47 47 ASP H H 47 8.313 8.313 8.089 0.224 19707 1773 1 4 . 1 1 48 48 ALA N N 48 120.922 120.922 122.997 -2.075 19707 1774 1 4 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.531 -0.162 19707 1775 1 4 . 1 1 48 48 ALA C C 48 174.295 174.295 177.167 -2.872 19707 1776 1 4 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.537 -1.900 19707 1777 1 4 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.783 -3.569 19707 1778 1 4 . 1 1 48 48 ALA H H 48 7.824 7.824 7.289 0.535 19707 1779 1 4 . 1 1 49 49 ARG N N 49 118.644 118.644 119.562 -0.918 19707 1780 1 4 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.144 0.198 19707 1781 1 4 . 1 1 49 49 ARG C C 49 172.504 172.504 176.183 -3.679 19707 1782 1 4 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.679 -3.770 19707 1783 1 4 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.899 -2.556 19707 1784 1 4 . 1 1 49 49 ARG H H 49 7.911 7.911 8.413 -0.502 19707 1785 1 4 . 1 1 50 50 TYR N N 50 119.470 119.470 115.496 3.974 19707 1786 1 4 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.063 0.228 19707 1787 1 4 . 1 1 50 50 TYR C C 50 170.470 170.470 174.405 -3.935 19707 1788 1 4 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.005 -1.737 19707 1789 1 4 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.339 -0.826 19707 1790 1 4 . 1 1 50 50 TYR H H 50 7.639 7.639 7.972 -0.333 19707 1791 1 4 . 1 1 51 51 ALA N N 51 127.418 127.418 125.654 1.764 19707 1792 1 4 . 1 1 51 51 ALA HA H 51 5.221 5.221 4.898 0.323 19707 1793 1 4 . 1 1 51 51 ALA C C 51 171.328 171.328 175.403 -4.075 19707 1794 1 4 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.637 -3.204 19707 1795 1 4 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.415 -1.103 19707 1796 1 4 . 1 1 51 51 ALA H H 51 8.222 8.222 8.718 -0.496 19707 1797 1 4 . 1 1 52 52 VAL N N 52 117.832 117.832 121.900 -4.068 19707 1798 1 4 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.146 -0.479 19707 1799 1 4 . 1 1 52 52 VAL C C 52 172.436 172.436 174.348 -1.912 19707 1800 1 4 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.314 -3.557 19707 1801 1 4 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.435 -4.332 19707 1802 1 4 . 1 1 52 52 VAL H H 52 8.753 8.753 9.067 -0.314 19707 1803 1 4 . 1 1 53 53 ILE N N 53 128.027 128.027 125.892 2.135 19707 1804 1 4 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.620 0.222 19707 1805 1 4 . 1 1 53 53 ILE C C 53 172.110 172.110 174.210 -2.100 19707 1806 1 4 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.361 -2.608 19707 1807 1 4 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.192 -4.033 19707 1808 1 4 . 1 1 53 53 ILE H H 53 9.261 9.261 9.013 0.248 19707 1809 1 4 . 1 1 54 54 ARG N N 54 127.885 127.885 126.903 0.982 19707 1810 1 4 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.707 0.046 19707 1811 1 4 . 1 1 54 54 ARG C C 54 172.285 172.285 174.501 -2.216 19707 1812 1 4 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.851 -1.591 19707 1813 1 4 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.746 -2.854 19707 1814 1 4 . 1 1 54 54 ARG H H 54 8.686 8.686 8.925 -0.239 19707 1815 1 4 . 1 1 55 55 ILE N N 55 129.907 129.907 124.374 5.533 19707 1816 1 4 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.432 -0.279 19707 1817 1 4 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.107 -2.512 19707 1818 1 4 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.549 -1.936 19707 1819 1 4 . 1 1 55 55 ILE H H 55 9.292 9.292 8.494 0.798 19707 1820 1 4 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.417 -0.225 19707 1821 1 4 . 1 1 56 56 PRO C C 56 174.787 174.787 177.879 -3.092 19707 1822 1 4 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.745 -2.011 19707 1823 1 4 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.577 -2.664 19707 1824 1 4 . 1 1 57 57 GLY N N 57 111.828 111.828 111.613 0.215 19707 1825 1 4 . 1 1 57 57 GLY C C 57 171.039 171.039 173.644 -2.605 19707 1826 1 4 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.826 -2.009 19707 1827 1 4 . 1 1 57 57 GLY H H 57 8.708 8.708 8.741 -0.033 19707 1828 1 4 . 1 1 58 58 GLN N N 58 118.457 118.457 119.711 -1.254 19707 1829 1 4 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.850 0.050 19707 1830 1 4 . 1 1 58 58 GLN CA C 58 50.272 50.272 52.983 -2.711 19707 1831 1 4 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.712 -2.558 19707 1832 1 4 . 1 1 58 58 GLN H H 58 7.909 7.909 7.578 0.331 19707 1833 1 4 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.413 0.023 19707 1834 1 4 . 1 1 59 59 PRO C C 59 174.607 174.607 176.455 -1.848 19707 1835 1 4 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.850 -2.796 19707 1836 1 4 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.238 -3.061 19707 1837 1 4 . 1 1 60 60 VAL N N 60 122.695 122.695 121.182 1.513 19707 1838 1 4 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.082 -0.127 19707 1839 1 4 . 1 1 60 60 VAL C C 60 172.403 172.403 175.776 -3.373 19707 1840 1 4 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.701 -1.806 19707 1841 1 4 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.644 -3.002 19707 1842 1 4 . 1 1 60 60 VAL H H 60 8.364 8.364 8.230 0.134 19707 1843 1 4 . 1 1 61 61 VAL N N 61 126.097 126.097 129.838 -3.741 19707 1844 1 4 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.354 -0.054 19707 1845 1 4 . 1 1 61 61 VAL C C 61 170.891 170.891 174.505 -3.614 19707 1846 1 4 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.550 -2.736 19707 1847 1 4 . 1 1 61 61 VAL CB C 61 31.198 31.198 33.913 -2.715 19707 1848 1 4 . 1 1 61 61 VAL H H 61 8.023 8.023 8.140 -0.117 19707 1849 1 4 . 1 1 62 62 GLU N N 62 126.097 126.097 126.063 0.034 19707 1850 1 4 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.983 0.176 19707 1851 1 4 . 1 1 62 62 GLU C C 62 172.252 172.252 175.348 -3.096 19707 1852 1 4 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.134 -3.594 19707 1853 1 4 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.332 -2.032 19707 1854 1 4 . 1 1 62 62 GLU H H 62 8.591 8.591 8.520 0.071 19707 1855 1 4 . 1 1 63 63 VAL N N 63 120.374 120.374 123.912 -3.538 19707 1856 1 4 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.281 0.112 19707 1857 1 4 . 1 1 63 63 VAL C C 63 171.040 171.040 176.502 -5.462 19707 1858 1 4 . 1 1 63 63 VAL CA C 63 57.833 57.833 62.109 -4.276 19707 1859 1 4 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.806 -0.229 19707 1860 1 4 . 1 1 63 63 VAL H H 63 8.732 8.732 9.003 -0.271 19707 1861 1 4 . 1 1 64 64 GLY N N 64 109.935 109.935 112.942 -3.007 19707 1862 1 4 . 1 1 64 64 GLY C C 64 171.656 171.656 173.962 -2.306 19707 1863 1 4 . 1 1 64 64 GLY CA C 64 41.177 41.177 45.996 -4.819 19707 1864 1 4 . 1 1 64 64 GLY H H 64 8.259 8.259 8.636 -0.377 19707 1865 1 4 . 1 1 65 65 THR N N 65 115.478 115.478 116.220 -0.742 19707 1866 1 4 . 1 1 65 65 THR HA H 65 4.342 4.342 4.365 -0.023 19707 1867 1 4 . 1 1 65 65 THR C C 65 170.663 170.663 172.738 -2.075 19707 1868 1 4 . 1 1 65 65 THR CA C 65 58.357 58.357 60.412 -2.055 19707 1869 1 4 . 1 1 65 65 THR CB C 65 67.923 67.923 71.911 -3.988 19707 1870 1 4 . 1 1 65 65 THR H H 65 8.123 8.123 7.632 0.491 19707 1871 1 4 . 1 1 66 66 LYS N N 66 130.775 130.775 124.307 6.468 19707 1872 1 4 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.211 -1.281 19707 1873 1 4 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.611 -2.421 19707 1874 1 4 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.782 -3.092 19707 1875 1 4 . 1 1 66 66 LYS H H 66 8.472 8.472 8.147 0.325 19707 1876 1 4 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.613 -0.202 19707 1877 1 4 . 1 1 67 67 PRO C C 67 173.211 173.211 177.111 -3.900 19707 1878 1 4 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.355 -2.789 19707 1879 1 4 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.475 -3.072 19707 1880 1 4 . 1 1 68 68 THR N N 68 111.983 111.983 114.566 -2.583 19707 1881 1 4 . 1 1 68 68 THR HA H 68 4.277 4.277 4.238 0.039 19707 1882 1 4 . 1 1 68 68 THR C C 68 171.720 171.720 175.471 -3.751 19707 1883 1 4 . 1 1 68 68 THR CA C 68 58.193 58.193 62.969 -4.776 19707 1884 1 4 . 1 1 68 68 THR CB C 68 67.723 67.723 69.125 -1.402 19707 1885 1 4 . 1 1 68 68 THR H H 68 8.091 8.091 8.303 -0.212 19707 1886 1 4 . 1 1 69 69 GLY N N 69 109.918 109.918 109.053 0.865 19707 1887 1 4 . 1 1 69 69 GLY C C 69 170.783 170.783 174.485 -3.702 19707 1888 1 4 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.724 -2.668 19707 1889 1 4 . 1 1 69 69 GLY H H 69 8.119 8.119 8.049 0.070 19707 1890 1 4 . 1 1 70 70 ASP N N 70 123.294 123.294 124.713 -1.419 19707 1891 1 4 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.836 -0.287 19707 1892 1 4 . 1 1 70 70 ASP C C 70 173.651 173.651 175.155 -1.504 19707 1893 1 4 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.601 -2.740 19707 1894 1 4 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.437 -1.704 19707 1895 1 4 . 1 1 70 70 ASP H H 70 8.444 8.444 8.666 -0.222 19707 1896 1 4 . 1 1 71 71 VAL N N 71 117.772 117.772 114.171 3.601 19707 1897 1 4 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.057 -0.350 19707 1898 1 4 . 1 1 71 71 VAL C C 71 172.992 172.992 174.397 -1.405 19707 1899 1 4 . 1 1 71 71 VAL CA C 71 57.376 57.376 58.967 -1.591 19707 1900 1 4 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.336 -2.314 19707 1901 1 4 . 1 1 71 71 VAL H H 71 8.173 8.173 7.812 0.361 19707 1902 1 4 . 1 1 72 72 LEU N N 72 123.435 123.435 122.314 1.121 19707 1903 1 4 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.534 0.102 19707 1904 1 4 . 1 1 72 72 LEU C C 72 173.189 173.189 175.969 -2.780 19707 1905 1 4 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.195 -2.988 19707 1906 1 4 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.085 -1.447 19707 1907 1 4 . 1 1 72 72 LEU H H 72 8.859 8.859 8.890 -0.031 19707 1908 1 4 . 1 1 73 73 GLN N N 73 119.520 119.520 121.036 -1.516 19707 1909 1 4 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.214 0.131 19707 1910 1 4 . 1 1 73 73 GLN C C 73 172.249 172.249 175.697 -3.448 19707 1911 1 4 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.488 -3.155 19707 1912 1 4 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.450 -1.680 19707 1913 1 4 . 1 1 73 73 GLN H H 73 9.196 9.196 8.252 0.944 19707 1914 1 4 . 1 1 74 74 GLY N N 74 113.513 113.513 111.847 1.666 19707 1915 1 4 . 1 1 74 74 GLY C C 74 169.072 169.072 171.987 -2.915 19707 1916 1 4 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.951 -2.654 19707 1917 1 4 . 1 1 74 74 GLY H H 74 9.373 9.373 9.120 0.253 19707 1918 1 4 . 1 1 75 75 ARG N N 75 122.479 122.479 123.876 -1.397 19707 1919 1 4 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.312 0.190 19707 1920 1 4 . 1 1 75 75 ARG C C 75 172.348 172.348 174.000 -1.652 19707 1921 1 4 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.758 -4.000 19707 1922 1 4 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.129 -2.311 19707 1923 1 4 . 1 1 75 75 ARG H H 75 8.615 8.615 8.036 0.580 19707 1924 1 4 . 1 1 76 76 ALA N N 76 122.346 122.346 128.648 -6.302 19707 1925 1 4 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.826 -0.290 19707 1926 1 4 . 1 1 76 76 ALA C C 76 172.704 172.704 175.001 -2.297 19707 1927 1 4 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.240 -2.213 19707 1928 1 4 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.889 -2.864 19707 1929 1 4 . 1 1 76 76 ALA H H 76 8.590 8.590 9.090 -0.500 19707 1930 1 4 . 1 1 77 77 THR N N 77 116.961 116.961 116.412 0.549 19707 1931 1 4 . 1 1 77 77 THR HA H 77 4.988 4.988 5.092 -0.104 19707 1932 1 4 . 1 1 77 77 THR C C 77 172.800 172.800 174.764 -1.964 19707 1933 1 4 . 1 1 77 77 THR CA C 77 58.344 58.344 60.842 -2.498 19707 1934 1 4 . 1 1 77 77 THR CB C 77 67.712 67.712 70.608 -2.896 19707 1935 1 4 . 1 1 77 77 THR H H 77 8.491 8.491 8.303 0.188 19707 1936 1 4 . 1 1 78 78 GLY N N 78 111.103 111.103 112.378 -1.275 19707 1937 1 4 . 1 1 78 78 GLY C C 78 172.567 172.567 174.928 -2.361 19707 1938 1 4 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.809 -2.499 19707 1939 1 4 . 1 1 78 78 GLY H H 78 8.649 8.649 8.660 -0.011 19707 1940 1 4 . 1 1 79 79 GLU N N 79 123.423 123.423 119.124 4.299 19707 1941 1 4 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.349 -0.353 19707 1942 1 4 . 1 1 79 79 GLU C C 79 175.466 175.466 177.488 -2.022 19707 1943 1 4 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.923 -2.464 19707 1944 1 4 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.672 -3.605 19707 1945 1 4 . 1 1 79 79 GLU H H 79 10.375 10.375 8.745 1.630 19707 1946 1 4 . 1 1 80 80 GLU N N 80 113.846 113.846 117.479 -3.633 19707 1947 1 4 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.416 -0.058 19707 1948 1 4 . 1 1 80 80 GLU C C 80 173.293 173.293 177.009 -3.716 19707 1949 1 4 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.974 -4.198 19707 1950 1 4 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.446 -4.715 19707 1951 1 4 . 1 1 80 80 GLU H H 80 7.679 7.679 8.439 -0.760 19707 1952 1 4 . 1 1 81 81 GLY N N 81 105.493 105.493 108.916 -3.423 19707 1953 1 4 . 1 1 81 81 GLY C C 81 170.427 170.427 174.191 -3.764 19707 1954 1 4 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.068 -2.456 19707 1955 1 4 . 1 1 81 81 GLY H H 81 7.476 7.476 7.659 -0.183 19707 1956 1 4 . 1 1 82 82 GLU N N 82 122.160 122.160 118.821 3.339 19707 1957 1 4 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.418 0.536 19707 1958 1 4 . 1 1 82 82 GLU C C 82 171.004 171.004 175.631 -4.627 19707 1959 1 4 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.755 -4.434 19707 1960 1 4 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.822 -4.756 19707 1961 1 4 . 1 1 82 82 GLU H H 82 9.585 9.585 8.016 1.569 19707 1962 1 4 . 1 1 83 83 THR N N 83 114.756 114.756 115.645 -0.889 19707 1963 1 4 . 1 1 83 83 THR HA H 83 4.990 4.990 5.093 -0.103 19707 1964 1 4 . 1 1 83 83 THR C C 83 170.909 170.909 173.214 -2.305 19707 1965 1 4 . 1 1 83 83 THR CA C 83 57.957 57.957 62.235 -4.278 19707 1966 1 4 . 1 1 83 83 THR CB C 83 68.271 68.271 71.797 -3.526 19707 1967 1 4 . 1 1 83 83 THR H H 83 8.490 8.490 8.454 0.036 19707 1968 1 4 . 1 1 84 84 VAL N N 84 122.639 122.639 125.800 -3.161 19707 1969 1 4 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.826 -0.171 19707 1970 1 4 . 1 1 84 84 VAL C C 84 170.962 170.962 173.749 -2.787 19707 1971 1 4 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.242 -2.945 19707 1972 1 4 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.833 -2.609 19707 1973 1 4 . 1 1 84 84 VAL H H 84 9.001 9.001 9.065 -0.064 19707 1974 1 4 . 1 1 85 85 LEU N N 85 129.903 129.903 128.169 1.734 19707 1975 1 4 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.541 -0.149 19707 1976 1 4 . 1 1 85 85 LEU C C 85 172.346 172.346 174.511 -2.165 19707 1977 1 4 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.181 -2.384 19707 1978 1 4 . 1 1 85 85 LEU CB C 85 42.515 42.515 47.008 -4.493 19707 1979 1 4 . 1 1 85 85 LEU H H 85 8.610 8.610 9.109 -0.499 19707 1980 1 4 . 1 1 86 86 VAL N N 86 122.778 122.778 123.926 -1.148 19707 1981 1 4 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.901 0.140 19707 1982 1 4 . 1 1 86 86 VAL C C 86 172.570 172.570 174.484 -1.914 19707 1983 1 4 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.249 -4.049 19707 1984 1 4 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.405 -3.130 19707 1985 1 4 . 1 1 86 86 VAL H H 86 9.228 9.228 9.076 0.152 19707 1986 1 4 . 1 1 87 87 GLU N N 87 120.437 120.437 126.554 -6.117 19707 1987 1 4 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.697 0.034 19707 1988 1 4 . 1 1 87 87 GLU C C 87 172.267 172.267 175.090 -2.823 19707 1989 1 4 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.334 -2.985 19707 1990 1 4 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.759 -2.635 19707 1991 1 4 . 1 1 87 87 GLU H H 87 8.851 8.851 9.286 -0.435 19707 1992 1 4 . 1 1 88 88 GLU N N 88 118.525 118.525 120.255 -1.730 19707 1993 1 4 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.677 0.324 19707 1994 1 4 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.935 -3.018 19707 1995 1 4 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.162 -1.215 19707 1996 1 4 . 1 1 88 88 GLU H H 88 8.380 8.380 8.445 -0.065 19707 1997 1 4 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.475 0.054 19707 1998 1 4 . 1 1 89 89 PRO C C 89 172.774 172.774 176.765 -3.991 19707 1999 1 4 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.153 -2.772 19707 2000 1 4 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.174 -2.840 19707 2001 1 5 . 1 1 2 2 SER N N 2 115.963 115.963 115.177 0.786 19707 2002 1 5 . 1 1 2 2 SER HA H 2 4.408 4.408 4.668 -0.260 19707 2003 1 5 . 1 1 2 2 SER C C 2 171.788 171.788 173.088 -1.300 19707 2004 1 5 . 1 1 2 2 SER CA C 2 55.870 55.870 57.950 -2.080 19707 2005 1 5 . 1 1 2 2 SER CB C 2 61.022 61.022 64.290 -3.268 19707 2006 1 5 . 1 1 2 2 SER H H 2 8.661 8.661 8.354 0.307 19707 2007 1 5 . 1 1 3 3 GLU N N 3 122.941 122.941 122.498 0.443 19707 2008 1 5 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.644 -0.324 19707 2009 1 5 . 1 1 3 3 GLU C C 3 173.817 173.817 175.955 -2.138 19707 2010 1 5 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.911 -1.957 19707 2011 1 5 . 1 1 3 3 GLU CB C 3 26.837 26.837 31.833 -4.996 19707 2012 1 5 . 1 1 3 3 GLU H H 3 8.706 8.706 8.470 0.236 19707 2013 1 5 . 1 1 4 4 THR N N 4 116.182 116.182 119.062 -2.880 19707 2014 1 5 . 1 1 4 4 THR HA H 4 4.233 4.233 4.200 0.033 19707 2015 1 5 . 1 1 4 4 THR C C 4 171.719 171.719 174.974 -3.255 19707 2016 1 5 . 1 1 4 4 THR CA C 4 59.414 59.414 62.475 -3.061 19707 2017 1 5 . 1 1 4 4 THR CB C 4 67.009 67.009 69.481 -2.472 19707 2018 1 5 . 1 1 4 4 THR H H 4 8.165 8.165 8.262 -0.097 19707 2019 1 5 . 1 1 5 5 ARG N N 5 124.184 124.184 123.901 0.283 19707 2020 1 5 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.340 0.020 19707 2021 1 5 . 1 1 5 5 ARG C C 5 173.520 173.520 176.464 -2.944 19707 2022 1 5 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.834 -2.491 19707 2023 1 5 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.610 -2.445 19707 2024 1 5 . 1 1 5 5 ARG H H 5 8.354 8.354 8.308 0.046 19707 2025 1 5 . 1 1 6 6 THR N N 6 116.652 116.652 115.391 1.261 19707 2026 1 5 . 1 1 6 6 THR HA H 6 4.263 4.263 4.296 -0.033 19707 2027 1 5 . 1 1 6 6 THR C C 6 171.784 171.784 173.522 -1.738 19707 2028 1 5 . 1 1 6 6 THR CA C 6 59.218 59.218 62.632 -3.414 19707 2029 1 5 . 1 1 6 6 THR CB C 6 67.213 67.213 69.319 -2.106 19707 2030 1 5 . 1 1 6 6 THR H H 6 8.224 8.224 8.265 -0.041 19707 2031 1 5 . 1 1 7 7 ILE N N 7 123.882 123.882 122.200 1.682 19707 2032 1 5 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.335 -0.197 19707 2033 1 5 . 1 1 7 7 ILE C C 7 173.572 173.572 176.194 -2.622 19707 2034 1 5 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.851 -2.369 19707 2035 1 5 . 1 1 7 7 ILE CB C 7 36.069 36.069 40.626 -4.557 19707 2036 1 5 . 1 1 7 7 ILE H H 7 8.247 8.247 8.217 0.030 19707 2037 1 5 . 1 1 8 8 SER N N 8 120.287 120.287 121.223 -0.936 19707 2038 1 5 . 1 1 8 8 SER HA H 8 4.445 4.445 4.653 -0.208 19707 2039 1 5 . 1 1 8 8 SER C C 8 171.926 171.926 174.712 -2.786 19707 2040 1 5 . 1 1 8 8 SER CA C 8 55.522 55.522 57.525 -2.003 19707 2041 1 5 . 1 1 8 8 SER CB C 8 61.073 61.073 62.758 -1.685 19707 2042 1 5 . 1 1 8 8 SER H H 8 8.402 8.402 8.773 -0.371 19707 2043 1 5 . 1 1 9 9 SER N N 9 118.425 118.425 118.296 0.129 19707 2044 1 5 . 1 1 9 9 SER HA H 9 4.525 4.525 4.284 0.241 19707 2045 1 5 . 1 1 9 9 SER C C 9 172.663 172.663 174.563 -1.900 19707 2046 1 5 . 1 1 9 9 SER CA C 9 55.897 55.897 59.529 -3.632 19707 2047 1 5 . 1 1 9 9 SER CB C 9 61.375 61.375 62.327 -0.952 19707 2048 1 5 . 1 1 9 9 SER H H 9 8.362 8.362 8.190 0.172 19707 2049 1 5 . 1 1 10 10 THR N N 10 115.676 115.676 113.270 2.406 19707 2050 1 5 . 1 1 10 10 THR HA H 10 4.232 4.232 4.441 -0.209 19707 2051 1 5 . 1 1 10 10 THR C C 10 173.070 173.070 175.581 -2.511 19707 2052 1 5 . 1 1 10 10 THR CA C 10 60.318 60.318 63.035 -2.717 19707 2053 1 5 . 1 1 10 10 THR CB C 10 67.205 67.205 69.126 -1.921 19707 2054 1 5 . 1 1 10 10 THR H H 10 8.274 8.274 8.088 0.186 19707 2055 1 5 . 1 1 11 11 ALA N N 11 124.726 124.726 124.761 -0.035 19707 2056 1 5 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.144 -0.157 19707 2057 1 5 . 1 1 11 11 ALA C C 11 176.825 176.825 179.409 -2.584 19707 2058 1 5 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.126 -2.585 19707 2059 1 5 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.296 -2.407 19707 2060 1 5 . 1 1 11 11 ALA H H 11 8.347 8.347 8.218 0.129 19707 2061 1 5 . 1 1 12 12 GLN N N 12 117.915 117.915 117.576 0.339 19707 2062 1 5 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.129 -0.340 19707 2063 1 5 . 1 1 12 12 GLN C C 12 174.697 174.697 177.581 -2.884 19707 2064 1 5 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.861 -2.857 19707 2065 1 5 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.653 -2.428 19707 2066 1 5 . 1 1 12 12 GLN H H 12 8.194 8.194 8.339 -0.145 19707 2067 1 5 . 1 1 13 13 GLU N N 13 118.510 118.510 119.230 -0.720 19707 2068 1 5 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.113 -0.010 19707 2069 1 5 . 1 1 13 13 GLU C C 13 176.192 176.192 179.259 -3.067 19707 2070 1 5 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.871 -2.556 19707 2071 1 5 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.743 -3.710 19707 2072 1 5 . 1 1 13 13 GLU H H 13 7.917 7.917 7.695 0.222 19707 2073 1 5 . 1 1 14 14 ARG N N 14 118.193 118.193 119.231 -1.038 19707 2074 1 5 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.034 -0.066 19707 2075 1 5 . 1 1 14 14 ARG C C 14 176.764 176.764 178.464 -1.700 19707 2076 1 5 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.116 -1.833 19707 2077 1 5 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.696 -2.459 19707 2078 1 5 . 1 1 14 14 ARG H H 14 7.907 7.907 8.278 -0.371 19707 2079 1 5 . 1 1 15 15 VAL N N 15 117.991 117.991 115.810 2.181 19707 2080 1 5 . 1 1 15 15 VAL HA H 15 3.903 3.903 4.054 -0.151 19707 2081 1 5 . 1 1 15 15 VAL C C 15 174.922 174.922 177.482 -2.560 19707 2082 1 5 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.889 -2.058 19707 2083 1 5 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.235 -2.512 19707 2084 1 5 . 1 1 15 15 VAL H H 15 7.658 7.658 7.499 0.159 19707 2085 1 5 . 1 1 16 16 ASP N N 16 124.314 124.314 120.461 3.853 19707 2086 1 5 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.407 -0.091 19707 2087 1 5 . 1 1 16 16 ASP C C 16 176.462 176.462 177.869 -1.407 19707 2088 1 5 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.370 -2.044 19707 2089 1 5 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.352 -4.683 19707 2090 1 5 . 1 1 16 16 ASP H H 16 8.291 8.291 8.164 0.127 19707 2091 1 5 . 1 1 17 17 LEU N N 17 120.212 120.212 119.609 0.603 19707 2092 1 5 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.138 -0.084 19707 2093 1 5 . 1 1 17 17 LEU C C 17 177.171 177.171 179.101 -1.930 19707 2094 1 5 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.634 -2.654 19707 2095 1 5 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.202 -2.357 19707 2096 1 5 . 1 1 17 17 LEU H H 17 8.172 8.172 7.597 0.575 19707 2097 1 5 . 1 1 18 18 GLU N N 18 120.587 120.587 119.091 1.496 19707 2098 1 5 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.946 0.247 19707 2099 1 5 . 1 1 18 18 GLU C C 18 175.997 175.997 178.701 -2.704 19707 2100 1 5 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.551 -3.449 19707 2101 1 5 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.756 -2.684 19707 2102 1 5 . 1 1 18 18 GLU H H 18 7.876 7.876 7.830 0.046 19707 2103 1 5 . 1 1 19 19 ALA N N 19 121.800 121.800 122.581 -0.781 19707 2104 1 5 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.103 -0.312 19707 2105 1 5 . 1 1 19 19 ALA C C 19 175.708 175.708 179.725 -4.017 19707 2106 1 5 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.816 -1.964 19707 2107 1 5 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.532 -4.378 19707 2108 1 5 . 1 1 19 19 ALA H H 19 7.792 7.792 7.365 0.427 19707 2109 1 5 . 1 1 20 20 VAL N N 20 118.680 118.680 119.977 -1.297 19707 2110 1 5 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.620 -0.320 19707 2111 1 5 . 1 1 20 20 VAL C C 20 176.276 176.276 177.767 -1.491 19707 2112 1 5 . 1 1 20 20 VAL CA C 20 63.807 63.807 67.234 -3.427 19707 2113 1 5 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.295 -1.744 19707 2114 1 5 . 1 1 20 20 VAL H H 20 7.712 7.712 8.230 -0.518 19707 2115 1 5 . 1 1 21 21 ARG N N 21 121.935 121.935 120.108 1.827 19707 2116 1 5 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.050 -0.055 19707 2117 1 5 . 1 1 21 21 ARG C C 21 176.828 176.828 178.662 -1.834 19707 2118 1 5 . 1 1 21 21 ARG CA C 21 56.660 56.660 59.324 -2.663 19707 2119 1 5 . 1 1 21 21 ARG CB C 21 27.290 27.290 30.039 -2.749 19707 2120 1 5 . 1 1 21 21 ARG H H 21 8.444 8.444 8.287 0.157 19707 2121 1 5 . 1 1 22 22 LEU N N 22 119.327 119.327 120.047 -0.720 19707 2122 1 5 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.061 -0.066 19707 2123 1 5 . 1 1 22 22 LEU C C 22 175.664 175.664 178.452 -2.788 19707 2124 1 5 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.005 -3.137 19707 2125 1 5 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.497 -2.362 19707 2126 1 5 . 1 1 22 22 LEU H H 22 8.248 8.248 8.168 0.080 19707 2127 1 5 . 1 1 23 23 ALA N N 23 121.202 121.202 121.758 -0.556 19707 2128 1 5 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.951 -0.216 19707 2129 1 5 . 1 1 23 23 ALA C C 23 175.492 175.492 179.644 -4.152 19707 2130 1 5 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.340 -2.271 19707 2131 1 5 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.967 -3.900 19707 2132 1 5 . 1 1 23 23 ALA H H 23 8.392 8.392 8.453 -0.061 19707 2133 1 5 . 1 1 24 24 SER N N 24 112.377 112.377 114.551 -2.174 19707 2134 1 5 . 1 1 24 24 SER HA H 24 4.214 4.214 4.262 -0.048 19707 2135 1 5 . 1 1 24 24 SER C C 24 174.773 174.773 176.261 -1.488 19707 2136 1 5 . 1 1 24 24 SER CA C 24 59.258 59.258 62.660 -3.402 19707 2137 1 5 . 1 1 24 24 SER CB C 24 60.149 60.149 63.165 -3.016 19707 2138 1 5 . 1 1 24 24 SER H H 24 7.690 7.690 7.656 0.034 19707 2139 1 5 . 1 1 25 25 ILE N N 25 123.886 123.886 123.009 0.877 19707 2140 1 5 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.002 -0.160 19707 2141 1 5 . 1 1 25 25 ILE C C 25 176.487 176.487 178.035 -1.548 19707 2142 1 5 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.867 -0.874 19707 2143 1 5 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.410 -0.478 19707 2144 1 5 . 1 1 25 25 ILE H H 25 7.837 7.837 8.078 -0.241 19707 2145 1 5 . 1 1 26 26 VAL N N 26 122.538 122.538 121.082 1.456 19707 2146 1 5 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.717 -0.329 19707 2147 1 5 . 1 1 26 26 VAL C C 26 174.624 174.624 177.992 -3.368 19707 2148 1 5 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.310 -2.395 19707 2149 1 5 . 1 1 26 26 VAL CB C 26 27.895 27.895 30.880 -2.985 19707 2150 1 5 . 1 1 26 26 VAL H H 26 8.804 8.804 8.739 0.065 19707 2151 1 5 . 1 1 27 27 ASP N N 27 120.433 120.433 120.768 -0.335 19707 2152 1 5 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.323 -0.159 19707 2153 1 5 . 1 1 27 27 ASP C C 27 174.966 174.966 178.451 -3.485 19707 2154 1 5 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.549 -2.220 19707 2155 1 5 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.703 -2.849 19707 2156 1 5 . 1 1 27 27 ASP H H 27 8.719 8.719 8.596 0.123 19707 2157 1 5 . 1 1 28 28 SER N N 28 112.397 112.397 114.992 -2.595 19707 2158 1 5 . 1 1 28 28 SER HA H 28 4.073 4.073 4.204 -0.131 19707 2159 1 5 . 1 1 28 28 SER C C 28 174.405 174.405 176.567 -2.162 19707 2160 1 5 . 1 1 28 28 SER CA C 28 59.115 59.115 61.822 -2.707 19707 2161 1 5 . 1 1 28 28 SER CB C 28 60.125 60.125 63.111 -2.986 19707 2162 1 5 . 1 1 28 28 SER H H 28 7.599 7.599 8.235 -0.636 19707 2163 1 5 . 1 1 29 29 ARG N N 29 123.945 123.945 122.325 1.620 19707 2164 1 5 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.949 0.078 19707 2165 1 5 . 1 1 29 29 ARG C C 29 175.902 175.902 177.960 -2.058 19707 2166 1 5 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.677 -3.403 19707 2167 1 5 . 1 1 29 29 ARG CB C 29 27.740 27.740 28.931 -1.191 19707 2168 1 5 . 1 1 29 29 ARG H H 29 7.769 7.769 7.620 0.149 19707 2169 1 5 . 1 1 30 30 LEU N N 30 121.580 121.580 120.857 0.723 19707 2170 1 5 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.983 -0.234 19707 2171 1 5 . 1 1 30 30 LEU C C 30 177.474 177.474 179.588 -2.114 19707 2172 1 5 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.903 -2.590 19707 2173 1 5 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.837 -2.808 19707 2174 1 5 . 1 1 30 30 LEU H H 30 8.665 8.665 8.314 0.351 19707 2175 1 5 . 1 1 31 31 ILE N N 31 119.330 119.330 117.054 2.276 19707 2176 1 5 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.772 -0.081 19707 2177 1 5 . 1 1 31 31 ILE C C 31 175.341 175.341 177.796 -2.455 19707 2178 1 5 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.036 -2.524 19707 2179 1 5 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.901 -2.334 19707 2180 1 5 . 1 1 31 31 ILE H H 31 8.226 8.226 8.383 -0.157 19707 2181 1 5 . 1 1 32 32 GLY N N 32 106.092 106.092 105.945 0.147 19707 2182 1 5 . 1 1 32 32 GLY C C 32 172.413 172.413 175.167 -2.754 19707 2183 1 5 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.741 -3.244 19707 2184 1 5 . 1 1 32 32 GLY H H 32 7.767 7.767 7.725 0.042 19707 2185 1 5 . 1 1 33 33 THR N N 33 110.966 110.966 112.830 -1.864 19707 2186 1 5 . 1 1 33 33 THR HA H 33 4.455 4.455 4.355 0.100 19707 2187 1 5 . 1 1 33 33 THR C C 33 172.714 172.714 174.800 -2.086 19707 2188 1 5 . 1 1 33 33 THR CA C 33 60.032 60.032 62.904 -2.872 19707 2189 1 5 . 1 1 33 33 THR CB C 33 68.287 68.287 70.056 -1.769 19707 2190 1 5 . 1 1 33 33 THR H H 33 8.102 8.102 7.818 0.284 19707 2191 1 5 . 1 1 34 34 GLY N N 34 110.320 110.320 111.859 -1.539 19707 2192 1 5 . 1 1 34 34 GLY C C 34 170.505 170.505 173.301 -2.796 19707 2193 1 5 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.117 -2.534 19707 2194 1 5 . 1 1 34 34 GLY H H 34 8.072 8.072 8.234 -0.162 19707 2195 1 5 . 1 1 35 35 SER N N 35 112.944 112.944 113.466 -0.522 19707 2196 1 5 . 1 1 35 35 SER HA H 35 4.385 4.385 4.811 -0.426 19707 2197 1 5 . 1 1 35 35 SER C C 35 169.537 169.537 172.949 -3.412 19707 2198 1 5 . 1 1 35 35 SER CA C 35 54.794 54.794 57.346 -2.553 19707 2199 1 5 . 1 1 35 35 SER CB C 35 62.029 62.029 65.740 -3.711 19707 2200 1 5 . 1 1 35 35 SER H H 35 7.719 7.719 7.467 0.252 19707 2201 1 5 . 1 1 36 36 VAL N N 36 118.566 118.566 122.881 -4.315 19707 2202 1 5 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.113 -0.080 19707 2203 1 5 . 1 1 36 36 VAL C C 36 169.876 169.876 175.023 -5.147 19707 2204 1 5 . 1 1 36 36 VAL CA C 36 58.565 58.565 61.947 -3.381 19707 2205 1 5 . 1 1 36 36 VAL CB C 36 30.952 30.952 32.836 -1.884 19707 2206 1 5 . 1 1 36 36 VAL H H 36 8.490 8.490 8.301 0.189 19707 2207 1 5 . 1 1 37 37 ASP N N 37 121.640 121.640 126.272 -4.632 19707 2208 1 5 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.940 -0.138 19707 2209 1 5 . 1 1 37 37 ASP C C 37 172.806 172.806 176.802 -3.996 19707 2210 1 5 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.526 -3.483 19707 2211 1 5 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.563 -3.357 19707 2212 1 5 . 1 1 37 37 ASP H H 37 7.195 7.195 8.159 -0.964 19707 2213 1 5 . 1 1 38 38 GLU N N 38 120.018 120.018 121.181 -1.163 19707 2214 1 5 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.905 -0.248 19707 2215 1 5 . 1 1 38 38 GLU C C 38 174.753 174.753 177.865 -3.112 19707 2216 1 5 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.384 -2.892 19707 2217 1 5 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.745 -3.666 19707 2218 1 5 . 1 1 38 38 GLU H H 38 8.908 8.908 8.820 0.088 19707 2219 1 5 . 1 1 39 39 ASP N N 39 118.668 118.668 117.686 0.982 19707 2220 1 5 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.460 -0.214 19707 2221 1 5 . 1 1 39 39 ASP C C 39 175.393 175.393 177.798 -2.405 19707 2222 1 5 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.419 -1.555 19707 2223 1 5 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.502 -3.532 19707 2224 1 5 . 1 1 39 39 ASP H H 39 8.242 8.242 8.618 -0.376 19707 2225 1 5 . 1 1 40 40 PHE N N 40 119.851 119.851 119.148 0.703 19707 2226 1 5 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.441 -0.237 19707 2227 1 5 . 1 1 40 40 PHE C C 40 174.929 174.929 175.990 -1.061 19707 2228 1 5 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.519 -2.348 19707 2229 1 5 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.881 -3.048 19707 2230 1 5 . 1 1 40 40 PHE H H 40 8.037 8.037 7.831 0.206 19707 2231 1 5 . 1 1 41 41 LEU N N 41 117.882 117.882 117.758 0.124 19707 2232 1 5 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.089 -0.567 19707 2233 1 5 . 1 1 41 41 LEU C C 41 175.938 175.938 178.828 -2.890 19707 2234 1 5 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.422 -1.562 19707 2235 1 5 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.526 -3.295 19707 2236 1 5 . 1 1 41 41 LEU H H 41 7.816 7.816 7.613 0.203 19707 2237 1 5 . 1 1 42 42 ARG N N 42 118.360 118.360 119.234 -0.874 19707 2238 1 5 . 1 1 42 42 ARG HA H 42 3.740 3.740 3.978 -0.238 19707 2239 1 5 . 1 1 42 42 ARG C C 42 175.435 175.435 176.879 -1.444 19707 2240 1 5 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.017 -2.046 19707 2241 1 5 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.962 -2.699 19707 2242 1 5 . 1 1 42 42 ARG H H 42 8.540 8.540 8.005 0.535 19707 2243 1 5 . 1 1 43 43 GLU N N 43 114.947 114.947 116.031 -1.084 19707 2244 1 5 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.294 -0.244 19707 2245 1 5 . 1 1 43 43 GLU C C 43 174.518 174.518 176.844 -2.326 19707 2246 1 5 . 1 1 43 43 GLU CA C 43 54.571 54.571 56.883 -2.312 19707 2247 1 5 . 1 1 43 43 GLU CB C 43 26.041 26.041 28.944 -2.903 19707 2248 1 5 . 1 1 43 43 GLU H H 43 7.223 7.223 8.201 -0.978 19707 2249 1 5 . 1 1 44 44 GLN N N 44 114.109 114.109 116.960 -2.851 19707 2250 1 5 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.454 -0.348 19707 2251 1 5 . 1 1 44 44 GLN C C 44 173.777 173.777 177.661 -3.884 19707 2252 1 5 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.437 -3.256 19707 2253 1 5 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.513 -3.643 19707 2254 1 5 . 1 1 44 44 GLN H H 44 7.372 7.372 8.275 -0.903 19707 2255 1 5 . 1 1 45 45 ILE N N 45 117.470 117.470 118.865 -1.395 19707 2256 1 5 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.580 0.368 19707 2257 1 5 . 1 1 45 45 ILE C C 45 172.305 172.305 176.744 -4.439 19707 2258 1 5 . 1 1 45 45 ILE CA C 45 58.505 58.505 65.601 -7.096 19707 2259 1 5 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.599 -1.899 19707 2260 1 5 . 1 1 45 45 ILE H H 45 7.235 7.235 7.349 -0.114 19707 2261 1 5 . 1 1 46 46 ARG N N 46 122.996 122.996 115.109 7.887 19707 2262 1 5 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.953 0.237 19707 2263 1 5 . 1 1 46 46 ARG C C 46 172.992 172.992 175.509 -2.517 19707 2264 1 5 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.172 -4.411 19707 2265 1 5 . 1 1 46 46 ARG CB C 46 27.952 27.952 27.783 0.169 19707 2266 1 5 . 1 1 46 46 ARG H H 46 8.336 8.336 8.869 -0.533 19707 2267 1 5 . 1 1 47 47 ASP N N 47 118.676 118.676 117.104 1.572 19707 2268 1 5 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.661 -0.213 19707 2269 1 5 . 1 1 47 47 ASP C C 47 172.520 172.520 174.741 -2.221 19707 2270 1 5 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.553 -2.663 19707 2271 1 5 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.715 -5.058 19707 2272 1 5 . 1 1 47 47 ASP H H 47 8.313 8.313 8.117 0.196 19707 2273 1 5 . 1 1 48 48 ALA N N 48 120.922 120.922 121.737 -0.815 19707 2274 1 5 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.485 -0.116 19707 2275 1 5 . 1 1 48 48 ALA C C 48 174.295 174.295 176.831 -2.536 19707 2276 1 5 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.292 -1.655 19707 2277 1 5 . 1 1 48 48 ALA CB C 48 16.214 16.214 20.280 -4.066 19707 2278 1 5 . 1 1 48 48 ALA H H 48 7.824 7.824 7.340 0.484 19707 2279 1 5 . 1 1 49 49 ARG N N 49 118.644 118.644 119.798 -1.154 19707 2280 1 5 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.019 0.323 19707 2281 1 5 . 1 1 49 49 ARG C C 49 172.504 172.504 176.366 -3.862 19707 2282 1 5 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.605 -3.696 19707 2283 1 5 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.502 -2.159 19707 2284 1 5 . 1 1 49 49 ARG H H 49 7.911 7.911 8.650 -0.739 19707 2285 1 5 . 1 1 50 50 TYR N N 50 119.470 119.470 114.585 4.885 19707 2286 1 5 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.043 0.248 19707 2287 1 5 . 1 1 50 50 TYR C C 50 170.470 170.470 174.295 -3.825 19707 2288 1 5 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.050 -1.782 19707 2289 1 5 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.134 -0.621 19707 2290 1 5 . 1 1 50 50 TYR H H 50 7.639 7.639 7.989 -0.350 19707 2291 1 5 . 1 1 51 51 ALA N N 51 127.418 127.418 125.949 1.469 19707 2292 1 5 . 1 1 51 51 ALA HA H 51 5.221 5.221 4.918 0.303 19707 2293 1 5 . 1 1 51 51 ALA C C 51 171.328 171.328 175.408 -4.080 19707 2294 1 5 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.353 -2.920 19707 2295 1 5 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.410 -1.098 19707 2296 1 5 . 1 1 51 51 ALA H H 51 8.222 8.222 8.843 -0.621 19707 2297 1 5 . 1 1 52 52 VAL N N 52 117.832 117.832 121.047 -3.215 19707 2298 1 5 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.109 -0.442 19707 2299 1 5 . 1 1 52 52 VAL C C 52 172.436 172.436 174.463 -2.027 19707 2300 1 5 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.746 -2.989 19707 2301 1 5 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.125 -4.022 19707 2302 1 5 . 1 1 52 52 VAL H H 52 8.753 8.753 9.011 -0.258 19707 2303 1 5 . 1 1 53 53 ILE N N 53 128.027 128.027 125.873 2.154 19707 2304 1 5 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.552 0.290 19707 2305 1 5 . 1 1 53 53 ILE C C 53 172.110 172.110 174.217 -2.107 19707 2306 1 5 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.640 -2.887 19707 2307 1 5 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.031 -2.872 19707 2308 1 5 . 1 1 53 53 ILE H H 53 9.261 9.261 8.953 0.308 19707 2309 1 5 . 1 1 54 54 ARG N N 54 127.885 127.885 127.714 0.171 19707 2310 1 5 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.593 0.160 19707 2311 1 5 . 1 1 54 54 ARG C C 54 172.285 172.285 174.316 -2.031 19707 2312 1 5 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.924 -1.664 19707 2313 1 5 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.616 -2.724 19707 2314 1 5 . 1 1 54 54 ARG H H 54 8.686 8.686 8.200 0.486 19707 2315 1 5 . 1 1 55 55 ILE N N 55 129.907 129.907 123.260 6.647 19707 2316 1 5 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.165 -0.012 19707 2317 1 5 . 1 1 55 55 ILE CA C 55 55.595 55.595 59.888 -4.293 19707 2318 1 5 . 1 1 55 55 ILE CB C 55 37.613 37.613 38.029 -0.416 19707 2319 1 5 . 1 1 55 55 ILE H H 55 9.292 9.292 8.169 1.123 19707 2320 1 5 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.288 -0.096 19707 2321 1 5 . 1 1 56 56 PRO C C 56 174.787 174.787 177.635 -2.848 19707 2322 1 5 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.073 -2.339 19707 2323 1 5 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.846 -2.933 19707 2324 1 5 . 1 1 57 57 GLY N N 57 111.828 111.828 111.450 0.378 19707 2325 1 5 . 1 1 57 57 GLY C C 57 171.039 171.039 173.575 -2.536 19707 2326 1 5 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.948 -2.131 19707 2327 1 5 . 1 1 57 57 GLY H H 57 8.708 8.708 8.894 -0.186 19707 2328 1 5 . 1 1 58 58 GLN N N 58 118.457 118.457 119.872 -1.415 19707 2329 1 5 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.777 0.123 19707 2330 1 5 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.125 -2.853 19707 2331 1 5 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.797 -2.643 19707 2332 1 5 . 1 1 58 58 GLN H H 58 7.909 7.909 7.539 0.370 19707 2333 1 5 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.416 0.020 19707 2334 1 5 . 1 1 59 59 PRO C C 59 174.607 174.607 176.322 -1.715 19707 2335 1 5 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.639 -2.584 19707 2336 1 5 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.091 -2.914 19707 2337 1 5 . 1 1 60 60 VAL N N 60 122.695 122.695 123.251 -0.556 19707 2338 1 5 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.179 -0.224 19707 2339 1 5 . 1 1 60 60 VAL C C 60 172.403 172.403 175.139 -2.736 19707 2340 1 5 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.563 -1.668 19707 2341 1 5 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.632 -2.990 19707 2342 1 5 . 1 1 60 60 VAL H H 60 8.364 8.364 8.221 0.143 19707 2343 1 5 . 1 1 61 61 VAL N N 61 126.097 126.097 127.585 -1.488 19707 2344 1 5 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.477 -0.177 19707 2345 1 5 . 1 1 61 61 VAL C C 61 170.891 170.891 173.769 -2.878 19707 2346 1 5 . 1 1 61 61 VAL CA C 61 58.814 58.814 60.710 -1.896 19707 2347 1 5 . 1 1 61 61 VAL CB C 61 31.198 31.198 35.634 -4.436 19707 2348 1 5 . 1 1 61 61 VAL H H 61 8.023 8.023 8.431 -0.408 19707 2349 1 5 . 1 1 62 62 GLU N N 62 126.097 126.097 126.798 -0.701 19707 2350 1 5 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.005 0.154 19707 2351 1 5 . 1 1 62 62 GLU C C 62 172.252 172.252 175.333 -3.081 19707 2352 1 5 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.210 -3.670 19707 2353 1 5 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.517 -2.217 19707 2354 1 5 . 1 1 62 62 GLU H H 62 8.591 8.591 8.479 0.112 19707 2355 1 5 . 1 1 63 63 VAL N N 63 120.374 120.374 123.382 -3.008 19707 2356 1 5 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.441 -0.048 19707 2357 1 5 . 1 1 63 63 VAL C C 63 171.040 171.040 176.629 -5.589 19707 2358 1 5 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.674 -3.841 19707 2359 1 5 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.587 -0.010 19707 2360 1 5 . 1 1 63 63 VAL H H 63 8.732 8.732 8.947 -0.215 19707 2361 1 5 . 1 1 64 64 GLY N N 64 109.935 109.935 114.051 -4.116 19707 2362 1 5 . 1 1 64 64 GLY C C 64 171.656 171.656 174.081 -2.425 19707 2363 1 5 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.021 -4.844 19707 2364 1 5 . 1 1 64 64 GLY H H 64 8.259 8.259 8.344 -0.085 19707 2365 1 5 . 1 1 65 65 THR N N 65 115.478 115.478 115.393 0.085 19707 2366 1 5 . 1 1 65 65 THR HA H 65 4.342 4.342 4.286 0.056 19707 2367 1 5 . 1 1 65 65 THR C C 65 170.663 170.663 172.238 -1.575 19707 2368 1 5 . 1 1 65 65 THR CA C 65 58.357 58.357 59.995 -1.637 19707 2369 1 5 . 1 1 65 65 THR CB C 65 67.923 67.923 71.504 -3.582 19707 2370 1 5 . 1 1 65 65 THR H H 65 8.123 8.123 7.612 0.511 19707 2371 1 5 . 1 1 66 66 LYS N N 66 130.775 130.775 124.227 6.548 19707 2372 1 5 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.252 -1.322 19707 2373 1 5 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.585 -2.395 19707 2374 1 5 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.883 -3.193 19707 2375 1 5 . 1 1 66 66 LYS H H 66 8.472 8.472 8.152 0.320 19707 2376 1 5 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.595 -0.184 19707 2377 1 5 . 1 1 67 67 PRO C C 67 173.211 173.211 177.051 -3.840 19707 2378 1 5 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.265 -2.699 19707 2379 1 5 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.384 -2.981 19707 2380 1 5 . 1 1 68 68 THR N N 68 111.983 111.983 114.421 -2.438 19707 2381 1 5 . 1 1 68 68 THR HA H 68 4.277 4.277 4.237 0.040 19707 2382 1 5 . 1 1 68 68 THR C C 68 171.720 171.720 175.566 -3.846 19707 2383 1 5 . 1 1 68 68 THR CA C 68 58.193 58.193 63.267 -5.074 19707 2384 1 5 . 1 1 68 68 THR CB C 68 67.723 67.723 69.158 -1.435 19707 2385 1 5 . 1 1 68 68 THR H H 68 8.091 8.091 8.226 -0.135 19707 2386 1 5 . 1 1 69 69 GLY N N 69 109.918 109.918 108.719 1.199 19707 2387 1 5 . 1 1 69 69 GLY C C 69 170.783 170.783 174.497 -3.714 19707 2388 1 5 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.733 -2.677 19707 2389 1 5 . 1 1 69 69 GLY H H 69 8.119 8.119 8.065 0.054 19707 2390 1 5 . 1 1 70 70 ASP N N 70 123.294 123.294 124.731 -1.437 19707 2391 1 5 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.843 -0.294 19707 2392 1 5 . 1 1 70 70 ASP C C 70 173.651 173.651 175.089 -1.438 19707 2393 1 5 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.622 -2.761 19707 2394 1 5 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.479 -1.746 19707 2395 1 5 . 1 1 70 70 ASP H H 70 8.444 8.444 8.692 -0.248 19707 2396 1 5 . 1 1 71 71 VAL N N 71 117.772 117.772 114.362 3.410 19707 2397 1 5 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.091 -0.384 19707 2398 1 5 . 1 1 71 71 VAL C C 71 172.992 172.992 174.247 -1.255 19707 2399 1 5 . 1 1 71 71 VAL CA C 71 57.376 57.376 58.989 -1.613 19707 2400 1 5 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.357 -2.335 19707 2401 1 5 . 1 1 71 71 VAL H H 71 8.173 8.173 7.769 0.404 19707 2402 1 5 . 1 1 72 72 LEU N N 72 123.435 123.435 122.839 0.596 19707 2403 1 5 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.605 0.031 19707 2404 1 5 . 1 1 72 72 LEU C C 72 173.189 173.189 176.010 -2.821 19707 2405 1 5 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.209 -3.002 19707 2406 1 5 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.069 -1.431 19707 2407 1 5 . 1 1 72 72 LEU H H 72 8.859 8.859 8.907 -0.048 19707 2408 1 5 . 1 1 73 73 GLN N N 73 119.520 119.520 122.136 -2.616 19707 2409 1 5 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.235 0.110 19707 2410 1 5 . 1 1 73 73 GLN C C 73 172.249 172.249 175.874 -3.625 19707 2411 1 5 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.255 -2.922 19707 2412 1 5 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.402 -1.632 19707 2413 1 5 . 1 1 73 73 GLN H H 73 9.196 9.196 8.309 0.887 19707 2414 1 5 . 1 1 74 74 GLY N N 74 113.513 113.513 111.464 2.049 19707 2415 1 5 . 1 1 74 74 GLY C C 74 169.072 169.072 172.436 -3.364 19707 2416 1 5 . 1 1 74 74 GLY CA C 74 41.297 41.297 44.196 -2.899 19707 2417 1 5 . 1 1 74 74 GLY H H 74 9.373 9.373 9.072 0.301 19707 2418 1 5 . 1 1 75 75 ARG N N 75 122.479 122.479 120.543 1.936 19707 2419 1 5 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.421 0.081 19707 2420 1 5 . 1 1 75 75 ARG C C 75 172.348 172.348 174.403 -2.055 19707 2421 1 5 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.276 -3.518 19707 2422 1 5 . 1 1 75 75 ARG CB C 75 31.818 31.818 35.534 -3.716 19707 2423 1 5 . 1 1 75 75 ARG H H 75 8.615 8.615 8.287 0.328 19707 2424 1 5 . 1 1 76 76 ALA N N 76 122.346 122.346 121.820 0.526 19707 2425 1 5 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.710 -0.174 19707 2426 1 5 . 1 1 76 76 ALA C C 76 172.704 172.704 174.488 -1.784 19707 2427 1 5 . 1 1 76 76 ALA CA C 76 49.027 49.027 52.147 -3.120 19707 2428 1 5 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.247 -2.222 19707 2429 1 5 . 1 1 76 76 ALA H H 76 8.590 8.590 8.551 0.039 19707 2430 1 5 . 1 1 77 77 THR N N 77 116.961 116.961 115.971 0.990 19707 2431 1 5 . 1 1 77 77 THR HA H 77 4.988 4.988 5.195 -0.207 19707 2432 1 5 . 1 1 77 77 THR C C 77 172.800 172.800 174.950 -2.150 19707 2433 1 5 . 1 1 77 77 THR CA C 77 58.344 58.344 60.995 -2.651 19707 2434 1 5 . 1 1 77 77 THR CB C 77 67.712 67.712 70.599 -2.887 19707 2435 1 5 . 1 1 77 77 THR H H 77 8.491 8.491 8.306 0.185 19707 2436 1 5 . 1 1 78 78 GLY N N 78 111.103 111.103 112.170 -1.067 19707 2437 1 5 . 1 1 78 78 GLY C C 78 172.567 172.567 174.908 -2.341 19707 2438 1 5 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.622 -2.313 19707 2439 1 5 . 1 1 78 78 GLY H H 78 8.649 8.649 8.463 0.186 19707 2440 1 5 . 1 1 79 79 GLU N N 79 123.423 123.423 119.228 4.195 19707 2441 1 5 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.332 -0.336 19707 2442 1 5 . 1 1 79 79 GLU C C 79 175.466 175.466 177.403 -1.937 19707 2443 1 5 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.973 -2.514 19707 2444 1 5 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.645 -3.578 19707 2445 1 5 . 1 1 79 79 GLU H H 79 10.375 10.375 8.741 1.634 19707 2446 1 5 . 1 1 80 80 GLU N N 80 113.846 113.846 117.168 -3.322 19707 2447 1 5 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.450 -0.092 19707 2448 1 5 . 1 1 80 80 GLU C C 80 173.293 173.293 176.972 -3.679 19707 2449 1 5 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.959 -4.183 19707 2450 1 5 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.603 -4.872 19707 2451 1 5 . 1 1 80 80 GLU H H 80 7.679 7.679 8.606 -0.927 19707 2452 1 5 . 1 1 81 81 GLY N N 81 105.493 105.493 109.023 -3.530 19707 2453 1 5 . 1 1 81 81 GLY C C 81 170.427 170.427 173.714 -3.287 19707 2454 1 5 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.147 -2.535 19707 2455 1 5 . 1 1 81 81 GLY H H 81 7.476 7.476 7.693 -0.217 19707 2456 1 5 . 1 1 82 82 GLU N N 82 122.160 122.160 119.731 2.429 19707 2457 1 5 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.348 0.606 19707 2458 1 5 . 1 1 82 82 GLU C C 82 171.004 171.004 175.025 -4.021 19707 2459 1 5 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.697 -4.376 19707 2460 1 5 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.692 -4.626 19707 2461 1 5 . 1 1 82 82 GLU H H 82 9.585 9.585 8.110 1.475 19707 2462 1 5 . 1 1 83 83 THR N N 83 114.756 114.756 115.584 -0.828 19707 2463 1 5 . 1 1 83 83 THR HA H 83 4.990 4.990 5.095 -0.105 19707 2464 1 5 . 1 1 83 83 THR C C 83 170.909 170.909 173.287 -2.378 19707 2465 1 5 . 1 1 83 83 THR CA C 83 57.957 57.957 61.689 -3.732 19707 2466 1 5 . 1 1 83 83 THR CB C 83 68.271 68.271 71.250 -2.979 19707 2467 1 5 . 1 1 83 83 THR H H 83 8.490 8.490 8.272 0.218 19707 2468 1 5 . 1 1 84 84 VAL N N 84 122.639 122.639 125.608 -2.969 19707 2469 1 5 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.591 0.064 19707 2470 1 5 . 1 1 84 84 VAL C C 84 170.962 170.962 173.776 -2.814 19707 2471 1 5 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.095 -2.798 19707 2472 1 5 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.879 -2.655 19707 2473 1 5 . 1 1 84 84 VAL H H 84 9.001 9.001 8.953 0.048 19707 2474 1 5 . 1 1 85 85 LEU N N 85 129.903 129.903 126.506 3.397 19707 2475 1 5 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.532 -0.140 19707 2476 1 5 . 1 1 85 85 LEU C C 85 172.346 172.346 174.625 -2.279 19707 2477 1 5 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.151 -2.354 19707 2478 1 5 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.889 -4.374 19707 2479 1 5 . 1 1 85 85 LEU H H 85 8.610 8.610 8.639 -0.029 19707 2480 1 5 . 1 1 86 86 VAL N N 86 122.778 122.778 122.349 0.429 19707 2481 1 5 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.838 0.203 19707 2482 1 5 . 1 1 86 86 VAL C C 86 172.570 172.570 174.217 -1.647 19707 2483 1 5 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.213 -4.013 19707 2484 1 5 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.902 -3.627 19707 2485 1 5 . 1 1 86 86 VAL H H 86 9.228 9.228 8.899 0.329 19707 2486 1 5 . 1 1 87 87 GLU N N 87 120.437 120.437 125.396 -4.959 19707 2487 1 5 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.563 0.168 19707 2488 1 5 . 1 1 87 87 GLU C C 87 172.267 172.267 174.958 -2.691 19707 2489 1 5 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.530 -3.181 19707 2490 1 5 . 1 1 87 87 GLU CB C 87 31.124 31.124 34.162 -3.038 19707 2491 1 5 . 1 1 87 87 GLU H H 87 8.851 8.851 9.249 -0.398 19707 2492 1 5 . 1 1 88 88 GLU N N 88 118.525 118.525 121.810 -3.285 19707 2493 1 5 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.782 0.219 19707 2494 1 5 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.112 -3.195 19707 2495 1 5 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.830 -2.883 19707 2496 1 5 . 1 1 88 88 GLU H H 88 8.380 8.380 8.829 -0.449 19707 2497 1 5 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.386 0.143 19707 2498 1 5 . 1 1 89 89 PRO C C 89 172.774 172.774 176.738 -3.964 19707 2499 1 5 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.188 -2.807 19707 2500 1 5 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.080 -2.746 19707 2501 1 6 . 1 1 2 2 SER N N 2 115.963 115.963 116.771 -0.808 19707 2502 1 6 . 1 1 2 2 SER HA H 2 4.408 4.408 4.626 -0.218 19707 2503 1 6 . 1 1 2 2 SER C C 2 171.788 171.788 174.680 -2.892 19707 2504 1 6 . 1 1 2 2 SER CA C 2 55.870 55.870 57.534 -1.664 19707 2505 1 6 . 1 1 2 2 SER CB C 2 61.022 61.022 63.998 -2.976 19707 2506 1 6 . 1 1 2 2 SER H H 2 8.661 8.661 8.297 0.364 19707 2507 1 6 . 1 1 3 3 GLU N N 3 122.941 122.941 122.113 0.828 19707 2508 1 6 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.381 -0.061 19707 2509 1 6 . 1 1 3 3 GLU C C 3 173.817 173.817 176.906 -3.089 19707 2510 1 6 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.893 -1.939 19707 2511 1 6 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.046 -3.209 19707 2512 1 6 . 1 1 3 3 GLU H H 3 8.706 8.706 8.523 0.183 19707 2513 1 6 . 1 1 4 4 THR N N 4 116.182 116.182 112.804 3.378 19707 2514 1 6 . 1 1 4 4 THR HA H 4 4.233 4.233 4.358 -0.125 19707 2515 1 6 . 1 1 4 4 THR C C 4 171.719 171.719 174.866 -3.147 19707 2516 1 6 . 1 1 4 4 THR CA C 4 59.414 59.414 62.979 -3.565 19707 2517 1 6 . 1 1 4 4 THR CB C 4 67.009 67.009 69.887 -2.878 19707 2518 1 6 . 1 1 4 4 THR H H 4 8.165 8.165 8.373 -0.208 19707 2519 1 6 . 1 1 5 5 ARG N N 5 124.184 124.184 120.430 3.754 19707 2520 1 6 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.593 -0.233 19707 2521 1 6 . 1 1 5 5 ARG C C 5 173.520 173.520 176.327 -2.807 19707 2522 1 6 . 1 1 5 5 ARG CA C 5 53.343 53.343 56.772 -3.429 19707 2523 1 6 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.336 -2.171 19707 2524 1 6 . 1 1 5 5 ARG H H 5 8.354 8.354 8.876 -0.522 19707 2525 1 6 . 1 1 6 6 THR N N 6 116.652 116.652 114.078 2.574 19707 2526 1 6 . 1 1 6 6 THR HA H 6 4.263 4.263 4.358 -0.095 19707 2527 1 6 . 1 1 6 6 THR C C 6 171.784 171.784 173.680 -1.896 19707 2528 1 6 . 1 1 6 6 THR CA C 6 59.218 59.218 61.097 -1.879 19707 2529 1 6 . 1 1 6 6 THR CB C 6 67.213 67.213 69.523 -2.310 19707 2530 1 6 . 1 1 6 6 THR H H 6 8.224 8.224 7.610 0.614 19707 2531 1 6 . 1 1 7 7 ILE N N 7 123.882 123.882 121.592 2.290 19707 2532 1 6 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.399 -0.261 19707 2533 1 6 . 1 1 7 7 ILE C C 7 173.572 173.572 175.618 -2.046 19707 2534 1 6 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.910 -2.428 19707 2535 1 6 . 1 1 7 7 ILE CB C 7 36.069 36.069 39.093 -3.024 19707 2536 1 6 . 1 1 7 7 ILE H H 7 8.247 8.247 8.377 -0.130 19707 2537 1 6 . 1 1 8 8 SER N N 8 120.287 120.287 120.355 -0.068 19707 2538 1 6 . 1 1 8 8 SER HA H 8 4.445 4.445 4.347 0.098 19707 2539 1 6 . 1 1 8 8 SER C C 8 171.926 171.926 174.757 -2.831 19707 2540 1 6 . 1 1 8 8 SER CA C 8 55.522 55.522 58.954 -3.432 19707 2541 1 6 . 1 1 8 8 SER CB C 8 61.073 61.073 64.082 -3.009 19707 2542 1 6 . 1 1 8 8 SER H H 8 8.402 8.402 8.364 0.038 19707 2543 1 6 . 1 1 9 9 SER N N 9 118.425 118.425 119.059 -0.634 19707 2544 1 6 . 1 1 9 9 SER HA H 9 4.525 4.525 4.739 -0.214 19707 2545 1 6 . 1 1 9 9 SER C C 9 172.663 172.663 174.391 -1.728 19707 2546 1 6 . 1 1 9 9 SER CA C 9 55.897 55.897 58.791 -2.894 19707 2547 1 6 . 1 1 9 9 SER CB C 9 61.375 61.375 63.944 -2.569 19707 2548 1 6 . 1 1 9 9 SER H H 9 8.362 8.362 8.585 -0.223 19707 2549 1 6 . 1 1 10 10 THR N N 10 115.676 115.676 113.804 1.872 19707 2550 1 6 . 1 1 10 10 THR HA H 10 4.232 4.232 4.639 -0.407 19707 2551 1 6 . 1 1 10 10 THR C C 10 173.070 173.070 175.519 -2.449 19707 2552 1 6 . 1 1 10 10 THR CA C 10 60.318 60.318 62.595 -2.277 19707 2553 1 6 . 1 1 10 10 THR CB C 10 67.205 67.205 69.625 -2.420 19707 2554 1 6 . 1 1 10 10 THR H H 10 8.274 8.274 7.780 0.494 19707 2555 1 6 . 1 1 11 11 ALA N N 11 124.726 124.726 122.711 2.015 19707 2556 1 6 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.119 -0.132 19707 2557 1 6 . 1 1 11 11 ALA C C 11 176.825 176.825 179.266 -2.441 19707 2558 1 6 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.960 -2.419 19707 2559 1 6 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.487 -2.598 19707 2560 1 6 . 1 1 11 11 ALA H H 11 8.347 8.347 8.069 0.278 19707 2561 1 6 . 1 1 12 12 GLN N N 12 117.915 117.915 116.906 1.009 19707 2562 1 6 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.218 -0.429 19707 2563 1 6 . 1 1 12 12 GLN C C 12 174.697 174.697 177.018 -2.321 19707 2564 1 6 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.614 -2.610 19707 2565 1 6 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.768 -2.543 19707 2566 1 6 . 1 1 12 12 GLN H H 12 8.194 8.194 7.799 0.395 19707 2567 1 6 . 1 1 13 13 GLU N N 13 118.510 118.510 120.275 -1.765 19707 2568 1 6 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.130 -0.027 19707 2569 1 6 . 1 1 13 13 GLU C C 13 176.192 176.192 178.936 -2.744 19707 2570 1 6 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.804 -2.489 19707 2571 1 6 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.593 -3.560 19707 2572 1 6 . 1 1 13 13 GLU H H 13 7.917 7.917 8.305 -0.388 19707 2573 1 6 . 1 1 14 14 ARG N N 14 118.193 118.193 119.860 -1.667 19707 2574 1 6 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.098 -0.130 19707 2575 1 6 . 1 1 14 14 ARG C C 14 176.764 176.764 178.483 -1.719 19707 2576 1 6 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.186 -1.903 19707 2577 1 6 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.675 -2.438 19707 2578 1 6 . 1 1 14 14 ARG H H 14 7.907 7.907 8.546 -0.639 19707 2579 1 6 . 1 1 15 15 VAL N N 15 117.991 117.991 114.563 3.428 19707 2580 1 6 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.898 0.005 19707 2581 1 6 . 1 1 15 15 VAL C C 15 174.922 174.922 176.856 -1.934 19707 2582 1 6 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.718 -1.887 19707 2583 1 6 . 1 1 15 15 VAL CB C 15 28.723 28.723 30.816 -2.093 19707 2584 1 6 . 1 1 15 15 VAL H H 15 7.658 7.658 7.479 0.179 19707 2585 1 6 . 1 1 16 16 ASP N N 16 124.314 124.314 120.102 4.212 19707 2586 1 6 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.452 -0.136 19707 2587 1 6 . 1 1 16 16 ASP C C 16 176.462 176.462 178.189 -1.727 19707 2588 1 6 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.701 -2.375 19707 2589 1 6 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.385 -4.716 19707 2590 1 6 . 1 1 16 16 ASP H H 16 8.291 8.291 8.004 0.287 19707 2591 1 6 . 1 1 17 17 LEU N N 17 120.212 120.212 119.528 0.684 19707 2592 1 6 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.074 -0.020 19707 2593 1 6 . 1 1 17 17 LEU C C 17 177.171 177.171 179.058 -1.887 19707 2594 1 6 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.459 -2.479 19707 2595 1 6 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.876 -3.031 19707 2596 1 6 . 1 1 17 17 LEU H H 17 8.172 8.172 7.462 0.710 19707 2597 1 6 . 1 1 18 18 GLU N N 18 120.587 120.587 118.553 2.034 19707 2598 1 6 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.968 0.225 19707 2599 1 6 . 1 1 18 18 GLU C C 18 175.997 175.997 178.697 -2.700 19707 2600 1 6 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.406 -3.304 19707 2601 1 6 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.793 -2.721 19707 2602 1 6 . 1 1 18 18 GLU H H 18 7.876 7.876 7.919 -0.043 19707 2603 1 6 . 1 1 19 19 ALA N N 19 121.800 121.800 122.816 -1.016 19707 2604 1 6 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.092 -0.301 19707 2605 1 6 . 1 1 19 19 ALA C C 19 175.708 175.708 179.709 -4.001 19707 2606 1 6 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.975 -2.123 19707 2607 1 6 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.444 -4.290 19707 2608 1 6 . 1 1 19 19 ALA H H 19 7.792 7.792 7.550 0.242 19707 2609 1 6 . 1 1 20 20 VAL N N 20 118.680 118.680 119.160 -0.480 19707 2610 1 6 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.597 -0.297 19707 2611 1 6 . 1 1 20 20 VAL C C 20 176.276 176.276 177.955 -1.679 19707 2612 1 6 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.311 -2.504 19707 2613 1 6 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.580 -2.029 19707 2614 1 6 . 1 1 20 20 VAL H H 20 7.712 7.712 8.166 -0.454 19707 2615 1 6 . 1 1 21 21 ARG N N 21 121.935 121.935 120.783 1.152 19707 2616 1 6 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.078 -0.083 19707 2617 1 6 . 1 1 21 21 ARG C C 21 176.828 176.828 178.617 -1.789 19707 2618 1 6 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.317 -1.657 19707 2619 1 6 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.545 -2.255 19707 2620 1 6 . 1 1 21 21 ARG H H 21 8.444 8.444 8.275 0.169 19707 2621 1 6 . 1 1 22 22 LEU N N 22 119.327 119.327 119.588 -0.261 19707 2622 1 6 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.084 -0.089 19707 2623 1 6 . 1 1 22 22 LEU C C 22 175.664 175.664 178.592 -2.928 19707 2624 1 6 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.198 -3.330 19707 2625 1 6 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.533 -2.398 19707 2626 1 6 . 1 1 22 22 LEU H H 22 8.248 8.248 8.362 -0.114 19707 2627 1 6 . 1 1 23 23 ALA N N 23 121.202 121.202 122.149 -0.947 19707 2628 1 6 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.963 -0.228 19707 2629 1 6 . 1 1 23 23 ALA C C 23 175.492 175.492 179.639 -4.147 19707 2630 1 6 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.319 -2.250 19707 2631 1 6 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.013 -3.946 19707 2632 1 6 . 1 1 23 23 ALA H H 23 8.392 8.392 8.420 -0.028 19707 2633 1 6 . 1 1 24 24 SER N N 24 112.377 112.377 114.951 -2.574 19707 2634 1 6 . 1 1 24 24 SER HA H 24 4.214 4.214 4.278 -0.064 19707 2635 1 6 . 1 1 24 24 SER C C 24 174.773 174.773 176.297 -1.524 19707 2636 1 6 . 1 1 24 24 SER CA C 24 59.258 59.258 62.497 -3.239 19707 2637 1 6 . 1 1 24 24 SER CB C 24 60.149 60.149 63.114 -2.966 19707 2638 1 6 . 1 1 24 24 SER H H 24 7.690 7.690 7.968 -0.278 19707 2639 1 6 . 1 1 25 25 ILE N N 25 123.886 123.886 122.629 1.257 19707 2640 1 6 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.975 -0.133 19707 2641 1 6 . 1 1 25 25 ILE C C 25 176.487 176.487 178.063 -1.576 19707 2642 1 6 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.297 -0.304 19707 2643 1 6 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.489 -0.557 19707 2644 1 6 . 1 1 25 25 ILE H H 25 7.837 7.837 8.147 -0.310 19707 2645 1 6 . 1 1 26 26 VAL N N 26 122.538 122.538 121.316 1.222 19707 2646 1 6 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.566 -0.178 19707 2647 1 6 . 1 1 26 26 VAL C C 26 174.624 174.624 177.483 -2.859 19707 2648 1 6 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.517 -2.602 19707 2649 1 6 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.501 -3.606 19707 2650 1 6 . 1 1 26 26 VAL H H 26 8.804 8.804 8.662 0.142 19707 2651 1 6 . 1 1 27 27 ASP N N 27 120.433 120.433 120.137 0.296 19707 2652 1 6 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.311 -0.147 19707 2653 1 6 . 1 1 27 27 ASP C C 27 174.966 174.966 178.431 -3.465 19707 2654 1 6 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.599 -2.270 19707 2655 1 6 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.729 -2.875 19707 2656 1 6 . 1 1 27 27 ASP H H 27 8.719 8.719 8.460 0.259 19707 2657 1 6 . 1 1 28 28 SER N N 28 112.397 112.397 115.700 -3.303 19707 2658 1 6 . 1 1 28 28 SER HA H 28 4.073 4.073 4.188 -0.115 19707 2659 1 6 . 1 1 28 28 SER C C 28 174.405 174.405 176.726 -2.321 19707 2660 1 6 . 1 1 28 28 SER CA C 28 59.115 59.115 61.987 -2.872 19707 2661 1 6 . 1 1 28 28 SER CB C 28 60.125 60.125 63.118 -2.993 19707 2662 1 6 . 1 1 28 28 SER H H 28 7.599 7.599 8.166 -0.567 19707 2663 1 6 . 1 1 29 29 ARG N N 29 123.945 123.945 122.460 1.485 19707 2664 1 6 . 1 1 29 29 ARG HA H 29 4.027 4.027 4.000 0.027 19707 2665 1 6 . 1 1 29 29 ARG C C 29 175.902 175.902 178.185 -2.283 19707 2666 1 6 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.882 -3.608 19707 2667 1 6 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.231 -1.491 19707 2668 1 6 . 1 1 29 29 ARG H H 29 7.769 7.769 7.811 -0.042 19707 2669 1 6 . 1 1 30 30 LEU N N 30 121.580 121.580 120.541 1.039 19707 2670 1 6 . 1 1 30 30 LEU HA H 30 3.749 3.749 4.009 -0.260 19707 2671 1 6 . 1 1 30 30 LEU C C 30 177.474 177.474 179.638 -2.164 19707 2672 1 6 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.825 -2.512 19707 2673 1 6 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.840 -2.811 19707 2674 1 6 . 1 1 30 30 LEU H H 30 8.665 8.665 8.353 0.312 19707 2675 1 6 . 1 1 31 31 ILE N N 31 119.330 119.330 117.442 1.888 19707 2676 1 6 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.765 -0.074 19707 2677 1 6 . 1 1 31 31 ILE C C 31 175.341 175.341 177.721 -2.380 19707 2678 1 6 . 1 1 31 31 ILE CA C 31 61.512 61.512 63.878 -2.366 19707 2679 1 6 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.921 -2.354 19707 2680 1 6 . 1 1 31 31 ILE H H 31 8.226 8.226 8.344 -0.118 19707 2681 1 6 . 1 1 32 32 GLY N N 32 106.092 106.092 105.971 0.121 19707 2682 1 6 . 1 1 32 32 GLY C C 32 172.413 172.413 174.877 -2.464 19707 2683 1 6 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.596 -3.099 19707 2684 1 6 . 1 1 32 32 GLY H H 32 7.767 7.767 7.754 0.013 19707 2685 1 6 . 1 1 33 33 THR N N 33 110.966 110.966 112.669 -1.703 19707 2686 1 6 . 1 1 33 33 THR HA H 33 4.455 4.455 4.348 0.107 19707 2687 1 6 . 1 1 33 33 THR C C 33 172.714 172.714 174.732 -2.018 19707 2688 1 6 . 1 1 33 33 THR CA C 33 60.032 60.032 62.386 -2.354 19707 2689 1 6 . 1 1 33 33 THR CB C 33 68.287 68.287 69.778 -1.491 19707 2690 1 6 . 1 1 33 33 THR H H 33 8.102 8.102 7.873 0.229 19707 2691 1 6 . 1 1 34 34 GLY N N 34 110.320 110.320 110.407 -0.087 19707 2692 1 6 . 1 1 34 34 GLY C C 34 170.505 170.505 173.761 -3.256 19707 2693 1 6 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.109 -2.526 19707 2694 1 6 . 1 1 34 34 GLY H H 34 8.072 8.072 8.182 -0.110 19707 2695 1 6 . 1 1 35 35 SER N N 35 112.944 112.944 114.460 -1.516 19707 2696 1 6 . 1 1 35 35 SER HA H 35 4.385 4.385 4.826 -0.441 19707 2697 1 6 . 1 1 35 35 SER C C 35 169.537 169.537 172.460 -2.923 19707 2698 1 6 . 1 1 35 35 SER CA C 35 54.794 54.794 58.183 -3.389 19707 2699 1 6 . 1 1 35 35 SER CB C 35 62.029 62.029 66.728 -4.699 19707 2700 1 6 . 1 1 35 35 SER H H 35 7.719 7.719 7.604 0.115 19707 2701 1 6 . 1 1 36 36 VAL N N 36 118.566 118.566 122.570 -4.004 19707 2702 1 6 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.295 -0.262 19707 2703 1 6 . 1 1 36 36 VAL C C 36 169.876 169.876 173.785 -3.909 19707 2704 1 6 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.087 -1.522 19707 2705 1 6 . 1 1 36 36 VAL CB C 36 30.952 30.952 34.200 -3.248 19707 2706 1 6 . 1 1 36 36 VAL H H 36 8.490 8.490 8.482 0.008 19707 2707 1 6 . 1 1 37 37 ASP N N 37 121.640 121.640 126.877 -5.237 19707 2708 1 6 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.881 -0.079 19707 2709 1 6 . 1 1 37 37 ASP C C 37 172.806 172.806 176.621 -3.815 19707 2710 1 6 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.653 -3.610 19707 2711 1 6 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.347 -3.141 19707 2712 1 6 . 1 1 37 37 ASP H H 37 7.195 7.195 8.006 -0.811 19707 2713 1 6 . 1 1 38 38 GLU N N 38 120.018 120.018 121.110 -1.092 19707 2714 1 6 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.900 -0.243 19707 2715 1 6 . 1 1 38 38 GLU C C 38 174.753 174.753 177.217 -2.464 19707 2716 1 6 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.366 -2.874 19707 2717 1 6 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.682 -3.603 19707 2718 1 6 . 1 1 38 38 GLU H H 38 8.908 8.908 8.827 0.081 19707 2719 1 6 . 1 1 39 39 ASP N N 39 118.668 118.668 116.908 1.760 19707 2720 1 6 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.480 -0.234 19707 2721 1 6 . 1 1 39 39 ASP C C 39 175.393 175.393 177.687 -2.294 19707 2722 1 6 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.407 -1.543 19707 2723 1 6 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.313 -3.343 19707 2724 1 6 . 1 1 39 39 ASP H H 39 8.242 8.242 8.694 -0.452 19707 2725 1 6 . 1 1 40 40 PHE N N 40 119.851 119.851 118.342 1.509 19707 2726 1 6 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.515 -0.311 19707 2727 1 6 . 1 1 40 40 PHE C C 40 174.929 174.929 175.995 -1.066 19707 2728 1 6 . 1 1 40 40 PHE CA C 40 58.171 58.171 59.606 -1.435 19707 2729 1 6 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.311 -3.478 19707 2730 1 6 . 1 1 40 40 PHE H H 40 8.037 8.037 8.054 -0.017 19707 2731 1 6 . 1 1 41 41 LEU N N 41 117.882 117.882 118.982 -1.100 19707 2732 1 6 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.396 -0.874 19707 2733 1 6 . 1 1 41 41 LEU C C 41 175.938 175.938 178.539 -2.601 19707 2734 1 6 . 1 1 41 41 LEU CA C 41 54.860 54.860 55.895 -1.035 19707 2735 1 6 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.932 -3.701 19707 2736 1 6 . 1 1 41 41 LEU H H 41 7.816 7.816 7.450 0.366 19707 2737 1 6 . 1 1 42 42 ARG N N 42 118.360 118.360 119.508 -1.148 19707 2738 1 6 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.031 -0.291 19707 2739 1 6 . 1 1 42 42 ARG C C 42 175.435 175.435 177.259 -1.824 19707 2740 1 6 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.126 -2.155 19707 2741 1 6 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.910 -2.646 19707 2742 1 6 . 1 1 42 42 ARG H H 42 8.540 8.540 8.025 0.515 19707 2743 1 6 . 1 1 43 43 GLU N N 43 114.947 114.947 117.183 -2.236 19707 2744 1 6 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.251 -0.201 19707 2745 1 6 . 1 1 43 43 GLU C C 43 174.518 174.518 177.378 -2.860 19707 2746 1 6 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.683 -3.112 19707 2747 1 6 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.060 -3.019 19707 2748 1 6 . 1 1 43 43 GLU H H 43 7.223 7.223 8.449 -1.226 19707 2749 1 6 . 1 1 44 44 GLN N N 44 114.109 114.109 117.140 -3.031 19707 2750 1 6 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.351 -0.245 19707 2751 1 6 . 1 1 44 44 GLN C C 44 173.777 173.777 177.593 -3.816 19707 2752 1 6 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.734 -3.553 19707 2753 1 6 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.463 -3.593 19707 2754 1 6 . 1 1 44 44 GLN H H 44 7.372 7.372 8.007 -0.635 19707 2755 1 6 . 1 1 45 45 ILE N N 45 117.470 117.470 116.129 1.341 19707 2756 1 6 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.857 0.091 19707 2757 1 6 . 1 1 45 45 ILE C C 45 172.305 172.305 177.527 -5.222 19707 2758 1 6 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.821 -5.316 19707 2759 1 6 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.967 -2.267 19707 2760 1 6 . 1 1 45 45 ILE H H 45 7.235 7.235 7.449 -0.214 19707 2761 1 6 . 1 1 46 46 ARG N N 46 122.996 122.996 115.019 7.977 19707 2762 1 6 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.037 0.153 19707 2763 1 6 . 1 1 46 46 ARG C C 46 172.992 172.992 175.709 -2.717 19707 2764 1 6 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.214 -4.453 19707 2765 1 6 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.037 -0.085 19707 2766 1 6 . 1 1 46 46 ARG H H 46 8.336 8.336 8.686 -0.350 19707 2767 1 6 . 1 1 47 47 ASP N N 47 118.676 118.676 116.502 2.174 19707 2768 1 6 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.644 -0.196 19707 2769 1 6 . 1 1 47 47 ASP C C 47 172.520 172.520 175.118 -2.598 19707 2770 1 6 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.253 -2.363 19707 2771 1 6 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.722 -5.066 19707 2772 1 6 . 1 1 47 47 ASP H H 47 8.313 8.313 8.128 0.185 19707 2773 1 6 . 1 1 48 48 ALA N N 48 120.922 120.922 122.608 -1.686 19707 2774 1 6 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.554 -0.185 19707 2775 1 6 . 1 1 48 48 ALA C C 48 174.295 174.295 177.084 -2.789 19707 2776 1 6 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.441 -1.804 19707 2777 1 6 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.938 -3.724 19707 2778 1 6 . 1 1 48 48 ALA H H 48 7.824 7.824 7.304 0.520 19707 2779 1 6 . 1 1 49 49 ARG N N 49 118.644 118.644 119.437 -0.793 19707 2780 1 6 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.151 0.191 19707 2781 1 6 . 1 1 49 49 ARG C C 49 172.504 172.504 176.190 -3.686 19707 2782 1 6 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.479 -3.570 19707 2783 1 6 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.985 -2.642 19707 2784 1 6 . 1 1 49 49 ARG H H 49 7.911 7.911 8.412 -0.501 19707 2785 1 6 . 1 1 50 50 TYR N N 50 119.470 119.470 115.390 4.080 19707 2786 1 6 . 1 1 50 50 TYR HA H 50 5.291 5.291 4.959 0.332 19707 2787 1 6 . 1 1 50 50 TYR C C 50 170.470 170.470 174.178 -3.708 19707 2788 1 6 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.222 -1.954 19707 2789 1 6 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.461 -0.948 19707 2790 1 6 . 1 1 50 50 TYR H H 50 7.639 7.639 7.998 -0.359 19707 2791 1 6 . 1 1 51 51 ALA N N 51 127.418 127.418 125.135 2.283 19707 2792 1 6 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.144 0.077 19707 2793 1 6 . 1 1 51 51 ALA C C 51 171.328 171.328 175.501 -4.173 19707 2794 1 6 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.390 -2.957 19707 2795 1 6 . 1 1 51 51 ALA CB C 51 20.312 20.312 22.007 -1.695 19707 2796 1 6 . 1 1 51 51 ALA H H 51 8.222 8.222 8.515 -0.293 19707 2797 1 6 . 1 1 52 52 VAL N N 52 117.832 117.832 121.934 -4.102 19707 2798 1 6 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.077 -0.410 19707 2799 1 6 . 1 1 52 52 VAL C C 52 172.436 172.436 174.093 -1.657 19707 2800 1 6 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.520 -3.764 19707 2801 1 6 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.560 -4.457 19707 2802 1 6 . 1 1 52 52 VAL H H 52 8.753 8.753 8.994 -0.241 19707 2803 1 6 . 1 1 53 53 ILE N N 53 128.027 128.027 125.703 2.324 19707 2804 1 6 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.628 0.214 19707 2805 1 6 . 1 1 53 53 ILE C C 53 172.110 172.110 173.979 -1.869 19707 2806 1 6 . 1 1 53 53 ILE CA C 53 56.753 56.753 58.936 -2.183 19707 2807 1 6 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.638 -4.479 19707 2808 1 6 . 1 1 53 53 ILE H H 53 9.261 9.261 8.963 0.298 19707 2809 1 6 . 1 1 54 54 ARG N N 54 127.885 127.885 127.116 0.769 19707 2810 1 6 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.736 0.017 19707 2811 1 6 . 1 1 54 54 ARG C C 54 172.285 172.285 174.539 -2.254 19707 2812 1 6 . 1 1 54 54 ARG CA C 54 52.260 52.260 54.616 -2.356 19707 2813 1 6 . 1 1 54 54 ARG CB C 54 27.892 27.892 31.163 -3.272 19707 2814 1 6 . 1 1 54 54 ARG H H 54 8.686 8.686 8.709 -0.023 19707 2815 1 6 . 1 1 55 55 ILE N N 55 129.907 129.907 123.761 6.146 19707 2816 1 6 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.477 -0.324 19707 2817 1 6 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.753 -2.158 19707 2818 1 6 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.664 -2.051 19707 2819 1 6 . 1 1 55 55 ILE H H 55 9.292 9.292 8.476 0.816 19707 2820 1 6 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.414 -0.222 19707 2821 1 6 . 1 1 56 56 PRO C C 56 174.787 174.787 177.866 -3.079 19707 2822 1 6 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.858 -2.123 19707 2823 1 6 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.626 -2.713 19707 2824 1 6 . 1 1 57 57 GLY N N 57 111.828 111.828 111.241 0.587 19707 2825 1 6 . 1 1 57 57 GLY C C 57 171.039 171.039 173.611 -2.572 19707 2826 1 6 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.818 -2.001 19707 2827 1 6 . 1 1 57 57 GLY H H 57 8.708 8.708 8.722 -0.014 19707 2828 1 6 . 1 1 58 58 GLN N N 58 118.457 118.457 119.820 -1.363 19707 2829 1 6 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.863 0.037 19707 2830 1 6 . 1 1 58 58 GLN CA C 58 50.272 50.272 52.978 -2.706 19707 2831 1 6 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.701 -2.547 19707 2832 1 6 . 1 1 58 58 GLN H H 58 7.909 7.909 7.595 0.314 19707 2833 1 6 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.391 0.045 19707 2834 1 6 . 1 1 59 59 PRO C C 59 174.607 174.607 177.049 -2.442 19707 2835 1 6 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.800 -2.745 19707 2836 1 6 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.193 -3.016 19707 2837 1 6 . 1 1 60 60 VAL N N 60 122.695 122.695 121.436 1.259 19707 2838 1 6 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.195 -0.240 19707 2839 1 6 . 1 1 60 60 VAL C C 60 172.403 172.403 175.701 -3.298 19707 2840 1 6 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.106 -1.211 19707 2841 1 6 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.740 -3.098 19707 2842 1 6 . 1 1 60 60 VAL H H 60 8.364 8.364 8.017 0.347 19707 2843 1 6 . 1 1 61 61 VAL N N 61 126.097 126.097 127.394 -1.297 19707 2844 1 6 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.490 -0.190 19707 2845 1 6 . 1 1 61 61 VAL C C 61 170.891 170.891 173.966 -3.075 19707 2846 1 6 . 1 1 61 61 VAL CA C 61 58.814 58.814 60.596 -1.782 19707 2847 1 6 . 1 1 61 61 VAL CB C 61 31.198 31.198 35.100 -3.902 19707 2848 1 6 . 1 1 61 61 VAL H H 61 8.023 8.023 8.183 -0.160 19707 2849 1 6 . 1 1 62 62 GLU N N 62 126.097 126.097 126.281 -0.184 19707 2850 1 6 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.005 0.154 19707 2851 1 6 . 1 1 62 62 GLU C C 62 172.252 172.252 175.266 -3.014 19707 2852 1 6 . 1 1 62 62 GLU CA C 62 51.540 51.540 54.880 -3.340 19707 2853 1 6 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.833 -2.533 19707 2854 1 6 . 1 1 62 62 GLU H H 62 8.591 8.591 8.473 0.118 19707 2855 1 6 . 1 1 63 63 VAL N N 63 120.374 120.374 123.339 -2.965 19707 2856 1 6 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.244 0.149 19707 2857 1 6 . 1 1 63 63 VAL C C 63 171.040 171.040 176.186 -5.146 19707 2858 1 6 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.813 -3.980 19707 2859 1 6 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.816 -0.239 19707 2860 1 6 . 1 1 63 63 VAL H H 63 8.732 8.732 8.860 -0.128 19707 2861 1 6 . 1 1 64 64 GLY N N 64 109.935 109.935 114.861 -4.926 19707 2862 1 6 . 1 1 64 64 GLY C C 64 171.656 171.656 173.826 -2.170 19707 2863 1 6 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.256 -5.079 19707 2864 1 6 . 1 1 64 64 GLY H H 64 8.259 8.259 8.525 -0.266 19707 2865 1 6 . 1 1 65 65 THR N N 65 115.478 115.478 116.425 -0.947 19707 2866 1 6 . 1 1 65 65 THR HA H 65 4.342 4.342 4.294 0.048 19707 2867 1 6 . 1 1 65 65 THR C C 65 170.663 170.663 172.781 -2.118 19707 2868 1 6 . 1 1 65 65 THR CA C 65 58.357 58.357 60.401 -2.044 19707 2869 1 6 . 1 1 65 65 THR CB C 65 67.923 67.923 71.840 -3.917 19707 2870 1 6 . 1 1 65 65 THR H H 65 8.123 8.123 7.477 0.646 19707 2871 1 6 . 1 1 66 66 LYS N N 66 130.775 130.775 125.383 5.392 19707 2872 1 6 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.151 -1.221 19707 2873 1 6 . 1 1 66 66 LYS CA C 66 52.190 52.190 55.041 -2.851 19707 2874 1 6 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.707 -3.017 19707 2875 1 6 . 1 1 66 66 LYS H H 66 8.472 8.472 8.166 0.306 19707 2876 1 6 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.591 -0.180 19707 2877 1 6 . 1 1 67 67 PRO C C 67 173.211 173.211 176.757 -3.546 19707 2878 1 6 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.309 -2.743 19707 2879 1 6 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.865 -3.462 19707 2880 1 6 . 1 1 68 68 THR N N 68 111.983 111.983 114.253 -2.270 19707 2881 1 6 . 1 1 68 68 THR HA H 68 4.277 4.277 4.425 -0.148 19707 2882 1 6 . 1 1 68 68 THR C C 68 171.720 171.720 175.639 -3.919 19707 2883 1 6 . 1 1 68 68 THR CA C 68 58.193 58.193 62.309 -4.116 19707 2884 1 6 . 1 1 68 68 THR CB C 68 67.723 67.723 69.656 -1.933 19707 2885 1 6 . 1 1 68 68 THR H H 68 8.091 8.091 8.514 -0.423 19707 2886 1 6 . 1 1 69 69 GLY N N 69 109.918 109.918 109.277 0.641 19707 2887 1 6 . 1 1 69 69 GLY C C 69 170.783 170.783 173.088 -2.305 19707 2888 1 6 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.950 -2.894 19707 2889 1 6 . 1 1 69 69 GLY H H 69 8.119 8.119 8.129 -0.010 19707 2890 1 6 . 1 1 70 70 ASP N N 70 123.294 123.294 121.794 1.500 19707 2891 1 6 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.824 -0.275 19707 2892 1 6 . 1 1 70 70 ASP C C 70 173.651 173.651 175.161 -1.510 19707 2893 1 6 . 1 1 70 70 ASP CA C 70 51.861 51.861 52.865 -1.004 19707 2894 1 6 . 1 1 70 70 ASP CB C 70 37.733 37.733 38.524 -0.791 19707 2895 1 6 . 1 1 70 70 ASP H H 70 8.444 8.444 8.762 -0.318 19707 2896 1 6 . 1 1 71 71 VAL N N 71 117.772 117.772 114.433 3.339 19707 2897 1 6 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.068 -0.361 19707 2898 1 6 . 1 1 71 71 VAL C C 71 172.992 172.992 174.389 -1.397 19707 2899 1 6 . 1 1 71 71 VAL CA C 71 57.376 57.376 60.005 -2.629 19707 2900 1 6 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.964 -2.942 19707 2901 1 6 . 1 1 71 71 VAL H H 71 8.173 8.173 7.550 0.623 19707 2902 1 6 . 1 1 72 72 LEU N N 72 123.435 123.435 122.670 0.765 19707 2903 1 6 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.600 0.036 19707 2904 1 6 . 1 1 72 72 LEU C C 72 173.189 173.189 176.157 -2.968 19707 2905 1 6 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.466 -3.259 19707 2906 1 6 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.292 -1.654 19707 2907 1 6 . 1 1 72 72 LEU H H 72 8.859 8.859 8.935 -0.076 19707 2908 1 6 . 1 1 73 73 GLN N N 73 119.520 119.520 119.953 -0.433 19707 2909 1 6 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.168 0.177 19707 2910 1 6 . 1 1 73 73 GLN C C 73 172.249 172.249 175.630 -3.381 19707 2911 1 6 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.545 -3.212 19707 2912 1 6 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.694 -1.924 19707 2913 1 6 . 1 1 73 73 GLN H H 73 9.196 9.196 8.214 0.982 19707 2914 1 6 . 1 1 74 74 GLY N N 74 113.513 113.513 111.934 1.579 19707 2915 1 6 . 1 1 74 74 GLY C C 74 169.072 169.072 171.944 -2.872 19707 2916 1 6 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.933 -2.636 19707 2917 1 6 . 1 1 74 74 GLY H H 74 9.373 9.373 9.145 0.228 19707 2918 1 6 . 1 1 75 75 ARG N N 75 122.479 122.479 123.367 -0.888 19707 2919 1 6 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.428 0.074 19707 2920 1 6 . 1 1 75 75 ARG C C 75 172.348 172.348 174.046 -1.698 19707 2921 1 6 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.545 -3.787 19707 2922 1 6 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.381 -2.563 19707 2923 1 6 . 1 1 75 75 ARG H H 75 8.615 8.615 8.124 0.491 19707 2924 1 6 . 1 1 76 76 ALA N N 76 122.346 122.346 127.467 -5.121 19707 2925 1 6 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.795 -0.259 19707 2926 1 6 . 1 1 76 76 ALA C C 76 172.704 172.704 174.774 -2.070 19707 2927 1 6 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.839 -2.812 19707 2928 1 6 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.707 -2.682 19707 2929 1 6 . 1 1 76 76 ALA H H 76 8.590 8.590 8.953 -0.363 19707 2930 1 6 . 1 1 77 77 THR N N 77 116.961 116.961 116.720 0.241 19707 2931 1 6 . 1 1 77 77 THR HA H 77 4.988 4.988 5.231 -0.243 19707 2932 1 6 . 1 1 77 77 THR C C 77 172.800 172.800 174.978 -2.178 19707 2933 1 6 . 1 1 77 77 THR CA C 77 58.344 58.344 61.036 -2.692 19707 2934 1 6 . 1 1 77 77 THR CB C 77 67.712 67.712 70.193 -2.481 19707 2935 1 6 . 1 1 77 77 THR H H 77 8.491 8.491 8.309 0.182 19707 2936 1 6 . 1 1 78 78 GLY N N 78 111.103 111.103 113.545 -2.442 19707 2937 1 6 . 1 1 78 78 GLY C C 78 172.567 172.567 174.718 -2.151 19707 2938 1 6 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.645 -2.336 19707 2939 1 6 . 1 1 78 78 GLY H H 78 8.649 8.649 8.600 0.049 19707 2940 1 6 . 1 1 79 79 GLU N N 79 123.423 123.423 119.338 4.085 19707 2941 1 6 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.337 -0.341 19707 2942 1 6 . 1 1 79 79 GLU C C 79 175.466 175.466 177.165 -1.699 19707 2943 1 6 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.042 -2.583 19707 2944 1 6 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.752 -3.685 19707 2945 1 6 . 1 1 79 79 GLU H H 79 10.375 10.375 8.811 1.564 19707 2946 1 6 . 1 1 80 80 GLU N N 80 113.846 113.846 117.605 -3.759 19707 2947 1 6 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.413 -0.055 19707 2948 1 6 . 1 1 80 80 GLU C C 80 173.293 173.293 176.829 -3.536 19707 2949 1 6 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.968 -4.192 19707 2950 1 6 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.582 -4.851 19707 2951 1 6 . 1 1 80 80 GLU H H 80 7.679 7.679 8.493 -0.814 19707 2952 1 6 . 1 1 81 81 GLY N N 81 105.493 105.493 109.027 -3.534 19707 2953 1 6 . 1 1 81 81 GLY C C 81 170.427 170.427 174.294 -3.867 19707 2954 1 6 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.214 -2.602 19707 2955 1 6 . 1 1 81 81 GLY H H 81 7.476 7.476 7.729 -0.253 19707 2956 1 6 . 1 1 82 82 GLU N N 82 122.160 122.160 119.685 2.475 19707 2957 1 6 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.474 0.480 19707 2958 1 6 . 1 1 82 82 GLU C C 82 171.004 171.004 175.423 -4.419 19707 2959 1 6 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.422 -4.101 19707 2960 1 6 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.354 -5.288 19707 2961 1 6 . 1 1 82 82 GLU H H 82 9.585 9.585 8.000 1.585 19707 2962 1 6 . 1 1 83 83 THR N N 83 114.756 114.756 116.053 -1.297 19707 2963 1 6 . 1 1 83 83 THR HA H 83 4.990 4.990 5.163 -0.173 19707 2964 1 6 . 1 1 83 83 THR C C 83 170.909 170.909 173.437 -2.528 19707 2965 1 6 . 1 1 83 83 THR CA C 83 57.957 57.957 62.236 -4.279 19707 2966 1 6 . 1 1 83 83 THR CB C 83 68.271 68.271 71.308 -3.037 19707 2967 1 6 . 1 1 83 83 THR H H 83 8.490 8.490 8.649 -0.159 19707 2968 1 6 . 1 1 84 84 VAL N N 84 122.639 122.639 125.866 -3.227 19707 2969 1 6 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.637 0.018 19707 2970 1 6 . 1 1 84 84 VAL C C 84 170.962 170.962 173.856 -2.894 19707 2971 1 6 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.322 -3.025 19707 2972 1 6 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.502 -2.278 19707 2973 1 6 . 1 1 84 84 VAL H H 84 9.001 9.001 9.116 -0.115 19707 2974 1 6 . 1 1 85 85 LEU N N 85 129.903 129.903 126.773 3.130 19707 2975 1 6 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.536 -0.144 19707 2976 1 6 . 1 1 85 85 LEU C C 85 172.346 172.346 174.597 -2.251 19707 2977 1 6 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.456 -2.659 19707 2978 1 6 . 1 1 85 85 LEU CB C 85 42.515 42.515 47.166 -4.651 19707 2979 1 6 . 1 1 85 85 LEU H H 85 8.610 8.610 9.004 -0.394 19707 2980 1 6 . 1 1 86 86 VAL N N 86 122.778 122.778 123.263 -0.485 19707 2981 1 6 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.943 0.098 19707 2982 1 6 . 1 1 86 86 VAL C C 86 172.570 172.570 174.494 -1.924 19707 2983 1 6 . 1 1 86 86 VAL CA C 86 57.200 57.200 60.781 -3.581 19707 2984 1 6 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.321 -3.046 19707 2985 1 6 . 1 1 86 86 VAL H H 86 9.228 9.228 9.163 0.065 19707 2986 1 6 . 1 1 87 87 GLU N N 87 120.437 120.437 125.757 -5.320 19707 2987 1 6 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.563 0.168 19707 2988 1 6 . 1 1 87 87 GLU C C 87 172.267 172.267 174.975 -2.708 19707 2989 1 6 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.655 -3.306 19707 2990 1 6 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.997 -2.873 19707 2991 1 6 . 1 1 87 87 GLU H H 87 8.851 8.851 9.304 -0.453 19707 2992 1 6 . 1 1 88 88 GLU N N 88 118.525 118.525 120.161 -1.636 19707 2993 1 6 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.722 0.279 19707 2994 1 6 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.998 -3.080 19707 2995 1 6 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.175 -1.228 19707 2996 1 6 . 1 1 88 88 GLU H H 88 8.380 8.380 8.309 0.071 19707 2997 1 6 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.571 -0.042 19707 2998 1 6 . 1 1 89 89 PRO C C 89 172.774 172.774 176.624 -3.850 19707 2999 1 6 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.058 -2.677 19707 3000 1 6 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.298 -2.964 19707 3001 1 7 . 1 1 2 2 SER N N 2 115.963 115.963 115.243 0.720 19707 3002 1 7 . 1 1 2 2 SER HA H 2 4.408 4.408 4.236 0.172 19707 3003 1 7 . 1 1 2 2 SER C C 2 171.788 171.788 173.429 -1.641 19707 3004 1 7 . 1 1 2 2 SER CA C 2 55.870 55.870 59.499 -3.629 19707 3005 1 7 . 1 1 2 2 SER CB C 2 61.022 61.022 63.282 -2.260 19707 3006 1 7 . 1 1 2 2 SER H H 2 8.661 8.661 8.382 0.279 19707 3007 1 7 . 1 1 3 3 GLU N N 3 122.941 122.941 120.549 2.392 19707 3008 1 7 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.484 -0.164 19707 3009 1 7 . 1 1 3 3 GLU C C 3 173.817 173.817 175.590 -1.773 19707 3010 1 7 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.863 -1.909 19707 3011 1 7 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.847 -4.010 19707 3012 1 7 . 1 1 3 3 GLU H H 3 8.706 8.706 7.788 0.918 19707 3013 1 7 . 1 1 4 4 THR N N 4 116.182 116.182 114.758 1.424 19707 3014 1 7 . 1 1 4 4 THR HA H 4 4.233 4.233 4.410 -0.177 19707 3015 1 7 . 1 1 4 4 THR C C 4 171.719 171.719 174.997 -3.278 19707 3016 1 7 . 1 1 4 4 THR CA C 4 59.414 59.414 62.397 -2.983 19707 3017 1 7 . 1 1 4 4 THR CB C 4 67.009 67.009 69.659 -2.650 19707 3018 1 7 . 1 1 4 4 THR H H 4 8.165 8.165 8.447 -0.282 19707 3019 1 7 . 1 1 5 5 ARG N N 5 124.184 124.184 122.237 1.947 19707 3020 1 7 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.577 -0.217 19707 3021 1 7 . 1 1 5 5 ARG C C 5 173.520 173.520 175.881 -2.361 19707 3022 1 7 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.679 -2.336 19707 3023 1 7 . 1 1 5 5 ARG CB C 5 28.165 28.165 29.785 -1.620 19707 3024 1 7 . 1 1 5 5 ARG H H 5 8.354 8.354 8.222 0.132 19707 3025 1 7 . 1 1 6 6 THR N N 6 116.652 116.652 115.353 1.299 19707 3026 1 7 . 1 1 6 6 THR HA H 6 4.263 4.263 4.117 0.146 19707 3027 1 7 . 1 1 6 6 THR C C 6 171.784 171.784 173.537 -1.753 19707 3028 1 7 . 1 1 6 6 THR CA C 6 59.218 59.218 62.997 -3.779 19707 3029 1 7 . 1 1 6 6 THR CB C 6 67.213 67.213 67.897 -0.684 19707 3030 1 7 . 1 1 6 6 THR H H 6 8.224 8.224 8.077 0.147 19707 3031 1 7 . 1 1 7 7 ILE N N 7 123.882 123.882 122.223 1.659 19707 3032 1 7 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.263 -0.125 19707 3033 1 7 . 1 1 7 7 ILE C C 7 173.572 173.572 176.627 -3.055 19707 3034 1 7 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.313 -1.831 19707 3035 1 7 . 1 1 7 7 ILE CB C 7 36.069 36.069 40.020 -3.951 19707 3036 1 7 . 1 1 7 7 ILE H H 7 8.247 8.247 7.862 0.385 19707 3037 1 7 . 1 1 8 8 SER N N 8 120.287 120.287 120.259 0.028 19707 3038 1 7 . 1 1 8 8 SER HA H 8 4.445 4.445 4.518 -0.073 19707 3039 1 7 . 1 1 8 8 SER C C 8 171.926 171.926 174.958 -3.032 19707 3040 1 7 . 1 1 8 8 SER CA C 8 55.522 55.522 57.903 -2.381 19707 3041 1 7 . 1 1 8 8 SER CB C 8 61.073 61.073 63.127 -2.054 19707 3042 1 7 . 1 1 8 8 SER H H 8 8.402 8.402 8.504 -0.102 19707 3043 1 7 . 1 1 9 9 SER N N 9 118.425 118.425 119.359 -0.934 19707 3044 1 7 . 1 1 9 9 SER HA H 9 4.525 4.525 4.360 0.165 19707 3045 1 7 . 1 1 9 9 SER C C 9 172.663 172.663 174.345 -1.682 19707 3046 1 7 . 1 1 9 9 SER CA C 9 55.897 55.897 59.174 -3.277 19707 3047 1 7 . 1 1 9 9 SER CB C 9 61.375 61.375 62.346 -0.971 19707 3048 1 7 . 1 1 9 9 SER H H 9 8.362 8.362 8.086 0.276 19707 3049 1 7 . 1 1 10 10 THR N N 10 115.676 115.676 113.854 1.822 19707 3050 1 7 . 1 1 10 10 THR HA H 10 4.232 4.232 4.433 -0.201 19707 3051 1 7 . 1 1 10 10 THR C C 10 173.070 173.070 175.570 -2.500 19707 3052 1 7 . 1 1 10 10 THR CA C 10 60.318 60.318 63.022 -2.704 19707 3053 1 7 . 1 1 10 10 THR CB C 10 67.205 67.205 69.063 -1.858 19707 3054 1 7 . 1 1 10 10 THR H H 10 8.274 8.274 8.178 0.096 19707 3055 1 7 . 1 1 11 11 ALA N N 11 124.726 124.726 125.137 -0.411 19707 3056 1 7 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.144 -0.157 19707 3057 1 7 . 1 1 11 11 ALA C C 11 176.825 176.825 179.390 -2.565 19707 3058 1 7 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.169 -2.628 19707 3059 1 7 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.337 -2.447 19707 3060 1 7 . 1 1 11 11 ALA H H 11 8.347 8.347 8.229 0.118 19707 3061 1 7 . 1 1 12 12 GLN N N 12 117.915 117.915 117.508 0.407 19707 3062 1 7 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.125 -0.336 19707 3063 1 7 . 1 1 12 12 GLN C C 12 174.697 174.697 177.531 -2.834 19707 3064 1 7 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.801 -2.797 19707 3065 1 7 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.638 -2.413 19707 3066 1 7 . 1 1 12 12 GLN H H 12 8.194 8.194 8.153 0.041 19707 3067 1 7 . 1 1 13 13 GLU N N 13 118.510 118.510 119.265 -0.755 19707 3068 1 7 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.121 -0.018 19707 3069 1 7 . 1 1 13 13 GLU C C 13 176.192 176.192 179.217 -3.025 19707 3070 1 7 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.836 -2.521 19707 3071 1 7 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.736 -3.704 19707 3072 1 7 . 1 1 13 13 GLU H H 13 7.917 7.917 7.838 0.079 19707 3073 1 7 . 1 1 14 14 ARG N N 14 118.193 118.193 119.420 -1.227 19707 3074 1 7 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.023 -0.055 19707 3075 1 7 . 1 1 14 14 ARG C C 14 176.764 176.764 178.520 -1.756 19707 3076 1 7 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.118 -1.835 19707 3077 1 7 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.730 -2.494 19707 3078 1 7 . 1 1 14 14 ARG H H 14 7.907 7.907 8.160 -0.253 19707 3079 1 7 . 1 1 15 15 VAL N N 15 117.991 117.991 115.898 2.093 19707 3080 1 7 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.902 0.001 19707 3081 1 7 . 1 1 15 15 VAL C C 15 174.922 174.922 177.598 -2.676 19707 3082 1 7 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.990 -2.159 19707 3083 1 7 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.227 -2.504 19707 3084 1 7 . 1 1 15 15 VAL H H 15 7.658 7.658 7.487 0.171 19707 3085 1 7 . 1 1 16 16 ASP N N 16 124.314 124.314 120.310 4.004 19707 3086 1 7 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.425 -0.109 19707 3087 1 7 . 1 1 16 16 ASP C C 16 176.462 176.462 177.670 -1.208 19707 3088 1 7 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.455 -2.129 19707 3089 1 7 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.259 -4.590 19707 3090 1 7 . 1 1 16 16 ASP H H 16 8.291 8.291 8.114 0.177 19707 3091 1 7 . 1 1 17 17 LEU N N 17 120.212 120.212 119.600 0.612 19707 3092 1 7 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.131 -0.077 19707 3093 1 7 . 1 1 17 17 LEU C C 17 177.171 177.171 178.990 -1.819 19707 3094 1 7 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.495 -2.515 19707 3095 1 7 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.239 -2.394 19707 3096 1 7 . 1 1 17 17 LEU H H 17 8.172 8.172 7.565 0.607 19707 3097 1 7 . 1 1 18 18 GLU N N 18 120.587 120.587 118.900 1.687 19707 3098 1 7 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.915 0.278 19707 3099 1 7 . 1 1 18 18 GLU C C 18 175.997 175.997 178.750 -2.753 19707 3100 1 7 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.508 -3.406 19707 3101 1 7 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.803 -2.731 19707 3102 1 7 . 1 1 18 18 GLU H H 18 7.876 7.876 7.828 0.048 19707 3103 1 7 . 1 1 19 19 ALA N N 19 121.800 121.800 122.671 -0.871 19707 3104 1 7 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.104 -0.313 19707 3105 1 7 . 1 1 19 19 ALA C C 19 175.708 175.708 179.667 -3.959 19707 3106 1 7 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.876 -2.024 19707 3107 1 7 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.518 -4.364 19707 3108 1 7 . 1 1 19 19 ALA H H 19 7.792 7.792 7.451 0.341 19707 3109 1 7 . 1 1 20 20 VAL N N 20 118.680 118.680 119.571 -0.891 19707 3110 1 7 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.558 -0.258 19707 3111 1 7 . 1 1 20 20 VAL C C 20 176.276 176.276 177.789 -1.513 19707 3112 1 7 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.610 -2.803 19707 3113 1 7 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.635 -2.084 19707 3114 1 7 . 1 1 20 20 VAL H H 20 7.712 7.712 8.132 -0.420 19707 3115 1 7 . 1 1 21 21 ARG N N 21 121.935 121.935 120.165 1.770 19707 3116 1 7 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.057 -0.062 19707 3117 1 7 . 1 1 21 21 ARG C C 21 176.828 176.828 178.656 -1.828 19707 3118 1 7 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.434 -1.774 19707 3119 1 7 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.589 -2.299 19707 3120 1 7 . 1 1 21 21 ARG H H 21 8.444 8.444 8.237 0.207 19707 3121 1 7 . 1 1 22 22 LEU N N 22 119.327 119.327 119.571 -0.244 19707 3122 1 7 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.035 -0.040 19707 3123 1 7 . 1 1 22 22 LEU C C 22 175.664 175.664 178.245 -2.581 19707 3124 1 7 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.361 -3.493 19707 3125 1 7 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.695 -2.560 19707 3126 1 7 . 1 1 22 22 LEU H H 22 8.248 8.248 8.060 0.188 19707 3127 1 7 . 1 1 23 23 ALA N N 23 121.202 121.202 122.302 -1.100 19707 3128 1 7 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.928 -0.193 19707 3129 1 7 . 1 1 23 23 ALA C C 23 175.492 175.492 179.696 -4.204 19707 3130 1 7 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.270 -2.200 19707 3131 1 7 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.898 -3.831 19707 3132 1 7 . 1 1 23 23 ALA H H 23 8.392 8.392 8.290 0.102 19707 3133 1 7 . 1 1 24 24 SER N N 24 112.377 112.377 115.027 -2.650 19707 3134 1 7 . 1 1 24 24 SER HA H 24 4.214 4.214 4.254 -0.040 19707 3135 1 7 . 1 1 24 24 SER C C 24 174.773 174.773 176.719 -1.946 19707 3136 1 7 . 1 1 24 24 SER CA C 24 59.258 59.258 61.692 -2.434 19707 3137 1 7 . 1 1 24 24 SER CB C 24 60.149 60.149 63.251 -3.102 19707 3138 1 7 . 1 1 24 24 SER H H 24 7.690 7.690 7.823 -0.133 19707 3139 1 7 . 1 1 25 25 ILE N N 25 123.886 123.886 122.500 1.386 19707 3140 1 7 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.005 -0.163 19707 3141 1 7 . 1 1 25 25 ILE C C 25 176.487 176.487 178.163 -1.676 19707 3142 1 7 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.219 -0.227 19707 3143 1 7 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.365 -0.433 19707 3144 1 7 . 1 1 25 25 ILE H H 25 7.837 7.837 7.798 0.039 19707 3145 1 7 . 1 1 26 26 VAL N N 26 122.538 122.538 121.014 1.524 19707 3146 1 7 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.683 -0.295 19707 3147 1 7 . 1 1 26 26 VAL C C 26 174.624 174.624 177.731 -3.107 19707 3148 1 7 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.388 -2.473 19707 3149 1 7 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.329 -3.434 19707 3150 1 7 . 1 1 26 26 VAL H H 26 8.804 8.804 8.578 0.226 19707 3151 1 7 . 1 1 27 27 ASP N N 27 120.433 120.433 120.368 0.065 19707 3152 1 7 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.316 -0.152 19707 3153 1 7 . 1 1 27 27 ASP C C 27 174.966 174.966 178.410 -3.444 19707 3154 1 7 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.575 -2.246 19707 3155 1 7 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.668 -2.814 19707 3156 1 7 . 1 1 27 27 ASP H H 27 8.719 8.719 8.520 0.199 19707 3157 1 7 . 1 1 28 28 SER N N 28 112.397 112.397 115.066 -2.669 19707 3158 1 7 . 1 1 28 28 SER HA H 28 4.073 4.073 4.209 -0.136 19707 3159 1 7 . 1 1 28 28 SER C C 28 174.405 174.405 176.614 -2.209 19707 3160 1 7 . 1 1 28 28 SER CA C 28 59.115 59.115 61.913 -2.798 19707 3161 1 7 . 1 1 28 28 SER CB C 28 60.125 60.125 63.116 -2.991 19707 3162 1 7 . 1 1 28 28 SER H H 28 7.599 7.599 8.310 -0.711 19707 3163 1 7 . 1 1 29 29 ARG N N 29 123.945 123.945 122.323 1.622 19707 3164 1 7 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.986 0.041 19707 3165 1 7 . 1 1 29 29 ARG C C 29 175.902 175.902 178.009 -2.107 19707 3166 1 7 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.881 -3.607 19707 3167 1 7 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.136 -1.396 19707 3168 1 7 . 1 1 29 29 ARG H H 29 7.769 7.769 7.525 0.244 19707 3169 1 7 . 1 1 30 30 LEU N N 30 121.580 121.580 120.804 0.776 19707 3170 1 7 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.994 -0.245 19707 3171 1 7 . 1 1 30 30 LEU C C 30 177.474 177.474 179.614 -2.140 19707 3172 1 7 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.885 -2.572 19707 3173 1 7 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.840 -2.811 19707 3174 1 7 . 1 1 30 30 LEU H H 30 8.665 8.665 8.305 0.360 19707 3175 1 7 . 1 1 31 31 ILE N N 31 119.330 119.330 117.219 2.111 19707 3176 1 7 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.762 -0.071 19707 3177 1 7 . 1 1 31 31 ILE C C 31 175.341 175.341 177.785 -2.444 19707 3178 1 7 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.028 -2.516 19707 3179 1 7 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.906 -2.339 19707 3180 1 7 . 1 1 31 31 ILE H H 31 8.226 8.226 8.428 -0.202 19707 3181 1 7 . 1 1 32 32 GLY N N 32 106.092 106.092 105.921 0.171 19707 3182 1 7 . 1 1 32 32 GLY C C 32 172.413 172.413 175.166 -2.753 19707 3183 1 7 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.754 -3.257 19707 3184 1 7 . 1 1 32 32 GLY H H 32 7.767 7.767 7.775 -0.008 19707 3185 1 7 . 1 1 33 33 THR N N 33 110.966 110.966 112.958 -1.992 19707 3186 1 7 . 1 1 33 33 THR HA H 33 4.455 4.455 4.348 0.107 19707 3187 1 7 . 1 1 33 33 THR C C 33 172.714 172.714 174.791 -2.077 19707 3188 1 7 . 1 1 33 33 THR CA C 33 60.032 60.032 62.895 -2.863 19707 3189 1 7 . 1 1 33 33 THR CB C 33 68.287 68.287 70.048 -1.761 19707 3190 1 7 . 1 1 33 33 THR H H 33 8.102 8.102 7.795 0.307 19707 3191 1 7 . 1 1 34 34 GLY N N 34 110.320 110.320 110.718 -0.398 19707 3192 1 7 . 1 1 34 34 GLY C C 34 170.505 170.505 173.686 -3.181 19707 3193 1 7 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.153 -2.570 19707 3194 1 7 . 1 1 34 34 GLY H H 34 8.072 8.072 8.135 -0.063 19707 3195 1 7 . 1 1 35 35 SER N N 35 112.944 112.944 114.467 -1.523 19707 3196 1 7 . 1 1 35 35 SER HA H 35 4.385 4.385 4.810 -0.425 19707 3197 1 7 . 1 1 35 35 SER C C 35 169.537 169.537 172.496 -2.959 19707 3198 1 7 . 1 1 35 35 SER CA C 35 54.794 54.794 58.251 -3.457 19707 3199 1 7 . 1 1 35 35 SER CB C 35 62.029 62.029 66.660 -4.631 19707 3200 1 7 . 1 1 35 35 SER H H 35 7.719 7.719 7.583 0.136 19707 3201 1 7 . 1 1 36 36 VAL N N 36 118.566 118.566 122.780 -4.214 19707 3202 1 7 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.285 -0.252 19707 3203 1 7 . 1 1 36 36 VAL C C 36 169.876 169.876 173.834 -3.958 19707 3204 1 7 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.069 -1.504 19707 3205 1 7 . 1 1 36 36 VAL CB C 36 30.952 30.952 34.039 -3.087 19707 3206 1 7 . 1 1 36 36 VAL H H 36 8.490 8.490 8.461 0.029 19707 3207 1 7 . 1 1 37 37 ASP N N 37 121.640 121.640 126.660 -5.020 19707 3208 1 7 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.880 -0.078 19707 3209 1 7 . 1 1 37 37 ASP C C 37 172.806 172.806 176.597 -3.791 19707 3210 1 7 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.697 -3.654 19707 3211 1 7 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.321 -3.115 19707 3212 1 7 . 1 1 37 37 ASP H H 37 7.195 7.195 8.016 -0.821 19707 3213 1 7 . 1 1 38 38 GLU N N 38 120.018 120.018 121.049 -1.031 19707 3214 1 7 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.902 -0.245 19707 3215 1 7 . 1 1 38 38 GLU C C 38 174.753 174.753 177.833 -3.080 19707 3216 1 7 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.387 -2.895 19707 3217 1 7 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.737 -3.658 19707 3218 1 7 . 1 1 38 38 GLU H H 38 8.908 8.908 8.810 0.098 19707 3219 1 7 . 1 1 39 39 ASP N N 39 118.668 118.668 117.875 0.793 19707 3220 1 7 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.464 -0.218 19707 3221 1 7 . 1 1 39 39 ASP C C 39 175.393 175.393 177.396 -2.003 19707 3222 1 7 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.300 -1.436 19707 3223 1 7 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.635 -3.665 19707 3224 1 7 . 1 1 39 39 ASP H H 39 8.242 8.242 8.597 -0.355 19707 3225 1 7 . 1 1 40 40 PHE N N 40 119.851 119.851 116.176 3.675 19707 3226 1 7 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.554 -0.350 19707 3227 1 7 . 1 1 40 40 PHE C C 40 174.929 174.929 174.978 -0.049 19707 3228 1 7 . 1 1 40 40 PHE CA C 40 58.171 58.171 58.288 -0.117 19707 3229 1 7 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.773 -2.940 19707 3230 1 7 . 1 1 40 40 PHE H H 40 8.037 8.037 7.822 0.215 19707 3231 1 7 . 1 1 41 41 LEU N N 41 117.882 117.882 116.803 1.079 19707 3232 1 7 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.484 -0.962 19707 3233 1 7 . 1 1 41 41 LEU C C 41 175.938 175.938 178.252 -2.314 19707 3234 1 7 . 1 1 41 41 LEU CA C 41 54.860 54.860 55.181 -0.321 19707 3235 1 7 . 1 1 41 41 LEU CB C 41 39.231 39.231 43.812 -4.581 19707 3236 1 7 . 1 1 41 41 LEU H H 41 7.816 7.816 7.756 0.060 19707 3237 1 7 . 1 1 42 42 ARG N N 42 118.360 118.360 120.535 -2.175 19707 3238 1 7 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.074 -0.334 19707 3239 1 7 . 1 1 42 42 ARG C C 42 175.435 175.435 177.101 -1.666 19707 3240 1 7 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.236 -2.265 19707 3241 1 7 . 1 1 42 42 ARG CB C 42 27.264 27.264 30.075 -2.811 19707 3242 1 7 . 1 1 42 42 ARG H H 42 8.540 8.540 8.320 0.220 19707 3243 1 7 . 1 1 43 43 GLU N N 43 114.947 114.947 116.844 -1.897 19707 3244 1 7 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.355 -0.305 19707 3245 1 7 . 1 1 43 43 GLU C C 43 174.518 174.518 177.725 -3.207 19707 3246 1 7 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.202 -2.631 19707 3247 1 7 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.066 -3.025 19707 3248 1 7 . 1 1 43 43 GLU H H 43 7.223 7.223 8.478 -1.255 19707 3249 1 7 . 1 1 44 44 GLN N N 44 114.109 114.109 117.929 -3.820 19707 3250 1 7 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.266 -0.160 19707 3251 1 7 . 1 1 44 44 GLN C C 44 173.777 173.777 177.480 -3.703 19707 3252 1 7 . 1 1 44 44 GLN CA C 44 52.181 52.181 56.267 -4.086 19707 3253 1 7 . 1 1 44 44 GLN CB C 44 25.870 25.870 28.988 -3.118 19707 3254 1 7 . 1 1 44 44 GLN H H 44 7.372 7.372 7.922 -0.550 19707 3255 1 7 . 1 1 45 45 ILE N N 45 117.470 117.470 116.542 0.928 19707 3256 1 7 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.681 0.267 19707 3257 1 7 . 1 1 45 45 ILE C C 45 172.305 172.305 177.478 -5.173 19707 3258 1 7 . 1 1 45 45 ILE CA C 45 58.505 58.505 64.158 -5.653 19707 3259 1 7 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.495 -1.795 19707 3260 1 7 . 1 1 45 45 ILE H H 45 7.235 7.235 7.480 -0.245 19707 3261 1 7 . 1 1 46 46 ARG N N 46 122.996 122.996 115.812 7.184 19707 3262 1 7 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.007 0.183 19707 3263 1 7 . 1 1 46 46 ARG C C 46 172.992 172.992 175.405 -2.413 19707 3264 1 7 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.026 -4.266 19707 3265 1 7 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.533 -0.581 19707 3266 1 7 . 1 1 46 46 ARG H H 46 8.336 8.336 8.643 -0.307 19707 3267 1 7 . 1 1 47 47 ASP N N 47 118.676 118.676 116.111 2.565 19707 3268 1 7 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.665 -0.217 19707 3269 1 7 . 1 1 47 47 ASP C C 47 172.520 172.520 174.741 -2.221 19707 3270 1 7 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.250 -2.360 19707 3271 1 7 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.834 -5.176 19707 3272 1 7 . 1 1 47 47 ASP H H 47 8.313 8.313 8.057 0.256 19707 3273 1 7 . 1 1 48 48 ALA N N 48 120.922 120.922 122.893 -1.971 19707 3274 1 7 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.668 -0.299 19707 3275 1 7 . 1 1 48 48 ALA C C 48 174.295 174.295 177.514 -3.219 19707 3276 1 7 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.610 -1.973 19707 3277 1 7 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.671 -3.457 19707 3278 1 7 . 1 1 48 48 ALA H H 48 7.824 7.824 7.298 0.526 19707 3279 1 7 . 1 1 49 49 ARG N N 49 118.644 118.644 119.908 -1.264 19707 3280 1 7 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.016 0.326 19707 3281 1 7 . 1 1 49 49 ARG C C 49 172.504 172.504 176.383 -3.879 19707 3282 1 7 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.647 -3.738 19707 3283 1 7 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.473 -2.130 19707 3284 1 7 . 1 1 49 49 ARG H H 49 7.911 7.911 8.646 -0.735 19707 3285 1 7 . 1 1 50 50 TYR N N 50 119.470 119.470 114.300 5.170 19707 3286 1 7 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.004 0.287 19707 3287 1 7 . 1 1 50 50 TYR C C 50 170.470 170.470 174.299 -3.829 19707 3288 1 7 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.249 -1.981 19707 3289 1 7 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.450 -0.937 19707 3290 1 7 . 1 1 50 50 TYR H H 50 7.639 7.639 7.928 -0.289 19707 3291 1 7 . 1 1 51 51 ALA N N 51 127.418 127.418 125.343 2.075 19707 3292 1 7 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.025 0.196 19707 3293 1 7 . 1 1 51 51 ALA C C 51 171.328 171.328 175.341 -4.013 19707 3294 1 7 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.542 -3.109 19707 3295 1 7 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.467 -1.155 19707 3296 1 7 . 1 1 51 51 ALA H H 51 8.222 8.222 8.745 -0.523 19707 3297 1 7 . 1 1 52 52 VAL N N 52 117.832 117.832 122.042 -4.210 19707 3298 1 7 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.149 -0.482 19707 3299 1 7 . 1 1 52 52 VAL C C 52 172.436 172.436 174.278 -1.842 19707 3300 1 7 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.221 -3.464 19707 3301 1 7 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.564 -4.461 19707 3302 1 7 . 1 1 52 52 VAL H H 52 8.753 8.753 9.011 -0.258 19707 3303 1 7 . 1 1 53 53 ILE N N 53 128.027 128.027 125.310 2.717 19707 3304 1 7 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.577 0.265 19707 3305 1 7 . 1 1 53 53 ILE C C 53 172.110 172.110 174.202 -2.092 19707 3306 1 7 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.392 -2.639 19707 3307 1 7 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.064 -3.905 19707 3308 1 7 . 1 1 53 53 ILE H H 53 9.261 9.261 8.964 0.297 19707 3309 1 7 . 1 1 54 54 ARG N N 54 127.885 127.885 127.520 0.365 19707 3310 1 7 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.700 0.053 19707 3311 1 7 . 1 1 54 54 ARG C C 54 172.285 172.285 174.382 -2.097 19707 3312 1 7 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.695 -1.435 19707 3313 1 7 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.520 -2.628 19707 3314 1 7 . 1 1 54 54 ARG H H 54 8.686 8.686 8.695 -0.009 19707 3315 1 7 . 1 1 55 55 ILE N N 55 129.907 129.907 123.827 6.080 19707 3316 1 7 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.380 -0.227 19707 3317 1 7 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.030 -2.435 19707 3318 1 7 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.003 -1.390 19707 3319 1 7 . 1 1 55 55 ILE H H 55 9.292 9.292 8.265 1.027 19707 3320 1 7 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.321 -0.129 19707 3321 1 7 . 1 1 56 56 PRO C C 56 174.787 174.787 177.690 -2.903 19707 3322 1 7 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.151 -2.417 19707 3323 1 7 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.835 -2.922 19707 3324 1 7 . 1 1 57 57 GLY N N 57 111.828 111.828 111.524 0.304 19707 3325 1 7 . 1 1 57 57 GLY C C 57 171.039 171.039 173.552 -2.513 19707 3326 1 7 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.921 -2.104 19707 3327 1 7 . 1 1 57 57 GLY H H 57 8.708 8.708 8.885 -0.177 19707 3328 1 7 . 1 1 58 58 GLN N N 58 118.457 118.457 119.817 -1.360 19707 3329 1 7 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.864 0.036 19707 3330 1 7 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.005 -2.732 19707 3331 1 7 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.820 -2.666 19707 3332 1 7 . 1 1 58 58 GLN H H 58 7.909 7.909 7.586 0.323 19707 3333 1 7 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.419 0.017 19707 3334 1 7 . 1 1 59 59 PRO C C 59 174.607 174.607 176.491 -1.884 19707 3335 1 7 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.683 -2.628 19707 3336 1 7 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.212 -3.035 19707 3337 1 7 . 1 1 60 60 VAL N N 60 122.695 122.695 121.358 1.337 19707 3338 1 7 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.079 -0.124 19707 3339 1 7 . 1 1 60 60 VAL C C 60 172.403 172.403 174.955 -2.552 19707 3340 1 7 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.804 -1.909 19707 3341 1 7 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.597 -2.955 19707 3342 1 7 . 1 1 60 60 VAL H H 60 8.364 8.364 8.220 0.144 19707 3343 1 7 . 1 1 61 61 VAL N N 61 126.097 126.097 129.026 -2.929 19707 3344 1 7 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.439 -0.139 19707 3345 1 7 . 1 1 61 61 VAL C C 61 170.891 170.891 174.460 -3.569 19707 3346 1 7 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.353 -2.539 19707 3347 1 7 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.607 -3.409 19707 3348 1 7 . 1 1 61 61 VAL H H 61 8.023 8.023 8.289 -0.266 19707 3349 1 7 . 1 1 62 62 GLU N N 62 126.097 126.097 125.495 0.602 19707 3350 1 7 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.021 0.138 19707 3351 1 7 . 1 1 62 62 GLU C C 62 172.252 172.252 175.387 -3.135 19707 3352 1 7 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.279 -3.739 19707 3353 1 7 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.618 -2.318 19707 3354 1 7 . 1 1 62 62 GLU H H 62 8.591 8.591 8.444 0.147 19707 3355 1 7 . 1 1 63 63 VAL N N 63 120.374 120.374 123.921 -3.547 19707 3356 1 7 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.125 0.268 19707 3357 1 7 . 1 1 63 63 VAL C C 63 171.040 171.040 176.546 -5.506 19707 3358 1 7 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.849 -4.016 19707 3359 1 7 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.987 -0.410 19707 3360 1 7 . 1 1 63 63 VAL H H 63 8.732 8.732 8.871 -0.139 19707 3361 1 7 . 1 1 64 64 GLY N N 64 109.935 109.935 114.291 -4.356 19707 3362 1 7 . 1 1 64 64 GLY C C 64 171.656 171.656 173.789 -2.133 19707 3363 1 7 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.194 -5.017 19707 3364 1 7 . 1 1 64 64 GLY H H 64 8.259 8.259 8.450 -0.191 19707 3365 1 7 . 1 1 65 65 THR N N 65 115.478 115.478 116.465 -0.987 19707 3366 1 7 . 1 1 65 65 THR HA H 65 4.342 4.342 4.341 0.001 19707 3367 1 7 . 1 1 65 65 THR C C 65 170.663 170.663 172.840 -2.177 19707 3368 1 7 . 1 1 65 65 THR CA C 65 58.357 58.357 60.166 -1.809 19707 3369 1 7 . 1 1 65 65 THR CB C 65 67.923 67.923 71.946 -4.023 19707 3370 1 7 . 1 1 65 65 THR H H 65 8.123 8.123 7.565 0.558 19707 3371 1 7 . 1 1 66 66 LYS N N 66 130.775 130.775 124.447 6.328 19707 3372 1 7 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.194 -1.264 19707 3373 1 7 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.830 -2.640 19707 3374 1 7 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.726 -3.036 19707 3375 1 7 . 1 1 66 66 LYS H H 66 8.472 8.472 8.164 0.308 19707 3376 1 7 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.560 -0.149 19707 3377 1 7 . 1 1 67 67 PRO C C 67 173.211 173.211 177.118 -3.907 19707 3378 1 7 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.374 -2.808 19707 3379 1 7 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.763 -3.360 19707 3380 1 7 . 1 1 68 68 THR N N 68 111.983 111.983 114.960 -2.977 19707 3381 1 7 . 1 1 68 68 THR HA H 68 4.277 4.277 4.229 0.048 19707 3382 1 7 . 1 1 68 68 THR C C 68 171.720 171.720 175.485 -3.765 19707 3383 1 7 . 1 1 68 68 THR CA C 68 58.193 58.193 62.736 -4.543 19707 3384 1 7 . 1 1 68 68 THR CB C 68 67.723 67.723 69.167 -1.444 19707 3385 1 7 . 1 1 68 68 THR H H 68 8.091 8.091 8.153 -0.062 19707 3386 1 7 . 1 1 69 69 GLY N N 69 109.918 109.918 108.932 0.986 19707 3387 1 7 . 1 1 69 69 GLY C C 69 170.783 170.783 174.282 -3.499 19707 3388 1 7 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.707 -2.651 19707 3389 1 7 . 1 1 69 69 GLY H H 69 8.119 8.119 7.994 0.125 19707 3390 1 7 . 1 1 70 70 ASP N N 70 123.294 123.294 124.878 -1.584 19707 3391 1 7 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.859 -0.310 19707 3392 1 7 . 1 1 70 70 ASP C C 70 173.651 173.651 175.040 -1.389 19707 3393 1 7 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.766 -2.905 19707 3394 1 7 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.629 -1.896 19707 3395 1 7 . 1 1 70 70 ASP H H 70 8.444 8.444 8.682 -0.238 19707 3396 1 7 . 1 1 71 71 VAL N N 71 117.772 117.772 114.442 3.330 19707 3397 1 7 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.146 -0.439 19707 3398 1 7 . 1 1 71 71 VAL C C 71 172.992 172.992 174.333 -1.341 19707 3399 1 7 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.069 -1.693 19707 3400 1 7 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.385 -2.363 19707 3401 1 7 . 1 1 71 71 VAL H H 71 8.173 8.173 7.784 0.389 19707 3402 1 7 . 1 1 72 72 LEU N N 72 123.435 123.435 123.319 0.116 19707 3403 1 7 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.525 0.111 19707 3404 1 7 . 1 1 72 72 LEU C C 72 173.189 173.189 176.187 -2.998 19707 3405 1 7 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.465 -3.258 19707 3406 1 7 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.967 -1.329 19707 3407 1 7 . 1 1 72 72 LEU H H 72 8.859 8.859 8.902 -0.043 19707 3408 1 7 . 1 1 73 73 GLN N N 73 119.520 119.520 121.673 -2.153 19707 3409 1 7 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.147 0.198 19707 3410 1 7 . 1 1 73 73 GLN C C 73 172.249 172.249 175.783 -3.534 19707 3411 1 7 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.482 -3.149 19707 3412 1 7 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.137 -1.367 19707 3413 1 7 . 1 1 73 73 GLN H H 73 9.196 9.196 8.329 0.867 19707 3414 1 7 . 1 1 74 74 GLY N N 74 113.513 113.513 111.929 1.584 19707 3415 1 7 . 1 1 74 74 GLY C C 74 169.072 169.072 172.014 -2.942 19707 3416 1 7 . 1 1 74 74 GLY CA C 74 41.297 41.297 44.031 -2.734 19707 3417 1 7 . 1 1 74 74 GLY H H 74 9.373 9.373 9.124 0.249 19707 3418 1 7 . 1 1 75 75 ARG N N 75 122.479 122.479 123.816 -1.337 19707 3419 1 7 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.287 0.215 19707 3420 1 7 . 1 1 75 75 ARG C C 75 172.348 172.348 174.015 -1.667 19707 3421 1 7 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.757 -3.999 19707 3422 1 7 . 1 1 75 75 ARG CB C 75 31.818 31.818 33.954 -2.136 19707 3423 1 7 . 1 1 75 75 ARG H H 75 8.615 8.615 8.340 0.275 19707 3424 1 7 . 1 1 76 76 ALA N N 76 122.346 122.346 128.063 -5.717 19707 3425 1 7 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.780 -0.244 19707 3426 1 7 . 1 1 76 76 ALA C C 76 172.704 172.704 175.087 -2.383 19707 3427 1 7 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.194 -2.167 19707 3428 1 7 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.910 -2.885 19707 3429 1 7 . 1 1 76 76 ALA H H 76 8.590 8.590 9.151 -0.561 19707 3430 1 7 . 1 1 77 77 THR N N 77 116.961 116.961 116.645 0.316 19707 3431 1 7 . 1 1 77 77 THR HA H 77 4.988 4.988 5.172 -0.184 19707 3432 1 7 . 1 1 77 77 THR C C 77 172.800 172.800 175.027 -2.227 19707 3433 1 7 . 1 1 77 77 THR CA C 77 58.344 58.344 61.505 -3.161 19707 3434 1 7 . 1 1 77 77 THR CB C 77 67.712 67.712 70.362 -2.650 19707 3435 1 7 . 1 1 77 77 THR H H 77 8.491 8.491 8.285 0.206 19707 3436 1 7 . 1 1 78 78 GLY N N 78 111.103 111.103 112.930 -1.827 19707 3437 1 7 . 1 1 78 78 GLY C C 78 172.567 172.567 174.988 -2.421 19707 3438 1 7 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.794 -2.485 19707 3439 1 7 . 1 1 78 78 GLY H H 78 8.649 8.649 8.685 -0.036 19707 3440 1 7 . 1 1 79 79 GLU N N 79 123.423 123.423 119.474 3.949 19707 3441 1 7 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.351 -0.355 19707 3442 1 7 . 1 1 79 79 GLU C C 79 175.466 175.466 177.045 -1.579 19707 3443 1 7 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.896 -2.437 19707 3444 1 7 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.411 -3.344 19707 3445 1 7 . 1 1 79 79 GLU H H 79 10.375 10.375 8.818 1.557 19707 3446 1 7 . 1 1 80 80 GLU N N 80 113.846 113.846 117.176 -3.330 19707 3447 1 7 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.446 -0.088 19707 3448 1 7 . 1 1 80 80 GLU C C 80 173.293 173.293 176.981 -3.688 19707 3449 1 7 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.952 -4.176 19707 3450 1 7 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.632 -4.901 19707 3451 1 7 . 1 1 80 80 GLU H H 80 7.679 7.679 8.453 -0.774 19707 3452 1 7 . 1 1 81 81 GLY N N 81 105.493 105.493 109.158 -3.665 19707 3453 1 7 . 1 1 81 81 GLY C C 81 170.427 170.427 174.329 -3.902 19707 3454 1 7 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.228 -2.616 19707 3455 1 7 . 1 1 81 81 GLY H H 81 7.476 7.476 7.757 -0.281 19707 3456 1 7 . 1 1 82 82 GLU N N 82 122.160 122.160 119.649 2.511 19707 3457 1 7 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.457 0.497 19707 3458 1 7 . 1 1 82 82 GLU C C 82 171.004 171.004 175.383 -4.379 19707 3459 1 7 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.438 -4.117 19707 3460 1 7 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.338 -5.272 19707 3461 1 7 . 1 1 82 82 GLU H H 82 9.585 9.585 8.050 1.535 19707 3462 1 7 . 1 1 83 83 THR N N 83 114.756 114.756 116.296 -1.540 19707 3463 1 7 . 1 1 83 83 THR HA H 83 4.990 4.990 5.127 -0.137 19707 3464 1 7 . 1 1 83 83 THR C C 83 170.909 170.909 173.377 -2.468 19707 3465 1 7 . 1 1 83 83 THR CA C 83 57.957 57.957 62.107 -4.150 19707 3466 1 7 . 1 1 83 83 THR CB C 83 68.271 68.271 71.216 -2.945 19707 3467 1 7 . 1 1 83 83 THR H H 83 8.490 8.490 8.423 0.067 19707 3468 1 7 . 1 1 84 84 VAL N N 84 122.639 122.639 125.834 -3.195 19707 3469 1 7 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.631 0.024 19707 3470 1 7 . 1 1 84 84 VAL C C 84 170.962 170.962 173.751 -2.789 19707 3471 1 7 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.834 -2.537 19707 3472 1 7 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.442 -2.218 19707 3473 1 7 . 1 1 84 84 VAL H H 84 9.001 9.001 9.080 -0.079 19707 3474 1 7 . 1 1 85 85 LEU N N 85 129.903 129.903 128.428 1.475 19707 3475 1 7 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.472 -0.080 19707 3476 1 7 . 1 1 85 85 LEU C C 85 172.346 172.346 174.567 -2.221 19707 3477 1 7 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.180 -2.383 19707 3478 1 7 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.692 -4.177 19707 3479 1 7 . 1 1 85 85 LEU H H 85 8.610 8.610 9.003 -0.393 19707 3480 1 7 . 1 1 86 86 VAL N N 86 122.778 122.778 124.159 -1.381 19707 3481 1 7 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.883 0.158 19707 3482 1 7 . 1 1 86 86 VAL C C 86 172.570 172.570 174.466 -1.896 19707 3483 1 7 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.282 -4.082 19707 3484 1 7 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.618 -3.343 19707 3485 1 7 . 1 1 86 86 VAL H H 86 9.228 9.228 9.115 0.113 19707 3486 1 7 . 1 1 87 87 GLU N N 87 120.437 120.437 126.318 -5.881 19707 3487 1 7 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.564 0.167 19707 3488 1 7 . 1 1 87 87 GLU C C 87 172.267 172.267 175.100 -2.833 19707 3489 1 7 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.432 -3.083 19707 3490 1 7 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.870 -2.746 19707 3491 1 7 . 1 1 87 87 GLU H H 87 8.851 8.851 9.239 -0.388 19707 3492 1 7 . 1 1 88 88 GLU N N 88 118.525 118.525 122.001 -3.476 19707 3493 1 7 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.780 0.221 19707 3494 1 7 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.130 -3.213 19707 3495 1 7 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.944 -2.998 19707 3496 1 7 . 1 1 88 88 GLU H H 88 8.380 8.380 8.665 -0.285 19707 3497 1 7 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.423 0.106 19707 3498 1 7 . 1 1 89 89 PRO C C 89 172.774 172.774 176.581 -3.807 19707 3499 1 7 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.193 -2.812 19707 3500 1 7 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.121 -2.787 19707 3501 1 8 . 1 1 2 2 SER N N 2 115.963 115.963 115.828 0.135 19707 3502 1 8 . 1 1 2 2 SER HA H 2 4.408 4.408 4.683 -0.275 19707 3503 1 8 . 1 1 2 2 SER C C 2 171.788 171.788 174.841 -3.053 19707 3504 1 8 . 1 1 2 2 SER CA C 2 55.870 55.870 57.728 -1.858 19707 3505 1 8 . 1 1 2 2 SER CB C 2 61.022 61.022 64.029 -3.007 19707 3506 1 8 . 1 1 2 2 SER H H 2 8.661 8.661 8.297 0.364 19707 3507 1 8 . 1 1 3 3 GLU N N 3 122.941 122.941 121.480 1.461 19707 3508 1 8 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.384 -0.064 19707 3509 1 8 . 1 1 3 3 GLU C C 3 173.817 173.817 175.102 -1.285 19707 3510 1 8 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.693 -2.739 19707 3511 1 8 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.093 -3.256 19707 3512 1 8 . 1 1 3 3 GLU H H 3 8.706 8.706 8.457 0.249 19707 3513 1 8 . 1 1 4 4 THR N N 4 116.182 116.182 116.320 -0.138 19707 3514 1 8 . 1 1 4 4 THR HA H 4 4.233 4.233 4.390 -0.157 19707 3515 1 8 . 1 1 4 4 THR C C 4 171.719 171.719 173.246 -1.527 19707 3516 1 8 . 1 1 4 4 THR CA C 4 59.414 59.414 61.792 -2.378 19707 3517 1 8 . 1 1 4 4 THR CB C 4 67.009 67.009 70.049 -3.040 19707 3518 1 8 . 1 1 4 4 THR H H 4 8.165 8.165 8.143 0.022 19707 3519 1 8 . 1 1 5 5 ARG N N 5 124.184 124.184 124.932 -0.748 19707 3520 1 8 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.272 0.088 19707 3521 1 8 . 1 1 5 5 ARG C C 5 173.520 173.520 176.494 -2.974 19707 3522 1 8 . 1 1 5 5 ARG CA C 5 53.343 53.343 56.136 -2.793 19707 3523 1 8 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.610 -2.445 19707 3524 1 8 . 1 1 5 5 ARG H H 5 8.354 8.354 8.373 -0.019 19707 3525 1 8 . 1 1 6 6 THR N N 6 116.652 116.652 117.016 -0.364 19707 3526 1 8 . 1 1 6 6 THR HA H 6 4.263 4.263 4.410 -0.147 19707 3527 1 8 . 1 1 6 6 THR C C 6 171.784 171.784 174.411 -2.627 19707 3528 1 8 . 1 1 6 6 THR CA C 6 59.218 59.218 61.751 -2.533 19707 3529 1 8 . 1 1 6 6 THR CB C 6 67.213 67.213 69.769 -2.556 19707 3530 1 8 . 1 1 6 6 THR H H 6 8.224 8.224 8.379 -0.155 19707 3531 1 8 . 1 1 7 7 ILE N N 7 123.882 123.882 122.168 1.714 19707 3532 1 8 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.451 -0.313 19707 3533 1 8 . 1 1 7 7 ILE C C 7 173.572 173.572 175.202 -1.630 19707 3534 1 8 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.973 -2.491 19707 3535 1 8 . 1 1 7 7 ILE CB C 7 36.069 36.069 39.643 -3.574 19707 3536 1 8 . 1 1 7 7 ILE H H 7 8.247 8.247 8.329 -0.082 19707 3537 1 8 . 1 1 8 8 SER N N 8 120.287 120.287 121.253 -0.966 19707 3538 1 8 . 1 1 8 8 SER HA H 8 4.445 4.445 4.820 -0.375 19707 3539 1 8 . 1 1 8 8 SER C C 8 171.926 171.926 174.625 -2.699 19707 3540 1 8 . 1 1 8 8 SER CA C 8 55.522 55.522 57.193 -1.671 19707 3541 1 8 . 1 1 8 8 SER CB C 8 61.073 61.073 65.998 -4.925 19707 3542 1 8 . 1 1 8 8 SER H H 8 8.402 8.402 8.604 -0.202 19707 3543 1 8 . 1 1 9 9 SER N N 9 118.425 118.425 121.414 -2.989 19707 3544 1 8 . 1 1 9 9 SER HA H 9 4.525 4.525 4.286 0.239 19707 3545 1 8 . 1 1 9 9 SER C C 9 172.663 172.663 174.489 -1.826 19707 3546 1 8 . 1 1 9 9 SER CA C 9 55.897 55.897 59.511 -3.614 19707 3547 1 8 . 1 1 9 9 SER CB C 9 61.375 61.375 62.603 -1.228 19707 3548 1 8 . 1 1 9 9 SER H H 9 8.362 8.362 9.093 -0.731 19707 3549 1 8 . 1 1 10 10 THR N N 10 115.676 115.676 110.213 5.463 19707 3550 1 8 . 1 1 10 10 THR HA H 10 4.232 4.232 4.471 -0.239 19707 3551 1 8 . 1 1 10 10 THR C C 10 173.070 173.070 175.529 -2.459 19707 3552 1 8 . 1 1 10 10 THR CA C 10 60.318 60.318 62.971 -2.654 19707 3553 1 8 . 1 1 10 10 THR CB C 10 67.205 67.205 70.062 -2.857 19707 3554 1 8 . 1 1 10 10 THR H H 10 8.274 8.274 7.314 0.960 19707 3555 1 8 . 1 1 11 11 ALA N N 11 124.726 124.726 124.548 0.178 19707 3556 1 8 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.181 -0.194 19707 3557 1 8 . 1 1 11 11 ALA C C 11 176.825 176.825 179.430 -2.605 19707 3558 1 8 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.593 -2.052 19707 3559 1 8 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.221 -2.332 19707 3560 1 8 . 1 1 11 11 ALA H H 11 8.347 8.347 8.229 0.118 19707 3561 1 8 . 1 1 12 12 GLN N N 12 117.915 117.915 117.147 0.768 19707 3562 1 8 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.214 -0.425 19707 3563 1 8 . 1 1 12 12 GLN C C 12 174.697 174.697 177.263 -2.566 19707 3564 1 8 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.423 -2.419 19707 3565 1 8 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.840 -2.615 19707 3566 1 8 . 1 1 12 12 GLN H H 12 8.194 8.194 8.067 0.127 19707 3567 1 8 . 1 1 13 13 GLU N N 13 118.510 118.510 119.461 -0.951 19707 3568 1 8 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.166 -0.063 19707 3569 1 8 . 1 1 13 13 GLU C C 13 176.192 176.192 179.215 -3.023 19707 3570 1 8 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.725 -2.410 19707 3571 1 8 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.827 -3.794 19707 3572 1 8 . 1 1 13 13 GLU H H 13 7.917 7.917 7.925 -0.008 19707 3573 1 8 . 1 1 14 14 ARG N N 14 118.193 118.193 120.179 -1.986 19707 3574 1 8 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.074 -0.106 19707 3575 1 8 . 1 1 14 14 ARG C C 14 176.764 176.764 178.512 -1.748 19707 3576 1 8 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.053 -1.770 19707 3577 1 8 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.382 -2.145 19707 3578 1 8 . 1 1 14 14 ARG H H 14 7.907 7.907 8.225 -0.318 19707 3579 1 8 . 1 1 15 15 VAL N N 15 117.991 117.991 114.895 3.096 19707 3580 1 8 . 1 1 15 15 VAL HA H 15 3.903 3.903 4.053 -0.150 19707 3581 1 8 . 1 1 15 15 VAL C C 15 174.922 174.922 177.632 -2.710 19707 3582 1 8 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.685 -1.854 19707 3583 1 8 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.391 -2.668 19707 3584 1 8 . 1 1 15 15 VAL H H 15 7.658 7.658 7.553 0.105 19707 3585 1 8 . 1 1 16 16 ASP N N 16 124.314 124.314 121.321 2.993 19707 3586 1 8 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.455 -0.139 19707 3587 1 8 . 1 1 16 16 ASP C C 16 176.462 176.462 177.785 -1.323 19707 3588 1 8 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.213 -1.887 19707 3589 1 8 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.458 -4.789 19707 3590 1 8 . 1 1 16 16 ASP H H 16 8.291 8.291 8.010 0.281 19707 3591 1 8 . 1 1 17 17 LEU N N 17 120.212 120.212 119.063 1.149 19707 3592 1 8 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.116 -0.062 19707 3593 1 8 . 1 1 17 17 LEU C C 17 177.171 177.171 179.063 -1.892 19707 3594 1 8 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.658 -2.678 19707 3595 1 8 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.213 -2.368 19707 3596 1 8 . 1 1 17 17 LEU H H 17 8.172 8.172 7.549 0.623 19707 3597 1 8 . 1 1 18 18 GLU N N 18 120.587 120.587 119.467 1.120 19707 3598 1 8 . 1 1 18 18 GLU HA H 18 4.193 4.193 4.039 0.154 19707 3599 1 8 . 1 1 18 18 GLU C C 18 175.997 175.997 178.631 -2.634 19707 3600 1 8 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.272 -3.170 19707 3601 1 8 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.872 -2.800 19707 3602 1 8 . 1 1 18 18 GLU H H 18 7.876 7.876 7.827 0.049 19707 3603 1 8 . 1 1 19 19 ALA N N 19 121.800 121.800 123.295 -1.495 19707 3604 1 8 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.143 -0.352 19707 3605 1 8 . 1 1 19 19 ALA C C 19 175.708 175.708 179.763 -4.055 19707 3606 1 8 . 1 1 19 19 ALA CA C 19 52.852 52.852 55.064 -2.212 19707 3607 1 8 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.338 -4.184 19707 3608 1 8 . 1 1 19 19 ALA H H 19 7.792 7.792 7.578 0.214 19707 3609 1 8 . 1 1 20 20 VAL N N 20 118.680 118.680 118.933 -0.253 19707 3610 1 8 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.689 -0.389 19707 3611 1 8 . 1 1 20 20 VAL C C 20 176.276 176.276 178.033 -1.757 19707 3612 1 8 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.330 -2.523 19707 3613 1 8 . 1 1 20 20 VAL CB C 20 29.551 29.551 30.939 -1.387 19707 3614 1 8 . 1 1 20 20 VAL H H 20 7.712 7.712 8.087 -0.375 19707 3615 1 8 . 1 1 21 21 ARG N N 21 121.935 121.935 121.057 0.878 19707 3616 1 8 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.081 -0.086 19707 3617 1 8 . 1 1 21 21 ARG C C 21 176.828 176.828 178.754 -1.926 19707 3618 1 8 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.560 -1.900 19707 3619 1 8 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.531 -2.241 19707 3620 1 8 . 1 1 21 21 ARG H H 21 8.444 8.444 8.256 0.188 19707 3621 1 8 . 1 1 22 22 LEU N N 22 119.327 119.327 119.541 -0.214 19707 3622 1 8 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.092 -0.097 19707 3623 1 8 . 1 1 22 22 LEU C C 22 175.664 175.664 178.610 -2.946 19707 3624 1 8 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.140 -3.272 19707 3625 1 8 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.573 -2.438 19707 3626 1 8 . 1 1 22 22 LEU H H 22 8.248 8.248 8.114 0.134 19707 3627 1 8 . 1 1 23 23 ALA N N 23 121.202 121.202 122.220 -1.018 19707 3628 1 8 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.919 -0.184 19707 3629 1 8 . 1 1 23 23 ALA C C 23 175.492 175.492 179.443 -3.951 19707 3630 1 8 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.318 -2.249 19707 3631 1 8 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.974 -3.908 19707 3632 1 8 . 1 1 23 23 ALA H H 23 8.392 8.392 8.617 -0.225 19707 3633 1 8 . 1 1 24 24 SER N N 24 112.377 112.377 114.969 -2.592 19707 3634 1 8 . 1 1 24 24 SER HA H 24 4.214 4.214 4.272 -0.058 19707 3635 1 8 . 1 1 24 24 SER C C 24 174.773 174.773 176.400 -1.627 19707 3636 1 8 . 1 1 24 24 SER CA C 24 59.258 59.258 62.470 -3.212 19707 3637 1 8 . 1 1 24 24 SER CB C 24 60.149 60.149 63.032 -2.883 19707 3638 1 8 . 1 1 24 24 SER H H 24 7.690 7.690 8.066 -0.376 19707 3639 1 8 . 1 1 25 25 ILE N N 25 123.886 123.886 122.135 1.751 19707 3640 1 8 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.996 -0.154 19707 3641 1 8 . 1 1 25 25 ILE C C 25 176.487 176.487 178.201 -1.714 19707 3642 1 8 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.447 -0.454 19707 3643 1 8 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.466 -0.534 19707 3644 1 8 . 1 1 25 25 ILE H H 25 7.837 7.837 7.963 -0.126 19707 3645 1 8 . 1 1 26 26 VAL N N 26 122.538 122.538 121.367 1.171 19707 3646 1 8 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.707 -0.319 19707 3647 1 8 . 1 1 26 26 VAL C C 26 174.624 174.624 178.052 -3.428 19707 3648 1 8 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.398 -2.483 19707 3649 1 8 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.293 -3.398 19707 3650 1 8 . 1 1 26 26 VAL H H 26 8.804 8.804 8.676 0.128 19707 3651 1 8 . 1 1 27 27 ASP N N 27 120.433 120.433 121.059 -0.626 19707 3652 1 8 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.334 -0.170 19707 3653 1 8 . 1 1 27 27 ASP C C 27 174.966 174.966 178.953 -3.987 19707 3654 1 8 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.840 -2.511 19707 3655 1 8 . 1 1 27 27 ASP CB C 27 37.854 37.854 39.938 -2.084 19707 3656 1 8 . 1 1 27 27 ASP H H 27 8.719 8.719 8.676 0.043 19707 3657 1 8 . 1 1 28 28 SER N N 28 112.397 112.397 114.680 -2.283 19707 3658 1 8 . 1 1 28 28 SER HA H 28 4.073 4.073 4.231 -0.158 19707 3659 1 8 . 1 1 28 28 SER C C 28 174.405 174.405 175.729 -1.324 19707 3660 1 8 . 1 1 28 28 SER CA C 28 59.115 59.115 61.571 -2.456 19707 3661 1 8 . 1 1 28 28 SER CB C 28 60.125 60.125 63.153 -3.028 19707 3662 1 8 . 1 1 28 28 SER H H 28 7.599 7.599 8.180 -0.581 19707 3663 1 8 . 1 1 29 29 ARG N N 29 123.945 123.945 121.597 2.348 19707 3664 1 8 . 1 1 29 29 ARG HA H 29 4.027 4.027 4.000 0.027 19707 3665 1 8 . 1 1 29 29 ARG C C 29 175.902 175.902 178.113 -2.211 19707 3666 1 8 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.728 -3.454 19707 3667 1 8 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.275 -1.535 19707 3668 1 8 . 1 1 29 29 ARG H H 29 7.769 7.769 7.597 0.172 19707 3669 1 8 . 1 1 30 30 LEU N N 30 121.580 121.580 120.969 0.611 19707 3670 1 8 . 1 1 30 30 LEU HA H 30 3.749 3.749 4.009 -0.260 19707 3671 1 8 . 1 1 30 30 LEU C C 30 177.474 177.474 179.642 -2.168 19707 3672 1 8 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.898 -2.585 19707 3673 1 8 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.955 -2.926 19707 3674 1 8 . 1 1 30 30 LEU H H 30 8.665 8.665 8.259 0.406 19707 3675 1 8 . 1 1 31 31 ILE N N 31 119.330 119.330 118.145 1.185 19707 3676 1 8 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.818 -0.127 19707 3677 1 8 . 1 1 31 31 ILE C C 31 175.341 175.341 177.490 -2.149 19707 3678 1 8 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.075 -2.563 19707 3679 1 8 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.557 -1.990 19707 3680 1 8 . 1 1 31 31 ILE H H 31 8.226 8.226 8.614 -0.388 19707 3681 1 8 . 1 1 32 32 GLY N N 32 106.092 106.092 107.838 -1.746 19707 3682 1 8 . 1 1 32 32 GLY C C 32 172.413 172.413 175.190 -2.777 19707 3683 1 8 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.825 -3.328 19707 3684 1 8 . 1 1 32 32 GLY H H 32 7.767 7.767 7.724 0.043 19707 3685 1 8 . 1 1 33 33 THR N N 33 110.966 110.966 113.733 -2.767 19707 3686 1 8 . 1 1 33 33 THR HA H 33 4.455 4.455 4.440 0.015 19707 3687 1 8 . 1 1 33 33 THR C C 33 172.714 172.714 175.310 -2.596 19707 3688 1 8 . 1 1 33 33 THR CA C 33 60.032 60.032 61.777 -1.745 19707 3689 1 8 . 1 1 33 33 THR CB C 33 68.287 68.287 69.888 -1.601 19707 3690 1 8 . 1 1 33 33 THR H H 33 8.102 8.102 7.785 0.317 19707 3691 1 8 . 1 1 34 34 GLY N N 34 110.320 110.320 110.222 0.098 19707 3692 1 8 . 1 1 34 34 GLY C C 34 170.505 170.505 173.702 -3.197 19707 3693 1 8 . 1 1 34 34 GLY CA C 34 42.583 42.583 44.902 -2.319 19707 3694 1 8 . 1 1 34 34 GLY H H 34 8.072 8.072 8.149 -0.077 19707 3695 1 8 . 1 1 35 35 SER N N 35 112.944 112.944 115.370 -2.426 19707 3696 1 8 . 1 1 35 35 SER HA H 35 4.385 4.385 4.895 -0.510 19707 3697 1 8 . 1 1 35 35 SER C C 35 169.537 169.537 172.564 -3.027 19707 3698 1 8 . 1 1 35 35 SER CA C 35 54.794 54.794 57.864 -3.070 19707 3699 1 8 . 1 1 35 35 SER CB C 35 62.029 62.029 66.152 -4.123 19707 3700 1 8 . 1 1 35 35 SER H H 35 7.719 7.719 7.683 0.036 19707 3701 1 8 . 1 1 36 36 VAL N N 36 118.566 118.566 123.237 -4.671 19707 3702 1 8 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.194 -0.161 19707 3703 1 8 . 1 1 36 36 VAL C C 36 169.876 169.876 173.787 -3.911 19707 3704 1 8 . 1 1 36 36 VAL CA C 36 58.565 58.565 59.802 -1.237 19707 3705 1 8 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.595 -2.643 19707 3706 1 8 . 1 1 36 36 VAL H H 36 8.490 8.490 8.374 0.116 19707 3707 1 8 . 1 1 37 37 ASP N N 37 121.640 121.640 127.103 -5.463 19707 3708 1 8 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.896 -0.094 19707 3709 1 8 . 1 1 37 37 ASP C C 37 172.806 172.806 176.344 -3.538 19707 3710 1 8 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.690 -3.647 19707 3711 1 8 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.396 -3.190 19707 3712 1 8 . 1 1 37 37 ASP H H 37 7.195 7.195 8.005 -0.810 19707 3713 1 8 . 1 1 38 38 GLU N N 38 120.018 120.018 120.607 -0.589 19707 3714 1 8 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.980 -0.323 19707 3715 1 8 . 1 1 38 38 GLU C C 38 174.753 174.753 178.100 -3.347 19707 3716 1 8 . 1 1 38 38 GLU CA C 38 57.492 57.492 59.824 -2.332 19707 3717 1 8 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.962 -3.883 19707 3718 1 8 . 1 1 38 38 GLU H H 38 8.908 8.908 8.702 0.206 19707 3719 1 8 . 1 1 39 39 ASP N N 39 118.668 118.668 117.761 0.907 19707 3720 1 8 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.472 -0.226 19707 3721 1 8 . 1 1 39 39 ASP C C 39 175.393 175.393 177.962 -2.569 19707 3722 1 8 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.415 -1.551 19707 3723 1 8 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.539 -3.569 19707 3724 1 8 . 1 1 39 39 ASP H H 39 8.242 8.242 8.632 -0.390 19707 3725 1 8 . 1 1 40 40 PHE N N 40 119.851 119.851 118.656 1.195 19707 3726 1 8 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.407 -0.203 19707 3727 1 8 . 1 1 40 40 PHE C C 40 174.929 174.929 175.404 -0.475 19707 3728 1 8 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.050 -1.879 19707 3729 1 8 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.740 -2.907 19707 3730 1 8 . 1 1 40 40 PHE H H 40 8.037 8.037 7.763 0.274 19707 3731 1 8 . 1 1 41 41 LEU N N 41 117.882 117.882 116.559 1.323 19707 3732 1 8 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.305 -0.783 19707 3733 1 8 . 1 1 41 41 LEU C C 41 175.938 175.938 178.758 -2.820 19707 3734 1 8 . 1 1 41 41 LEU CA C 41 54.860 54.860 55.421 -0.561 19707 3735 1 8 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.941 -3.710 19707 3736 1 8 . 1 1 41 41 LEU H H 41 7.816 7.816 7.300 0.516 19707 3737 1 8 . 1 1 42 42 ARG N N 42 118.360 118.360 119.994 -1.634 19707 3738 1 8 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.015 -0.275 19707 3739 1 8 . 1 1 42 42 ARG C C 42 175.435 175.435 177.194 -1.759 19707 3740 1 8 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.067 -2.096 19707 3741 1 8 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.756 -2.492 19707 3742 1 8 . 1 1 42 42 ARG H H 42 8.540 8.540 8.210 0.330 19707 3743 1 8 . 1 1 43 43 GLU N N 43 114.947 114.947 116.906 -1.959 19707 3744 1 8 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.337 -0.287 19707 3745 1 8 . 1 1 43 43 GLU C C 43 174.518 174.518 177.681 -3.163 19707 3746 1 8 . 1 1 43 43 GLU CA C 43 54.571 54.571 56.836 -2.265 19707 3747 1 8 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.076 -3.035 19707 3748 1 8 . 1 1 43 43 GLU H H 43 7.223 7.223 8.275 -1.052 19707 3749 1 8 . 1 1 44 44 GLN N N 44 114.109 114.109 117.956 -3.847 19707 3750 1 8 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.340 -0.234 19707 3751 1 8 . 1 1 44 44 GLN C C 44 173.777 173.777 177.336 -3.559 19707 3752 1 8 . 1 1 44 44 GLN CA C 44 52.181 52.181 56.177 -3.996 19707 3753 1 8 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.285 -3.414 19707 3754 1 8 . 1 1 44 44 GLN H H 44 7.372 7.372 8.380 -1.008 19707 3755 1 8 . 1 1 45 45 ILE N N 45 117.470 117.470 118.353 -0.883 19707 3756 1 8 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.726 0.222 19707 3757 1 8 . 1 1 45 45 ILE C C 45 172.305 172.305 177.042 -4.737 19707 3758 1 8 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.808 -5.303 19707 3759 1 8 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.642 -1.942 19707 3760 1 8 . 1 1 45 45 ILE H H 45 7.235 7.235 7.496 -0.261 19707 3761 1 8 . 1 1 46 46 ARG N N 46 122.996 122.996 115.594 7.402 19707 3762 1 8 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.024 0.166 19707 3763 1 8 . 1 1 46 46 ARG C C 46 172.992 172.992 175.442 -2.450 19707 3764 1 8 . 1 1 46 46 ARG CA C 46 53.761 53.761 57.806 -4.045 19707 3765 1 8 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.165 -0.213 19707 3766 1 8 . 1 1 46 46 ARG H H 46 8.336 8.336 8.739 -0.403 19707 3767 1 8 . 1 1 47 47 ASP N N 47 118.676 118.676 115.659 3.017 19707 3768 1 8 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.596 -0.148 19707 3769 1 8 . 1 1 47 47 ASP C C 47 172.520 172.520 174.904 -2.384 19707 3770 1 8 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.202 -2.312 19707 3771 1 8 . 1 1 47 47 ASP CB C 47 37.657 37.657 41.696 -4.039 19707 3772 1 8 . 1 1 47 47 ASP H H 47 8.313 8.313 7.650 0.663 19707 3773 1 8 . 1 1 48 48 ALA N N 48 120.922 120.922 122.042 -1.120 19707 3774 1 8 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.448 -0.079 19707 3775 1 8 . 1 1 48 48 ALA C C 48 174.295 174.295 177.351 -3.056 19707 3776 1 8 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.056 -2.419 19707 3777 1 8 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.815 -3.601 19707 3778 1 8 . 1 1 48 48 ALA H H 48 7.824 7.824 7.422 0.402 19707 3779 1 8 . 1 1 49 49 ARG N N 49 118.644 118.644 120.995 -2.351 19707 3780 1 8 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.020 0.322 19707 3781 1 8 . 1 1 49 49 ARG C C 49 172.504 172.504 176.349 -3.845 19707 3782 1 8 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.748 -3.838 19707 3783 1 8 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.811 -2.468 19707 3784 1 8 . 1 1 49 49 ARG H H 49 7.911 7.911 8.387 -0.476 19707 3785 1 8 . 1 1 50 50 TYR N N 50 119.470 119.470 114.836 4.634 19707 3786 1 8 . 1 1 50 50 TYR HA H 50 5.291 5.291 4.953 0.338 19707 3787 1 8 . 1 1 50 50 TYR C C 50 170.470 170.470 174.128 -3.658 19707 3788 1 8 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.352 -2.084 19707 3789 1 8 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.374 -0.862 19707 3790 1 8 . 1 1 50 50 TYR H H 50 7.639 7.639 7.966 -0.327 19707 3791 1 8 . 1 1 51 51 ALA N N 51 127.418 127.418 125.369 2.049 19707 3792 1 8 . 1 1 51 51 ALA HA H 51 5.221 5.221 4.984 0.237 19707 3793 1 8 . 1 1 51 51 ALA C C 51 171.328 171.328 175.356 -4.028 19707 3794 1 8 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.640 -3.207 19707 3795 1 8 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.351 -1.038 19707 3796 1 8 . 1 1 51 51 ALA H H 51 8.222 8.222 8.693 -0.471 19707 3797 1 8 . 1 1 52 52 VAL N N 52 117.832 117.832 121.491 -3.659 19707 3798 1 8 . 1 1 52 52 VAL HA H 52 4.667 4.667 4.830 -0.163 19707 3799 1 8 . 1 1 52 52 VAL C C 52 172.436 172.436 174.162 -1.726 19707 3800 1 8 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.611 -3.854 19707 3801 1 8 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.662 -4.559 19707 3802 1 8 . 1 1 52 52 VAL H H 52 8.753 8.753 9.057 -0.304 19707 3803 1 8 . 1 1 53 53 ILE N N 53 128.027 128.027 125.050 2.977 19707 3804 1 8 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.671 0.171 19707 3805 1 8 . 1 1 53 53 ILE C C 53 172.110 172.110 174.678 -2.568 19707 3806 1 8 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.237 -2.484 19707 3807 1 8 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.935 -3.776 19707 3808 1 8 . 1 1 53 53 ILE H H 53 9.261 9.261 8.872 0.389 19707 3809 1 8 . 1 1 54 54 ARG N N 54 127.885 127.885 125.900 1.985 19707 3810 1 8 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.651 0.102 19707 3811 1 8 . 1 1 54 54 ARG C C 54 172.285 172.285 174.425 -2.140 19707 3812 1 8 . 1 1 54 54 ARG CA C 54 52.260 52.260 54.045 -1.785 19707 3813 1 8 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.812 -2.920 19707 3814 1 8 . 1 1 54 54 ARG H H 54 8.686 8.686 8.999 -0.313 19707 3815 1 8 . 1 1 55 55 ILE N N 55 129.907 129.907 123.576 6.331 19707 3816 1 8 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.367 -0.214 19707 3817 1 8 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.361 -2.766 19707 3818 1 8 . 1 1 55 55 ILE CB C 55 37.613 37.613 38.996 -1.383 19707 3819 1 8 . 1 1 55 55 ILE H H 55 9.292 9.292 8.247 1.045 19707 3820 1 8 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.337 -0.145 19707 3821 1 8 . 1 1 56 56 PRO C C 56 174.787 174.787 177.684 -2.897 19707 3822 1 8 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.999 -2.265 19707 3823 1 8 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.871 -2.958 19707 3824 1 8 . 1 1 57 57 GLY N N 57 111.828 111.828 111.376 0.452 19707 3825 1 8 . 1 1 57 57 GLY C C 57 171.039 171.039 173.543 -2.504 19707 3826 1 8 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.946 -2.129 19707 3827 1 8 . 1 1 57 57 GLY H H 57 8.708 8.708 8.906 -0.198 19707 3828 1 8 . 1 1 58 58 GLN N N 58 118.457 118.457 119.588 -1.131 19707 3829 1 8 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.825 0.075 19707 3830 1 8 . 1 1 58 58 GLN CA C 58 50.272 50.272 52.993 -2.721 19707 3831 1 8 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.829 -2.675 19707 3832 1 8 . 1 1 58 58 GLN H H 58 7.909 7.909 7.551 0.358 19707 3833 1 8 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.444 -0.008 19707 3834 1 8 . 1 1 59 59 PRO C C 59 174.607 174.607 176.594 -1.987 19707 3835 1 8 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.967 -2.912 19707 3836 1 8 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.212 -3.034 19707 3837 1 8 . 1 1 60 60 VAL N N 60 122.695 122.695 122.152 0.543 19707 3838 1 8 . 1 1 60 60 VAL HA H 60 3.955 3.955 3.855 0.100 19707 3839 1 8 . 1 1 60 60 VAL C C 60 172.403 172.403 175.699 -3.296 19707 3840 1 8 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.799 -1.904 19707 3841 1 8 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.252 -2.610 19707 3842 1 8 . 1 1 60 60 VAL H H 60 8.364 8.364 8.225 0.139 19707 3843 1 8 . 1 1 61 61 VAL N N 61 126.097 126.097 126.959 -0.862 19707 3844 1 8 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.532 -0.232 19707 3845 1 8 . 1 1 61 61 VAL C C 61 170.891 170.891 173.990 -3.099 19707 3846 1 8 . 1 1 61 61 VAL CA C 61 58.814 58.814 60.446 -1.632 19707 3847 1 8 . 1 1 61 61 VAL CB C 61 31.198 31.198 35.028 -3.830 19707 3848 1 8 . 1 1 61 61 VAL H H 61 8.023 8.023 8.368 -0.345 19707 3849 1 8 . 1 1 62 62 GLU N N 62 126.097 126.097 127.159 -1.062 19707 3850 1 8 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.976 0.183 19707 3851 1 8 . 1 1 62 62 GLU C C 62 172.252 172.252 175.178 -2.926 19707 3852 1 8 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.037 -3.497 19707 3853 1 8 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.810 -2.510 19707 3854 1 8 . 1 1 62 62 GLU H H 62 8.591 8.591 8.500 0.091 19707 3855 1 8 . 1 1 63 63 VAL N N 63 120.374 120.374 122.782 -2.408 19707 3856 1 8 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.249 0.144 19707 3857 1 8 . 1 1 63 63 VAL C C 63 171.040 171.040 176.983 -5.943 19707 3858 1 8 . 1 1 63 63 VAL CA C 63 57.833 57.833 60.892 -3.059 19707 3859 1 8 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.856 -0.279 19707 3860 1 8 . 1 1 63 63 VAL H H 63 8.732 8.732 8.862 -0.130 19707 3861 1 8 . 1 1 64 64 GLY N N 64 109.935 109.935 114.525 -4.590 19707 3862 1 8 . 1 1 64 64 GLY C C 64 171.656 171.656 173.899 -2.243 19707 3863 1 8 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.221 -5.044 19707 3864 1 8 . 1 1 64 64 GLY H H 64 8.259 8.259 8.541 -0.282 19707 3865 1 8 . 1 1 65 65 THR N N 65 115.478 115.478 115.847 -0.369 19707 3866 1 8 . 1 1 65 65 THR HA H 65 4.342 4.342 4.330 0.012 19707 3867 1 8 . 1 1 65 65 THR C C 65 170.663 170.663 172.748 -2.085 19707 3868 1 8 . 1 1 65 65 THR CA C 65 58.357 58.357 60.307 -1.950 19707 3869 1 8 . 1 1 65 65 THR CB C 65 67.923 67.923 71.951 -4.027 19707 3870 1 8 . 1 1 65 65 THR H H 65 8.123 8.123 7.569 0.554 19707 3871 1 8 . 1 1 66 66 LYS N N 66 130.775 130.775 123.716 7.059 19707 3872 1 8 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.176 -1.246 19707 3873 1 8 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.886 -2.696 19707 3874 1 8 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.763 -3.073 19707 3875 1 8 . 1 1 66 66 LYS H H 66 8.472 8.472 8.137 0.335 19707 3876 1 8 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.572 -0.161 19707 3877 1 8 . 1 1 67 67 PRO C C 67 173.211 173.211 176.977 -3.766 19707 3878 1 8 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.418 -2.852 19707 3879 1 8 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.673 -3.270 19707 3880 1 8 . 1 1 68 68 THR N N 68 111.983 111.983 114.745 -2.762 19707 3881 1 8 . 1 1 68 68 THR HA H 68 4.277 4.277 4.252 0.025 19707 3882 1 8 . 1 1 68 68 THR C C 68 171.720 171.720 175.599 -3.879 19707 3883 1 8 . 1 1 68 68 THR CA C 68 58.193 58.193 62.865 -4.673 19707 3884 1 8 . 1 1 68 68 THR CB C 68 67.723 67.723 69.175 -1.452 19707 3885 1 8 . 1 1 68 68 THR H H 68 8.091 8.091 8.117 -0.026 19707 3886 1 8 . 1 1 69 69 GLY N N 69 109.918 109.918 108.697 1.221 19707 3887 1 8 . 1 1 69 69 GLY C C 69 170.783 170.783 174.476 -3.693 19707 3888 1 8 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.745 -2.689 19707 3889 1 8 . 1 1 69 69 GLY H H 69 8.119 8.119 8.060 0.059 19707 3890 1 8 . 1 1 70 70 ASP N N 70 123.294 123.294 124.697 -1.403 19707 3891 1 8 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.831 -0.282 19707 3892 1 8 . 1 1 70 70 ASP C C 70 173.651 173.651 175.086 -1.435 19707 3893 1 8 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.730 -2.869 19707 3894 1 8 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.498 -1.765 19707 3895 1 8 . 1 1 70 70 ASP H H 70 8.444 8.444 8.707 -0.263 19707 3896 1 8 . 1 1 71 71 VAL N N 71 117.772 117.772 114.190 3.582 19707 3897 1 8 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.144 -0.437 19707 3898 1 8 . 1 1 71 71 VAL C C 71 172.992 172.992 174.301 -1.309 19707 3899 1 8 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.074 -1.698 19707 3900 1 8 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.408 -2.386 19707 3901 1 8 . 1 1 71 71 VAL H H 71 8.173 8.173 7.778 0.395 19707 3902 1 8 . 1 1 72 72 LEU N N 72 123.435 123.435 122.815 0.620 19707 3903 1 8 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.545 0.091 19707 3904 1 8 . 1 1 72 72 LEU C C 72 173.189 173.189 176.111 -2.922 19707 3905 1 8 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.261 -3.054 19707 3906 1 8 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.262 -1.624 19707 3907 1 8 . 1 1 72 72 LEU H H 72 8.859 8.859 8.891 -0.032 19707 3908 1 8 . 1 1 73 73 GLN N N 73 119.520 119.520 121.565 -2.045 19707 3909 1 8 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.125 0.220 19707 3910 1 8 . 1 1 73 73 GLN C C 73 172.249 172.249 175.567 -3.318 19707 3911 1 8 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.614 -3.281 19707 3912 1 8 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.506 -1.736 19707 3913 1 8 . 1 1 73 73 GLN H H 73 9.196 9.196 8.294 0.902 19707 3914 1 8 . 1 1 74 74 GLY N N 74 113.513 113.513 111.686 1.827 19707 3915 1 8 . 1 1 74 74 GLY C C 74 169.072 169.072 171.974 -2.902 19707 3916 1 8 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.701 -2.404 19707 3917 1 8 . 1 1 74 74 GLY H H 74 9.373 9.373 9.131 0.242 19707 3918 1 8 . 1 1 75 75 ARG N N 75 122.479 122.479 122.201 0.278 19707 3919 1 8 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.446 0.056 19707 3920 1 8 . 1 1 75 75 ARG C C 75 172.348 172.348 174.035 -1.687 19707 3921 1 8 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.468 -3.710 19707 3922 1 8 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.457 -2.639 19707 3923 1 8 . 1 1 75 75 ARG H H 75 8.615 8.615 8.330 0.285 19707 3924 1 8 . 1 1 76 76 ALA N N 76 122.346 122.346 125.321 -2.975 19707 3925 1 8 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.722 -0.186 19707 3926 1 8 . 1 1 76 76 ALA C C 76 172.704 172.704 174.589 -1.885 19707 3927 1 8 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.895 -2.868 19707 3928 1 8 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.669 -2.644 19707 3929 1 8 . 1 1 76 76 ALA H H 76 8.590 8.590 8.862 -0.272 19707 3930 1 8 . 1 1 77 77 THR N N 77 116.961 116.961 115.865 1.096 19707 3931 1 8 . 1 1 77 77 THR HA H 77 4.988 4.988 5.121 -0.133 19707 3932 1 8 . 1 1 77 77 THR C C 77 172.800 172.800 174.846 -2.046 19707 3933 1 8 . 1 1 77 77 THR CA C 77 58.344 58.344 61.593 -3.249 19707 3934 1 8 . 1 1 77 77 THR CB C 77 67.712 67.712 71.292 -3.580 19707 3935 1 8 . 1 1 77 77 THR H H 77 8.491 8.491 8.264 0.227 19707 3936 1 8 . 1 1 78 78 GLY N N 78 111.103 111.103 112.810 -1.707 19707 3937 1 8 . 1 1 78 78 GLY C C 78 172.567 172.567 175.013 -2.446 19707 3938 1 8 . 1 1 78 78 GLY CA C 78 41.309 41.309 44.490 -3.181 19707 3939 1 8 . 1 1 78 78 GLY H H 78 8.649 8.649 9.335 -0.686 19707 3940 1 8 . 1 1 79 79 GLU N N 79 123.423 123.423 120.645 2.778 19707 3941 1 8 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.068 -0.072 19707 3942 1 8 . 1 1 79 79 GLU C C 79 175.466 175.466 177.845 -2.379 19707 3943 1 8 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.962 -3.503 19707 3944 1 8 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.738 -3.671 19707 3945 1 8 . 1 1 79 79 GLU H H 79 10.375 10.375 9.085 1.290 19707 3946 1 8 . 1 1 80 80 GLU N N 80 113.846 113.846 116.950 -3.104 19707 3947 1 8 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.327 0.031 19707 3948 1 8 . 1 1 80 80 GLU C C 80 173.293 173.293 177.105 -3.812 19707 3949 1 8 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.912 -4.136 19707 3950 1 8 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.595 -4.864 19707 3951 1 8 . 1 1 80 80 GLU H H 80 7.679 7.679 8.198 -0.519 19707 3952 1 8 . 1 1 81 81 GLY N N 81 105.493 105.493 108.545 -3.052 19707 3953 1 8 . 1 1 81 81 GLY C C 81 170.427 170.427 174.153 -3.726 19707 3954 1 8 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.197 -2.585 19707 3955 1 8 . 1 1 81 81 GLY H H 81 7.476 7.476 7.885 -0.409 19707 3956 1 8 . 1 1 82 82 GLU N N 82 122.160 122.160 118.432 3.728 19707 3957 1 8 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.440 0.514 19707 3958 1 8 . 1 1 82 82 GLU C C 82 171.004 171.004 175.266 -4.262 19707 3959 1 8 . 1 1 82 82 GLU CA C 82 51.321 51.321 54.611 -3.290 19707 3960 1 8 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.331 -5.265 19707 3961 1 8 . 1 1 82 82 GLU H H 82 9.585 9.585 7.887 1.698 19707 3962 1 8 . 1 1 83 83 THR N N 83 114.756 114.756 115.055 -0.299 19707 3963 1 8 . 1 1 83 83 THR HA H 83 4.990 4.990 5.164 -0.174 19707 3964 1 8 . 1 1 83 83 THR C C 83 170.909 170.909 173.233 -2.324 19707 3965 1 8 . 1 1 83 83 THR CA C 83 57.957 57.957 62.331 -4.375 19707 3966 1 8 . 1 1 83 83 THR CB C 83 68.271 68.271 71.276 -3.005 19707 3967 1 8 . 1 1 83 83 THR H H 83 8.490 8.490 7.844 0.646 19707 3968 1 8 . 1 1 84 84 VAL N N 84 122.639 122.639 127.396 -4.757 19707 3969 1 8 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.752 -0.097 19707 3970 1 8 . 1 1 84 84 VAL C C 84 170.962 170.962 174.024 -3.062 19707 3971 1 8 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.791 -3.494 19707 3972 1 8 . 1 1 84 84 VAL CB C 84 32.224 32.224 33.611 -1.387 19707 3973 1 8 . 1 1 84 84 VAL H H 84 9.001 9.001 8.980 0.021 19707 3974 1 8 . 1 1 85 85 LEU N N 85 129.903 129.903 127.488 2.415 19707 3975 1 8 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.524 -0.133 19707 3976 1 8 . 1 1 85 85 LEU C C 85 172.346 172.346 174.311 -1.965 19707 3977 1 8 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.422 -2.625 19707 3978 1 8 . 1 1 85 85 LEU CB C 85 42.515 42.515 47.121 -4.606 19707 3979 1 8 . 1 1 85 85 LEU H H 85 8.610 8.610 8.980 -0.370 19707 3980 1 8 . 1 1 86 86 VAL N N 86 122.778 122.778 123.341 -0.563 19707 3981 1 8 . 1 1 86 86 VAL HA H 86 5.041 5.041 5.056 -0.015 19707 3982 1 8 . 1 1 86 86 VAL C C 86 172.570 172.570 173.756 -1.186 19707 3983 1 8 . 1 1 86 86 VAL CA C 86 57.200 57.200 59.667 -2.467 19707 3984 1 8 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.845 -3.570 19707 3985 1 8 . 1 1 86 86 VAL H H 86 9.228 9.228 9.156 0.072 19707 3986 1 8 . 1 1 87 87 GLU N N 87 120.437 120.437 127.405 -6.968 19707 3987 1 8 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.509 0.222 19707 3988 1 8 . 1 1 87 87 GLU C C 87 172.267 172.267 175.001 -2.734 19707 3989 1 8 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.722 -3.373 19707 3990 1 8 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.869 -2.745 19707 3991 1 8 . 1 1 87 87 GLU H H 87 8.851 8.851 9.117 -0.266 19707 3992 1 8 . 1 1 88 88 GLU N N 88 118.525 118.525 121.839 -3.314 19707 3993 1 8 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.810 0.191 19707 3994 1 8 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.862 -2.945 19707 3995 1 8 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.084 -2.137 19707 3996 1 8 . 1 1 88 88 GLU H H 88 8.380 8.380 8.570 -0.190 19707 3997 1 8 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.436 0.093 19707 3998 1 8 . 1 1 89 89 PRO C C 89 172.774 172.774 176.668 -3.894 19707 3999 1 8 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.315 -2.934 19707 4000 1 8 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.114 -2.780 19707 4001 1 9 . 1 1 2 2 SER N N 2 115.963 115.963 117.207 -1.244 19707 4002 1 9 . 1 1 2 2 SER HA H 2 4.408 4.408 4.495 -0.087 19707 4003 1 9 . 1 1 2 2 SER C C 2 171.788 171.788 174.840 -3.052 19707 4004 1 9 . 1 1 2 2 SER CA C 2 55.870 55.870 58.249 -2.379 19707 4005 1 9 . 1 1 2 2 SER CB C 2 61.022 61.022 64.043 -3.021 19707 4006 1 9 . 1 1 2 2 SER H H 2 8.661 8.661 8.214 0.447 19707 4007 1 9 . 1 1 3 3 GLU N N 3 122.941 122.941 123.735 -0.794 19707 4008 1 9 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.300 0.020 19707 4009 1 9 . 1 1 3 3 GLU C C 3 173.817 173.817 176.392 -2.575 19707 4010 1 9 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.002 -2.048 19707 4011 1 9 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.182 -3.345 19707 4012 1 9 . 1 1 3 3 GLU H H 3 8.706 8.706 8.391 0.315 19707 4013 1 9 . 1 1 4 4 THR N N 4 116.182 116.182 117.339 -1.157 19707 4014 1 9 . 1 1 4 4 THR HA H 4 4.233 4.233 4.296 -0.063 19707 4015 1 9 . 1 1 4 4 THR C C 4 171.719 171.719 175.400 -3.681 19707 4016 1 9 . 1 1 4 4 THR CA C 4 59.414 59.414 62.582 -3.168 19707 4017 1 9 . 1 1 4 4 THR CB C 4 67.009 67.009 69.205 -2.196 19707 4018 1 9 . 1 1 4 4 THR H H 4 8.165 8.165 8.331 -0.166 19707 4019 1 9 . 1 1 5 5 ARG N N 5 124.184 124.184 127.611 -3.427 19707 4020 1 9 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.232 0.128 19707 4021 1 9 . 1 1 5 5 ARG C C 5 173.520 173.520 175.500 -1.980 19707 4022 1 9 . 1 1 5 5 ARG CA C 5 53.343 53.343 57.459 -4.116 19707 4023 1 9 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.230 -2.065 19707 4024 1 9 . 1 1 5 5 ARG H H 5 8.354 8.354 8.585 -0.231 19707 4025 1 9 . 1 1 6 6 THR N N 6 116.652 116.652 118.335 -1.683 19707 4026 1 9 . 1 1 6 6 THR HA H 6 4.263 4.263 4.540 -0.277 19707 4027 1 9 . 1 1 6 6 THR C C 6 171.784 171.784 173.687 -1.903 19707 4028 1 9 . 1 1 6 6 THR CA C 6 59.218 59.218 61.824 -2.606 19707 4029 1 9 . 1 1 6 6 THR CB C 6 67.213 67.213 70.783 -3.570 19707 4030 1 9 . 1 1 6 6 THR H H 6 8.224 8.224 8.347 -0.123 19707 4031 1 9 . 1 1 7 7 ILE N N 7 123.882 123.882 124.242 -0.360 19707 4032 1 9 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.298 -0.160 19707 4033 1 9 . 1 1 7 7 ILE C C 7 173.572 173.572 175.829 -2.257 19707 4034 1 9 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.566 -2.084 19707 4035 1 9 . 1 1 7 7 ILE CB C 7 36.069 36.069 39.252 -3.183 19707 4036 1 9 . 1 1 7 7 ILE H H 7 8.247 8.247 8.259 -0.012 19707 4037 1 9 . 1 1 8 8 SER N N 8 120.287 120.287 122.528 -2.241 19707 4038 1 9 . 1 1 8 8 SER HA H 8 4.445 4.445 4.408 0.037 19707 4039 1 9 . 1 1 8 8 SER C C 8 171.926 171.926 175.139 -3.213 19707 4040 1 9 . 1 1 8 8 SER CA C 8 55.522 55.522 58.422 -2.901 19707 4041 1 9 . 1 1 8 8 SER CB C 8 61.073 61.073 63.830 -2.757 19707 4042 1 9 . 1 1 8 8 SER H H 8 8.402 8.402 8.581 -0.179 19707 4043 1 9 . 1 1 9 9 SER N N 9 118.425 118.425 122.181 -3.756 19707 4044 1 9 . 1 1 9 9 SER HA H 9 4.525 4.525 4.385 0.140 19707 4045 1 9 . 1 1 9 9 SER C C 9 172.663 172.663 173.814 -1.151 19707 4046 1 9 . 1 1 9 9 SER CA C 9 55.897 55.897 59.185 -3.288 19707 4047 1 9 . 1 1 9 9 SER CB C 9 61.375 61.375 62.091 -0.716 19707 4048 1 9 . 1 1 9 9 SER H H 9 8.362 8.362 8.867 -0.505 19707 4049 1 9 . 1 1 10 10 THR N N 10 115.676 115.676 113.604 2.072 19707 4050 1 9 . 1 1 10 10 THR HA H 10 4.232 4.232 4.425 -0.193 19707 4051 1 9 . 1 1 10 10 THR C C 10 173.070 173.070 175.610 -2.540 19707 4052 1 9 . 1 1 10 10 THR CA C 10 60.318 60.318 63.373 -3.055 19707 4053 1 9 . 1 1 10 10 THR CB C 10 67.205 67.205 69.283 -2.078 19707 4054 1 9 . 1 1 10 10 THR H H 10 8.274 8.274 8.250 0.024 19707 4055 1 9 . 1 1 11 11 ALA N N 11 124.726 124.726 125.703 -0.977 19707 4056 1 9 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.309 -0.322 19707 4057 1 9 . 1 1 11 11 ALA C C 11 176.825 176.825 179.292 -2.467 19707 4058 1 9 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.914 -2.373 19707 4059 1 9 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.086 -2.197 19707 4060 1 9 . 1 1 11 11 ALA H H 11 8.347 8.347 8.165 0.182 19707 4061 1 9 . 1 1 12 12 GLN N N 12 117.915 117.915 117.210 0.705 19707 4062 1 9 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.184 -0.395 19707 4063 1 9 . 1 1 12 12 GLN C C 12 174.697 174.697 177.251 -2.554 19707 4064 1 9 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.468 -2.464 19707 4065 1 9 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.733 -2.508 19707 4066 1 9 . 1 1 12 12 GLN H H 12 8.194 8.194 8.132 0.062 19707 4067 1 9 . 1 1 13 13 GLU N N 13 118.510 118.510 119.246 -0.736 19707 4068 1 9 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.156 -0.053 19707 4069 1 9 . 1 1 13 13 GLU C C 13 176.192 176.192 179.044 -2.852 19707 4070 1 9 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.712 -2.397 19707 4071 1 9 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.767 -3.734 19707 4072 1 9 . 1 1 13 13 GLU H H 13 7.917 7.917 8.173 -0.256 19707 4073 1 9 . 1 1 14 14 ARG N N 14 118.193 118.193 119.261 -1.068 19707 4074 1 9 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.051 -0.083 19707 4075 1 9 . 1 1 14 14 ARG C C 14 176.764 176.764 178.375 -1.611 19707 4076 1 9 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.025 -1.742 19707 4077 1 9 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.798 -2.561 19707 4078 1 9 . 1 1 14 14 ARG H H 14 7.907 7.907 7.737 0.171 19707 4079 1 9 . 1 1 15 15 VAL N N 15 117.991 117.991 115.847 2.144 19707 4080 1 9 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.972 -0.069 19707 4081 1 9 . 1 1 15 15 VAL C C 15 174.922 174.922 177.438 -2.516 19707 4082 1 9 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.806 -1.975 19707 4083 1 9 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.303 -2.580 19707 4084 1 9 . 1 1 15 15 VAL H H 15 7.658 7.658 7.578 0.080 19707 4085 1 9 . 1 1 16 16 ASP N N 16 124.314 124.314 120.839 3.475 19707 4086 1 9 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.396 -0.080 19707 4087 1 9 . 1 1 16 16 ASP C C 16 176.462 176.462 177.763 -1.301 19707 4088 1 9 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.515 -2.189 19707 4089 1 9 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.109 -4.440 19707 4090 1 9 . 1 1 16 16 ASP H H 16 8.291 8.291 8.169 0.122 19707 4091 1 9 . 1 1 17 17 LEU N N 17 120.212 120.212 119.455 0.757 19707 4092 1 9 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.060 -0.006 19707 4093 1 9 . 1 1 17 17 LEU C C 17 177.171 177.171 178.754 -1.583 19707 4094 1 9 . 1 1 17 17 LEU CA C 17 54.980 54.980 58.145 -3.165 19707 4095 1 9 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.920 -3.075 19707 4096 1 9 . 1 1 17 17 LEU H H 17 8.172 8.172 7.543 0.629 19707 4097 1 9 . 1 1 18 18 GLU N N 18 120.587 120.587 119.134 1.453 19707 4098 1 9 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.938 0.255 19707 4099 1 9 . 1 1 18 18 GLU C C 18 175.997 175.997 178.415 -2.418 19707 4100 1 9 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.436 -3.334 19707 4101 1 9 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.831 -2.759 19707 4102 1 9 . 1 1 18 18 GLU H H 18 7.876 7.876 7.750 0.126 19707 4103 1 9 . 1 1 19 19 ALA N N 19 121.800 121.800 122.401 -0.601 19707 4104 1 9 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.146 -0.355 19707 4105 1 9 . 1 1 19 19 ALA C C 19 175.708 175.708 179.822 -4.114 19707 4106 1 9 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.871 -2.019 19707 4107 1 9 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.360 -4.207 19707 4108 1 9 . 1 1 19 19 ALA H H 19 7.792 7.792 7.489 0.303 19707 4109 1 9 . 1 1 20 20 VAL N N 20 118.680 118.680 119.879 -1.199 19707 4110 1 9 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.688 -0.388 19707 4111 1 9 . 1 1 20 20 VAL C C 20 176.276 176.276 177.958 -1.682 19707 4112 1 9 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.554 -2.747 19707 4113 1 9 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.186 -1.635 19707 4114 1 9 . 1 1 20 20 VAL H H 20 7.712 7.712 7.620 0.092 19707 4115 1 9 . 1 1 21 21 ARG N N 21 121.935 121.935 120.784 1.151 19707 4116 1 9 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.046 -0.051 19707 4117 1 9 . 1 1 21 21 ARG C C 21 176.828 176.828 178.667 -1.839 19707 4118 1 9 . 1 1 21 21 ARG CA C 21 56.660 56.660 59.422 -2.762 19707 4119 1 9 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.954 -2.664 19707 4120 1 9 . 1 1 21 21 ARG H H 21 8.444 8.444 8.354 0.090 19707 4121 1 9 . 1 1 22 22 LEU N N 22 119.327 119.327 119.477 -0.150 19707 4122 1 9 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.119 -0.124 19707 4123 1 9 . 1 1 22 22 LEU C C 22 175.664 175.664 178.552 -2.888 19707 4124 1 9 . 1 1 22 22 LEU CA C 22 54.868 54.868 57.861 -2.994 19707 4125 1 9 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.541 -2.406 19707 4126 1 9 . 1 1 22 22 LEU H H 22 8.248 8.248 8.047 0.201 19707 4127 1 9 . 1 1 23 23 ALA N N 23 121.202 121.202 122.294 -1.092 19707 4128 1 9 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.946 -0.211 19707 4129 1 9 . 1 1 23 23 ALA C C 23 175.492 175.492 179.623 -4.131 19707 4130 1 9 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.368 -2.299 19707 4131 1 9 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.000 -3.933 19707 4132 1 9 . 1 1 23 23 ALA H H 23 8.392 8.392 8.474 -0.082 19707 4133 1 9 . 1 1 24 24 SER N N 24 112.377 112.377 115.219 -2.842 19707 4134 1 9 . 1 1 24 24 SER HA H 24 4.214 4.214 4.269 -0.055 19707 4135 1 9 . 1 1 24 24 SER C C 24 174.773 174.773 176.654 -1.881 19707 4136 1 9 . 1 1 24 24 SER CA C 24 59.258 59.258 62.513 -3.255 19707 4137 1 9 . 1 1 24 24 SER CB C 24 60.149 60.149 63.036 -2.887 19707 4138 1 9 . 1 1 24 24 SER H H 24 7.690 7.690 8.134 -0.444 19707 4139 1 9 . 1 1 25 25 ILE N N 25 123.886 123.886 122.035 1.851 19707 4140 1 9 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.952 -0.110 19707 4141 1 9 . 1 1 25 25 ILE C C 25 176.487 176.487 177.966 -1.479 19707 4142 1 9 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.852 -0.859 19707 4143 1 9 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.677 -0.745 19707 4144 1 9 . 1 1 25 25 ILE H H 25 7.837 7.837 8.166 -0.329 19707 4145 1 9 . 1 1 26 26 VAL N N 26 122.538 122.538 121.454 1.084 19707 4146 1 9 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.602 -0.214 19707 4147 1 9 . 1 1 26 26 VAL C C 26 174.624 174.624 177.476 -2.852 19707 4148 1 9 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.588 -2.673 19707 4149 1 9 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.540 -3.645 19707 4150 1 9 . 1 1 26 26 VAL H H 26 8.804 8.804 8.685 0.119 19707 4151 1 9 . 1 1 27 27 ASP N N 27 120.433 120.433 120.264 0.169 19707 4152 1 9 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.253 -0.089 19707 4153 1 9 . 1 1 27 27 ASP C C 27 174.966 174.966 178.339 -3.373 19707 4154 1 9 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.523 -2.194 19707 4155 1 9 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.668 -2.814 19707 4156 1 9 . 1 1 27 27 ASP H H 27 8.719 8.719 8.348 0.371 19707 4157 1 9 . 1 1 28 28 SER N N 28 112.397 112.397 115.195 -2.798 19707 4158 1 9 . 1 1 28 28 SER HA H 28 4.073 4.073 4.119 -0.046 19707 4159 1 9 . 1 1 28 28 SER C C 28 174.405 174.405 176.836 -2.431 19707 4160 1 9 . 1 1 28 28 SER CA C 28 59.115 59.115 61.248 -2.133 19707 4161 1 9 . 1 1 28 28 SER CB C 28 60.125 60.125 63.219 -3.094 19707 4162 1 9 . 1 1 28 28 SER H H 28 7.599 7.599 8.022 -0.423 19707 4163 1 9 . 1 1 29 29 ARG N N 29 123.945 123.945 122.227 1.718 19707 4164 1 9 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.893 0.134 19707 4165 1 9 . 1 1 29 29 ARG C C 29 175.902 175.902 178.408 -2.506 19707 4166 1 9 . 1 1 29 29 ARG CA C 29 54.274 54.274 58.065 -3.791 19707 4167 1 9 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.096 -1.357 19707 4168 1 9 . 1 1 29 29 ARG H H 29 7.769 7.769 7.760 0.009 19707 4169 1 9 . 1 1 30 30 LEU N N 30 121.580 121.580 120.068 1.512 19707 4170 1 9 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.999 -0.250 19707 4171 1 9 . 1 1 30 30 LEU C C 30 177.474 177.474 179.677 -2.203 19707 4172 1 9 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.736 -2.423 19707 4173 1 9 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.791 -2.762 19707 4174 1 9 . 1 1 30 30 LEU H H 30 8.665 8.665 8.300 0.365 19707 4175 1 9 . 1 1 31 31 ILE N N 31 119.330 119.330 117.942 1.388 19707 4176 1 9 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.732 -0.041 19707 4177 1 9 . 1 1 31 31 ILE C C 31 175.341 175.341 177.833 -2.492 19707 4178 1 9 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.034 -2.522 19707 4179 1 9 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.920 -2.353 19707 4180 1 9 . 1 1 31 31 ILE H H 31 8.226 8.226 8.305 -0.079 19707 4181 1 9 . 1 1 32 32 GLY N N 32 106.092 106.092 105.880 0.212 19707 4182 1 9 . 1 1 32 32 GLY C C 32 172.413 172.413 174.885 -2.472 19707 4183 1 9 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.628 -3.131 19707 4184 1 9 . 1 1 32 32 GLY H H 32 7.767 7.767 7.954 -0.187 19707 4185 1 9 . 1 1 33 33 THR N N 33 110.966 110.966 112.598 -1.632 19707 4186 1 9 . 1 1 33 33 THR HA H 33 4.455 4.455 4.352 0.103 19707 4187 1 9 . 1 1 33 33 THR C C 33 172.714 172.714 174.758 -2.044 19707 4188 1 9 . 1 1 33 33 THR CA C 33 60.032 60.032 62.395 -2.363 19707 4189 1 9 . 1 1 33 33 THR CB C 33 68.287 68.287 69.791 -1.504 19707 4190 1 9 . 1 1 33 33 THR H H 33 8.102 8.102 7.878 0.224 19707 4191 1 9 . 1 1 34 34 GLY N N 34 110.320 110.320 111.290 -0.970 19707 4192 1 9 . 1 1 34 34 GLY C C 34 170.505 170.505 173.364 -2.859 19707 4193 1 9 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.008 -2.425 19707 4194 1 9 . 1 1 34 34 GLY H H 34 8.072 8.072 8.203 -0.131 19707 4195 1 9 . 1 1 35 35 SER N N 35 112.944 112.944 113.762 -0.818 19707 4196 1 9 . 1 1 35 35 SER HA H 35 4.385 4.385 4.843 -0.459 19707 4197 1 9 . 1 1 35 35 SER C C 35 169.537 169.537 172.875 -3.338 19707 4198 1 9 . 1 1 35 35 SER CA C 35 54.794 54.794 57.251 -2.457 19707 4199 1 9 . 1 1 35 35 SER CB C 35 62.029 62.029 65.889 -3.860 19707 4200 1 9 . 1 1 35 35 SER H H 35 7.719 7.719 7.541 0.178 19707 4201 1 9 . 1 1 36 36 VAL N N 36 118.566 118.566 122.976 -4.410 19707 4202 1 9 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.106 -0.073 19707 4203 1 9 . 1 1 36 36 VAL C C 36 169.876 169.876 174.843 -4.967 19707 4204 1 9 . 1 1 36 36 VAL CA C 36 58.565 58.565 62.184 -3.619 19707 4205 1 9 . 1 1 36 36 VAL CB C 36 30.952 30.952 32.816 -1.864 19707 4206 1 9 . 1 1 36 36 VAL H H 36 8.490 8.490 8.303 0.187 19707 4207 1 9 . 1 1 37 37 ASP N N 37 121.640 121.640 125.006 -3.366 19707 4208 1 9 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.903 -0.101 19707 4209 1 9 . 1 1 37 37 ASP C C 37 172.806 172.806 176.496 -3.690 19707 4210 1 9 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.846 -3.803 19707 4211 1 9 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.925 -3.719 19707 4212 1 9 . 1 1 37 37 ASP H H 37 7.195 7.195 8.449 -1.254 19707 4213 1 9 . 1 1 38 38 GLU N N 38 120.018 120.018 121.678 -1.660 19707 4214 1 9 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.966 -0.309 19707 4215 1 9 . 1 1 38 38 GLU C C 38 174.753 174.753 177.277 -2.524 19707 4216 1 9 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.360 -2.868 19707 4217 1 9 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.779 -3.700 19707 4218 1 9 . 1 1 38 38 GLU H H 38 8.908 8.908 9.000 -0.092 19707 4219 1 9 . 1 1 39 39 ASP N N 39 118.668 118.668 116.910 1.758 19707 4220 1 9 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.438 -0.192 19707 4221 1 9 . 1 1 39 39 ASP C C 39 175.393 175.393 177.816 -2.423 19707 4222 1 9 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.469 -1.605 19707 4223 1 9 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.246 -3.276 19707 4224 1 9 . 1 1 39 39 ASP H H 39 8.242 8.242 8.731 -0.489 19707 4225 1 9 . 1 1 40 40 PHE N N 40 119.851 119.851 119.098 0.753 19707 4226 1 9 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.496 -0.292 19707 4227 1 9 . 1 1 40 40 PHE C C 40 174.929 174.929 175.531 -0.602 19707 4228 1 9 . 1 1 40 40 PHE CA C 40 58.171 58.171 59.646 -1.475 19707 4229 1 9 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.279 -3.446 19707 4230 1 9 . 1 1 40 40 PHE H H 40 8.037 8.037 7.995 0.042 19707 4231 1 9 . 1 1 41 41 LEU N N 41 117.882 117.882 119.467 -1.585 19707 4232 1 9 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.044 -0.522 19707 4233 1 9 . 1 1 41 41 LEU C C 41 175.938 175.938 178.471 -2.533 19707 4234 1 9 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.352 -1.492 19707 4235 1 9 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.630 -3.399 19707 4236 1 9 . 1 1 41 41 LEU H H 41 7.816 7.816 7.742 0.074 19707 4237 1 9 . 1 1 42 42 ARG N N 42 118.360 118.360 119.394 -1.034 19707 4238 1 9 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.003 -0.263 19707 4239 1 9 . 1 1 42 42 ARG C C 42 175.435 175.435 177.105 -1.670 19707 4240 1 9 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.039 -2.068 19707 4241 1 9 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.923 -2.659 19707 4242 1 9 . 1 1 42 42 ARG H H 42 8.540 8.540 8.052 0.488 19707 4243 1 9 . 1 1 43 43 GLU N N 43 114.947 114.947 116.228 -1.281 19707 4244 1 9 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.345 -0.295 19707 4245 1 9 . 1 1 43 43 GLU C C 43 174.518 174.518 177.256 -2.738 19707 4246 1 9 . 1 1 43 43 GLU CA C 43 54.571 54.571 56.703 -2.132 19707 4247 1 9 . 1 1 43 43 GLU CB C 43 26.041 26.041 28.953 -2.912 19707 4248 1 9 . 1 1 43 43 GLU H H 43 7.223 7.223 8.331 -1.108 19707 4249 1 9 . 1 1 44 44 GLN N N 44 114.109 114.109 117.538 -3.429 19707 4250 1 9 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.441 -0.335 19707 4251 1 9 . 1 1 44 44 GLN C C 44 173.777 173.777 177.563 -3.786 19707 4252 1 9 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.761 -3.580 19707 4253 1 9 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.775 -3.905 19707 4254 1 9 . 1 1 44 44 GLN H H 44 7.372 7.372 8.262 -0.890 19707 4255 1 9 . 1 1 45 45 ILE N N 45 117.470 117.470 118.221 -0.751 19707 4256 1 9 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.535 0.413 19707 4257 1 9 . 1 1 45 45 ILE C C 45 172.305 172.305 176.770 -4.465 19707 4258 1 9 . 1 1 45 45 ILE CA C 45 58.505 58.505 65.737 -7.232 19707 4259 1 9 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.640 -1.940 19707 4260 1 9 . 1 1 45 45 ILE H H 45 7.235 7.235 7.710 -0.475 19707 4261 1 9 . 1 1 46 46 ARG N N 46 122.996 122.996 114.429 8.567 19707 4262 1 9 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.979 0.211 19707 4263 1 9 . 1 1 46 46 ARG C C 46 172.992 172.992 175.354 -2.362 19707 4264 1 9 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.236 -4.475 19707 4265 1 9 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.814 -0.862 19707 4266 1 9 . 1 1 46 46 ARG H H 46 8.336 8.336 8.629 -0.293 19707 4267 1 9 . 1 1 47 47 ASP N N 47 118.676 118.676 116.926 1.750 19707 4268 1 9 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.689 -0.241 19707 4269 1 9 . 1 1 47 47 ASP C C 47 172.520 172.520 174.625 -2.105 19707 4270 1 9 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.280 -2.390 19707 4271 1 9 . 1 1 47 47 ASP CB C 47 37.657 37.657 43.231 -5.574 19707 4272 1 9 . 1 1 47 47 ASP H H 47 8.313 8.313 8.150 0.163 19707 4273 1 9 . 1 1 48 48 ALA N N 48 120.922 120.922 121.877 -0.955 19707 4274 1 9 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.629 -0.260 19707 4275 1 9 . 1 1 48 48 ALA C C 48 174.295 174.295 176.227 -1.932 19707 4276 1 9 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.039 -1.402 19707 4277 1 9 . 1 1 48 48 ALA CB C 48 16.214 16.214 20.970 -4.756 19707 4278 1 9 . 1 1 48 48 ALA H H 48 7.824 7.824 7.344 0.480 19707 4279 1 9 . 1 1 49 49 ARG N N 49 118.644 118.644 119.938 -1.294 19707 4280 1 9 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.023 0.319 19707 4281 1 9 . 1 1 49 49 ARG C C 49 172.504 172.504 176.402 -3.898 19707 4282 1 9 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.471 -3.562 19707 4283 1 9 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.531 -2.188 19707 4284 1 9 . 1 1 49 49 ARG H H 49 7.911 7.911 8.783 -0.872 19707 4285 1 9 . 1 1 50 50 TYR N N 50 119.470 119.470 114.467 5.003 19707 4286 1 9 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.007 0.284 19707 4287 1 9 . 1 1 50 50 TYR C C 50 170.470 170.470 174.260 -3.790 19707 4288 1 9 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.224 -1.956 19707 4289 1 9 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.034 -0.521 19707 4290 1 9 . 1 1 50 50 TYR H H 50 7.639 7.639 7.874 -0.235 19707 4291 1 9 . 1 1 51 51 ALA N N 51 127.418 127.418 125.830 1.588 19707 4292 1 9 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.099 0.122 19707 4293 1 9 . 1 1 51 51 ALA C C 51 171.328 171.328 175.458 -4.130 19707 4294 1 9 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.283 -2.850 19707 4295 1 9 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.788 -1.476 19707 4296 1 9 . 1 1 51 51 ALA H H 51 8.222 8.222 8.793 -0.571 19707 4297 1 9 . 1 1 52 52 VAL N N 52 117.832 117.832 120.173 -2.341 19707 4298 1 9 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.214 -0.547 19707 4299 1 9 . 1 1 52 52 VAL C C 52 172.436 172.436 174.233 -1.797 19707 4300 1 9 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.825 -3.068 19707 4301 1 9 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.345 -4.242 19707 4302 1 9 . 1 1 52 52 VAL H H 52 8.753 8.753 9.082 -0.329 19707 4303 1 9 . 1 1 53 53 ILE N N 53 128.027 128.027 126.006 2.021 19707 4304 1 9 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.546 0.296 19707 4305 1 9 . 1 1 53 53 ILE C C 53 172.110 172.110 174.252 -2.142 19707 4306 1 9 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.221 -2.468 19707 4307 1 9 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.010 -3.851 19707 4308 1 9 . 1 1 53 53 ILE H H 53 9.261 9.261 9.035 0.226 19707 4309 1 9 . 1 1 54 54 ARG N N 54 127.885 127.885 127.494 0.391 19707 4310 1 9 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.700 0.053 19707 4311 1 9 . 1 1 54 54 ARG C C 54 172.285 172.285 174.323 -2.038 19707 4312 1 9 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.740 -1.480 19707 4313 1 9 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.656 -2.764 19707 4314 1 9 . 1 1 54 54 ARG H H 54 8.686 8.686 8.751 -0.065 19707 4315 1 9 . 1 1 55 55 ILE N N 55 129.907 129.907 124.098 5.809 19707 4316 1 9 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.388 -0.235 19707 4317 1 9 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.935 -2.340 19707 4318 1 9 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.180 -1.567 19707 4319 1 9 . 1 1 55 55 ILE H H 55 9.292 9.292 8.340 0.952 19707 4320 1 9 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.315 -0.123 19707 4321 1 9 . 1 1 56 56 PRO C C 56 174.787 174.787 177.723 -2.936 19707 4322 1 9 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.194 -2.460 19707 4323 1 9 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.820 -2.907 19707 4324 1 9 . 1 1 57 57 GLY N N 57 111.828 111.828 111.663 0.165 19707 4325 1 9 . 1 1 57 57 GLY C C 57 171.039 171.039 173.571 -2.532 19707 4326 1 9 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.923 -2.106 19707 4327 1 9 . 1 1 57 57 GLY H H 57 8.708 8.708 8.876 -0.168 19707 4328 1 9 . 1 1 58 58 GLN N N 58 118.457 118.457 119.872 -1.415 19707 4329 1 9 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.792 0.108 19707 4330 1 9 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.114 -2.842 19707 4331 1 9 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.814 -2.660 19707 4332 1 9 . 1 1 58 58 GLN H H 58 7.909 7.909 7.607 0.302 19707 4333 1 9 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.475 -0.039 19707 4334 1 9 . 1 1 59 59 PRO C C 59 174.607 174.607 176.514 -1.907 19707 4335 1 9 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.982 -2.927 19707 4336 1 9 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.102 -2.925 19707 4337 1 9 . 1 1 60 60 VAL N N 60 122.695 122.695 121.398 1.297 19707 4338 1 9 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.065 -0.110 19707 4339 1 9 . 1 1 60 60 VAL C C 60 172.403 172.403 175.541 -3.138 19707 4340 1 9 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.449 -1.554 19707 4341 1 9 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.571 -2.929 19707 4342 1 9 . 1 1 60 60 VAL H H 60 8.364 8.364 8.225 0.139 19707 4343 1 9 . 1 1 61 61 VAL N N 61 126.097 126.097 128.894 -2.797 19707 4344 1 9 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.388 -0.088 19707 4345 1 9 . 1 1 61 61 VAL C C 61 170.891 170.891 174.370 -3.479 19707 4346 1 9 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.391 -2.577 19707 4347 1 9 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.423 -3.225 19707 4348 1 9 . 1 1 61 61 VAL H H 61 8.023 8.023 8.071 -0.048 19707 4349 1 9 . 1 1 62 62 GLU N N 62 126.097 126.097 125.572 0.525 19707 4350 1 9 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.001 0.158 19707 4351 1 9 . 1 1 62 62 GLU C C 62 172.252 172.252 175.211 -2.959 19707 4352 1 9 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.054 -3.514 19707 4353 1 9 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.574 -2.274 19707 4354 1 9 . 1 1 62 62 GLU H H 62 8.591 8.591 8.491 0.100 19707 4355 1 9 . 1 1 63 63 VAL N N 63 120.374 120.374 123.486 -3.112 19707 4356 1 9 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.261 0.132 19707 4357 1 9 . 1 1 63 63 VAL C C 63 171.040 171.040 176.739 -5.699 19707 4358 1 9 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.650 -3.817 19707 4359 1 9 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.427 0.150 19707 4360 1 9 . 1 1 63 63 VAL H H 63 8.732 8.732 8.846 -0.114 19707 4361 1 9 . 1 1 64 64 GLY N N 64 109.935 109.935 114.889 -4.954 19707 4362 1 9 . 1 1 64 64 GLY C C 64 171.656 171.656 173.912 -2.256 19707 4363 1 9 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.101 -4.924 19707 4364 1 9 . 1 1 64 64 GLY H H 64 8.259 8.259 8.605 -0.346 19707 4365 1 9 . 1 1 65 65 THR N N 65 115.478 115.478 116.459 -0.981 19707 4366 1 9 . 1 1 65 65 THR HA H 65 4.342 4.342 4.372 -0.030 19707 4367 1 9 . 1 1 65 65 THR C C 65 170.663 170.663 172.226 -1.563 19707 4368 1 9 . 1 1 65 65 THR CA C 65 58.357 58.357 60.429 -2.072 19707 4369 1 9 . 1 1 65 65 THR CB C 65 67.923 67.923 71.997 -4.074 19707 4370 1 9 . 1 1 65 65 THR H H 65 8.123 8.123 7.580 0.543 19707 4371 1 9 . 1 1 66 66 LYS N N 66 130.775 130.775 124.636 6.139 19707 4372 1 9 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.088 -1.158 19707 4373 1 9 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.282 -2.092 19707 4374 1 9 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.775 -3.085 19707 4375 1 9 . 1 1 66 66 LYS H H 66 8.472 8.472 8.296 0.176 19707 4376 1 9 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.627 -0.216 19707 4377 1 9 . 1 1 67 67 PRO C C 67 173.211 173.211 176.804 -3.593 19707 4378 1 9 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.297 -2.731 19707 4379 1 9 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.646 -3.243 19707 4380 1 9 . 1 1 68 68 THR N N 68 111.983 111.983 114.477 -2.494 19707 4381 1 9 . 1 1 68 68 THR HA H 68 4.277 4.277 4.277 -0.000 19707 4382 1 9 . 1 1 68 68 THR C C 68 171.720 171.720 175.519 -3.799 19707 4383 1 9 . 1 1 68 68 THR CA C 68 58.193 58.193 62.726 -4.533 19707 4384 1 9 . 1 1 68 68 THR CB C 68 67.723 67.723 69.417 -1.694 19707 4385 1 9 . 1 1 68 68 THR H H 68 8.091 8.091 8.347 -0.256 19707 4386 1 9 . 1 1 69 69 GLY N N 69 109.918 109.918 108.884 1.034 19707 4387 1 9 . 1 1 69 69 GLY C C 69 170.783 170.783 174.378 -3.595 19707 4388 1 9 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.704 -2.648 19707 4389 1 9 . 1 1 69 69 GLY H H 69 8.119 8.119 7.996 0.123 19707 4390 1 9 . 1 1 70 70 ASP N N 70 123.294 123.294 124.754 -1.460 19707 4391 1 9 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.872 -0.323 19707 4392 1 9 . 1 1 70 70 ASP C C 70 173.651 173.651 175.066 -1.415 19707 4393 1 9 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.756 -2.895 19707 4394 1 9 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.659 -1.926 19707 4395 1 9 . 1 1 70 70 ASP H H 70 8.444 8.444 8.695 -0.251 19707 4396 1 9 . 1 1 71 71 VAL N N 71 117.772 117.772 114.302 3.470 19707 4397 1 9 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.124 -0.417 19707 4398 1 9 . 1 1 71 71 VAL C C 71 172.992 172.992 174.239 -1.247 19707 4399 1 9 . 1 1 71 71 VAL CA C 71 57.376 57.376 58.993 -1.617 19707 4400 1 9 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.400 -2.378 19707 4401 1 9 . 1 1 71 71 VAL H H 71 8.173 8.173 7.768 0.405 19707 4402 1 9 . 1 1 72 72 LEU N N 72 123.435 123.435 122.644 0.791 19707 4403 1 9 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.582 0.054 19707 4404 1 9 . 1 1 72 72 LEU C C 72 173.189 173.189 176.131 -2.942 19707 4405 1 9 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.200 -2.993 19707 4406 1 9 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.191 -1.553 19707 4407 1 9 . 1 1 72 72 LEU H H 72 8.859 8.859 8.935 -0.076 19707 4408 1 9 . 1 1 73 73 GLN N N 73 119.520 119.520 122.024 -2.504 19707 4409 1 9 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.182 0.163 19707 4410 1 9 . 1 1 73 73 GLN C C 73 172.249 172.249 175.729 -3.480 19707 4411 1 9 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.512 -3.179 19707 4412 1 9 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.198 -1.428 19707 4413 1 9 . 1 1 73 73 GLN H H 73 9.196 9.196 8.307 0.889 19707 4414 1 9 . 1 1 74 74 GLY N N 74 113.513 113.513 111.805 1.708 19707 4415 1 9 . 1 1 74 74 GLY C C 74 169.072 169.072 171.948 -2.876 19707 4416 1 9 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.767 -2.470 19707 4417 1 9 . 1 1 74 74 GLY H H 74 9.373 9.373 9.116 0.257 19707 4418 1 9 . 1 1 75 75 ARG N N 75 122.479 122.479 123.210 -0.731 19707 4419 1 9 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.363 0.139 19707 4420 1 9 . 1 1 75 75 ARG C C 75 172.348 172.348 174.049 -1.701 19707 4421 1 9 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.770 -4.013 19707 4422 1 9 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.278 -2.460 19707 4423 1 9 . 1 1 75 75 ARG H H 75 8.615 8.615 8.399 0.216 19707 4424 1 9 . 1 1 76 76 ALA N N 76 122.346 122.346 127.357 -5.011 19707 4425 1 9 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.782 -0.246 19707 4426 1 9 . 1 1 76 76 ALA C C 76 172.704 172.704 174.773 -2.069 19707 4427 1 9 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.429 -2.402 19707 4428 1 9 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.869 -2.845 19707 4429 1 9 . 1 1 76 76 ALA H H 76 8.590 8.590 9.002 -0.412 19707 4430 1 9 . 1 1 77 77 THR N N 77 116.961 116.961 116.232 0.729 19707 4431 1 9 . 1 1 77 77 THR HA H 77 4.988 4.988 5.126 -0.138 19707 4432 1 9 . 1 1 77 77 THR C C 77 172.800 172.800 174.922 -2.122 19707 4433 1 9 . 1 1 77 77 THR CA C 77 58.344 58.344 61.455 -3.111 19707 4434 1 9 . 1 1 77 77 THR CB C 77 67.712 67.712 70.558 -2.846 19707 4435 1 9 . 1 1 77 77 THR H H 77 8.491 8.491 8.280 0.211 19707 4436 1 9 . 1 1 78 78 GLY N N 78 111.103 111.103 112.666 -1.563 19707 4437 1 9 . 1 1 78 78 GLY C C 78 172.567 172.567 174.395 -1.828 19707 4438 1 9 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.686 -2.377 19707 4439 1 9 . 1 1 78 78 GLY H H 78 8.649 8.649 8.693 -0.044 19707 4440 1 9 . 1 1 79 79 GLU N N 79 123.423 123.423 119.531 3.892 19707 4441 1 9 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.308 -0.312 19707 4442 1 9 . 1 1 79 79 GLU C C 79 175.466 175.466 177.266 -1.800 19707 4443 1 9 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.091 -2.632 19707 4444 1 9 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.781 -3.714 19707 4445 1 9 . 1 1 79 79 GLU H H 79 10.375 10.375 8.853 1.522 19707 4446 1 9 . 1 1 80 80 GLU N N 80 113.846 113.846 117.451 -3.605 19707 4447 1 9 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.391 -0.033 19707 4448 1 9 . 1 1 80 80 GLU C C 80 173.293 173.293 176.773 -3.480 19707 4449 1 9 . 1 1 80 80 GLU CA C 80 51.776 51.776 56.056 -4.280 19707 4450 1 9 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.733 -5.002 19707 4451 1 9 . 1 1 80 80 GLU H H 80 7.679 7.679 8.498 -0.819 19707 4452 1 9 . 1 1 81 81 GLY N N 81 105.493 105.493 108.959 -3.466 19707 4453 1 9 . 1 1 81 81 GLY C C 81 170.427 170.427 174.176 -3.749 19707 4454 1 9 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.080 -2.468 19707 4455 1 9 . 1 1 81 81 GLY H H 81 7.476 7.476 7.570 -0.094 19707 4456 1 9 . 1 1 82 82 GLU N N 82 122.160 122.160 118.851 3.309 19707 4457 1 9 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.396 0.558 19707 4458 1 9 . 1 1 82 82 GLU C C 82 171.004 171.004 175.625 -4.621 19707 4459 1 9 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.809 -4.488 19707 4460 1 9 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.700 -4.634 19707 4461 1 9 . 1 1 82 82 GLU H H 82 9.585 9.585 8.008 1.577 19707 4462 1 9 . 1 1 83 83 THR N N 83 114.756 114.756 115.662 -0.906 19707 4463 1 9 . 1 1 83 83 THR HA H 83 4.990 4.990 5.152 -0.162 19707 4464 1 9 . 1 1 83 83 THR C C 83 170.909 170.909 173.424 -2.515 19707 4465 1 9 . 1 1 83 83 THR CA C 83 57.957 57.957 62.081 -4.124 19707 4466 1 9 . 1 1 83 83 THR CB C 83 68.271 68.271 71.835 -3.564 19707 4467 1 9 . 1 1 83 83 THR H H 83 8.490 8.490 8.476 0.014 19707 4468 1 9 . 1 1 84 84 VAL N N 84 122.639 122.639 125.599 -2.960 19707 4469 1 9 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.797 -0.142 19707 4470 1 9 . 1 1 84 84 VAL C C 84 170.962 170.962 173.586 -2.624 19707 4471 1 9 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.822 -2.525 19707 4472 1 9 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.120 -2.896 19707 4473 1 9 . 1 1 84 84 VAL H H 84 9.001 9.001 8.992 0.009 19707 4474 1 9 . 1 1 85 85 LEU N N 85 129.903 129.903 128.076 1.827 19707 4475 1 9 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.539 -0.147 19707 4476 1 9 . 1 1 85 85 LEU C C 85 172.346 172.346 174.447 -2.101 19707 4477 1 9 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.078 -2.281 19707 4478 1 9 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.941 -4.426 19707 4479 1 9 . 1 1 85 85 LEU H H 85 8.610 8.610 8.999 -0.389 19707 4480 1 9 . 1 1 86 86 VAL N N 86 122.778 122.778 123.826 -1.048 19707 4481 1 9 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.873 0.168 19707 4482 1 9 . 1 1 86 86 VAL C C 86 172.570 172.570 174.458 -1.888 19707 4483 1 9 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.252 -4.052 19707 4484 1 9 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.477 -3.202 19707 4485 1 9 . 1 1 86 86 VAL H H 86 9.228 9.228 9.209 0.019 19707 4486 1 9 . 1 1 87 87 GLU N N 87 120.437 120.437 126.135 -5.698 19707 4487 1 9 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.551 0.180 19707 4488 1 9 . 1 1 87 87 GLU C C 87 172.267 172.267 175.017 -2.750 19707 4489 1 9 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.446 -3.097 19707 4490 1 9 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.788 -2.664 19707 4491 1 9 . 1 1 87 87 GLU H H 87 8.851 8.851 9.369 -0.518 19707 4492 1 9 . 1 1 88 88 GLU N N 88 118.525 118.525 122.381 -3.856 19707 4493 1 9 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.772 0.229 19707 4494 1 9 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.038 -3.121 19707 4495 1 9 . 1 1 88 88 GLU CB C 88 29.947 29.947 33.160 -3.213 19707 4496 1 9 . 1 1 88 88 GLU H H 88 8.380 8.380 8.683 -0.303 19707 4497 1 9 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.414 0.115 19707 4498 1 9 . 1 1 89 89 PRO C C 89 172.774 172.774 176.750 -3.976 19707 4499 1 9 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.116 -2.735 19707 4500 1 9 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.114 -2.780 19707 4501 1 10 . 1 1 2 2 SER N N 2 115.963 115.963 115.329 0.634 19707 4502 1 10 . 1 1 2 2 SER HA H 2 4.408 4.408 4.886 -0.478 19707 4503 1 10 . 1 1 2 2 SER C C 2 171.788 171.788 173.829 -2.041 19707 4504 1 10 . 1 1 2 2 SER CA C 2 55.870 55.870 58.048 -2.178 19707 4505 1 10 . 1 1 2 2 SER CB C 2 61.022 61.022 64.658 -3.636 19707 4506 1 10 . 1 1 2 2 SER H H 2 8.661 8.661 8.595 0.066 19707 4507 1 10 . 1 1 3 3 GLU N N 3 122.941 122.941 122.449 0.492 19707 4508 1 10 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.692 -0.372 19707 4509 1 10 . 1 1 3 3 GLU C C 3 173.817 173.817 175.052 -1.235 19707 4510 1 10 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.041 -2.087 19707 4511 1 10 . 1 1 3 3 GLU CB C 3 26.837 26.837 31.555 -4.718 19707 4512 1 10 . 1 1 3 3 GLU H H 3 8.706 8.706 8.614 0.092 19707 4513 1 10 . 1 1 4 4 THR N N 4 116.182 116.182 116.846 -0.664 19707 4514 1 10 . 1 1 4 4 THR HA H 4 4.233 4.233 4.464 -0.231 19707 4515 1 10 . 1 1 4 4 THR C C 4 171.719 171.719 173.759 -2.040 19707 4516 1 10 . 1 1 4 4 THR CA C 4 59.414 59.414 61.785 -2.371 19707 4517 1 10 . 1 1 4 4 THR CB C 4 67.009 67.009 70.118 -3.109 19707 4518 1 10 . 1 1 4 4 THR H H 4 8.165 8.165 8.210 -0.045 19707 4519 1 10 . 1 1 5 5 ARG N N 5 124.184 124.184 123.691 0.493 19707 4520 1 10 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.484 -0.123 19707 4521 1 10 . 1 1 5 5 ARG C C 5 173.520 173.520 176.573 -3.053 19707 4522 1 10 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.814 -2.471 19707 4523 1 10 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.880 -2.715 19707 4524 1 10 . 1 1 5 5 ARG H H 5 8.354 8.354 8.501 -0.147 19707 4525 1 10 . 1 1 6 6 THR N N 6 116.652 116.652 118.521 -1.869 19707 4526 1 10 . 1 1 6 6 THR HA H 6 4.263 4.263 4.228 0.035 19707 4527 1 10 . 1 1 6 6 THR C C 6 171.784 171.784 174.740 -2.956 19707 4528 1 10 . 1 1 6 6 THR CA C 6 59.218 59.218 62.556 -3.338 19707 4529 1 10 . 1 1 6 6 THR CB C 6 67.213 67.213 69.140 -1.927 19707 4530 1 10 . 1 1 6 6 THR H H 6 8.224 8.224 8.295 -0.071 19707 4531 1 10 . 1 1 7 7 ILE N N 7 123.882 123.882 126.811 -2.929 19707 4532 1 10 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.167 -0.029 19707 4533 1 10 . 1 1 7 7 ILE C C 7 173.572 173.572 177.341 -3.769 19707 4534 1 10 . 1 1 7 7 ILE CA C 7 58.482 58.482 61.573 -3.091 19707 4535 1 10 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.620 -2.551 19707 4536 1 10 . 1 1 7 7 ILE H H 7 8.247 8.247 8.487 -0.240 19707 4537 1 10 . 1 1 8 8 SER N N 8 120.287 120.287 123.866 -3.579 19707 4538 1 10 . 1 1 8 8 SER HA H 8 4.445 4.445 4.591 -0.146 19707 4539 1 10 . 1 1 8 8 SER C C 8 171.926 171.926 174.512 -2.586 19707 4540 1 10 . 1 1 8 8 SER CA C 8 55.522 55.522 58.066 -2.544 19707 4541 1 10 . 1 1 8 8 SER CB C 8 61.073 61.073 61.809 -0.735 19707 4542 1 10 . 1 1 8 8 SER H H 8 8.402 8.402 8.770 -0.368 19707 4543 1 10 . 1 1 9 9 SER N N 9 118.425 118.425 118.314 0.111 19707 4544 1 10 . 1 1 9 9 SER HA H 9 4.525 4.525 4.321 0.204 19707 4545 1 10 . 1 1 9 9 SER C C 9 172.663 172.663 174.498 -1.835 19707 4546 1 10 . 1 1 9 9 SER CA C 9 55.897 55.897 59.535 -3.639 19707 4547 1 10 . 1 1 9 9 SER CB C 9 61.375 61.375 62.211 -0.836 19707 4548 1 10 . 1 1 9 9 SER H H 9 8.362 8.362 8.107 0.255 19707 4549 1 10 . 1 1 10 10 THR N N 10 115.676 115.676 113.386 2.290 19707 4550 1 10 . 1 1 10 10 THR HA H 10 4.232 4.232 4.448 -0.216 19707 4551 1 10 . 1 1 10 10 THR C C 10 173.070 173.070 175.612 -2.542 19707 4552 1 10 . 1 1 10 10 THR CA C 10 60.318 60.318 63.012 -2.694 19707 4553 1 10 . 1 1 10 10 THR CB C 10 67.205 67.205 69.120 -1.915 19707 4554 1 10 . 1 1 10 10 THR H H 10 8.274 8.274 8.079 0.195 19707 4555 1 10 . 1 1 11 11 ALA N N 11 124.726 124.726 125.158 -0.432 19707 4556 1 10 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.176 -0.189 19707 4557 1 10 . 1 1 11 11 ALA C C 11 176.825 176.825 179.480 -2.655 19707 4558 1 10 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.140 -2.599 19707 4559 1 10 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.353 -2.464 19707 4560 1 10 . 1 1 11 11 ALA H H 11 8.347 8.347 8.263 0.084 19707 4561 1 10 . 1 1 12 12 GLN N N 12 117.915 117.915 117.556 0.359 19707 4562 1 10 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.129 -0.340 19707 4563 1 10 . 1 1 12 12 GLN C C 12 174.697 174.697 177.578 -2.881 19707 4564 1 10 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.859 -2.856 19707 4565 1 10 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.661 -2.436 19707 4566 1 10 . 1 1 12 12 GLN H H 12 8.194 8.194 8.310 -0.116 19707 4567 1 10 . 1 1 13 13 GLU N N 13 118.510 118.510 119.318 -0.808 19707 4568 1 10 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.119 -0.016 19707 4569 1 10 . 1 1 13 13 GLU C C 13 176.192 176.192 179.216 -3.024 19707 4570 1 10 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.678 -2.363 19707 4571 1 10 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.696 -3.663 19707 4572 1 10 . 1 1 13 13 GLU H H 13 7.917 7.917 7.712 0.205 19707 4573 1 10 . 1 1 14 14 ARG N N 14 118.193 118.193 119.472 -1.279 19707 4574 1 10 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.078 -0.110 19707 4575 1 10 . 1 1 14 14 ARG C C 14 176.764 176.764 178.599 -1.835 19707 4576 1 10 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.082 -1.799 19707 4577 1 10 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.695 -2.458 19707 4578 1 10 . 1 1 14 14 ARG H H 14 7.907 7.907 8.228 -0.321 19707 4579 1 10 . 1 1 15 15 VAL N N 15 117.991 117.991 115.124 2.867 19707 4580 1 10 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.950 -0.047 19707 4581 1 10 . 1 1 15 15 VAL C C 15 174.922 174.922 177.031 -2.109 19707 4582 1 10 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.334 -1.503 19707 4583 1 10 . 1 1 15 15 VAL CB C 15 28.723 28.723 30.853 -2.130 19707 4584 1 10 . 1 1 15 15 VAL H H 15 7.658 7.658 7.422 0.236 19707 4585 1 10 . 1 1 16 16 ASP N N 16 124.314 124.314 120.546 3.768 19707 4586 1 10 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.404 -0.088 19707 4587 1 10 . 1 1 16 16 ASP C C 16 176.462 176.462 178.085 -1.623 19707 4588 1 10 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.674 -2.348 19707 4589 1 10 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.155 -4.486 19707 4590 1 10 . 1 1 16 16 ASP H H 16 8.291 8.291 8.039 0.252 19707 4591 1 10 . 1 1 17 17 LEU N N 17 120.212 120.212 119.355 0.857 19707 4592 1 10 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.077 -0.023 19707 4593 1 10 . 1 1 17 17 LEU C C 17 177.171 177.171 178.772 -1.601 19707 4594 1 10 . 1 1 17 17 LEU CA C 17 54.980 54.980 58.137 -3.157 19707 4595 1 10 . 1 1 17 17 LEU CB C 17 38.845 38.845 42.033 -3.188 19707 4596 1 10 . 1 1 17 17 LEU H H 17 8.172 8.172 7.528 0.644 19707 4597 1 10 . 1 1 18 18 GLU N N 18 120.587 120.587 119.676 0.911 19707 4598 1 10 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.986 0.207 19707 4599 1 10 . 1 1 18 18 GLU C C 18 175.997 175.997 178.768 -2.771 19707 4600 1 10 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.330 -3.228 19707 4601 1 10 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.921 -2.849 19707 4602 1 10 . 1 1 18 18 GLU H H 18 7.876 7.876 7.792 0.084 19707 4603 1 10 . 1 1 19 19 ALA N N 19 121.800 121.800 122.851 -1.051 19707 4604 1 10 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.141 -0.350 19707 4605 1 10 . 1 1 19 19 ALA C C 19 175.708 175.708 179.729 -4.021 19707 4606 1 10 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.963 -2.111 19707 4607 1 10 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.319 -4.165 19707 4608 1 10 . 1 1 19 19 ALA H H 19 7.792 7.792 7.771 0.021 19707 4609 1 10 . 1 1 20 20 VAL N N 20 118.680 118.680 119.249 -0.569 19707 4610 1 10 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.594 -0.294 19707 4611 1 10 . 1 1 20 20 VAL C C 20 176.276 176.276 177.963 -1.687 19707 4612 1 10 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.314 -2.507 19707 4613 1 10 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.562 -2.011 19707 4614 1 10 . 1 1 20 20 VAL H H 20 7.712 7.712 7.838 -0.126 19707 4615 1 10 . 1 1 21 21 ARG N N 21 121.935 121.935 120.764 1.171 19707 4616 1 10 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.080 -0.085 19707 4617 1 10 . 1 1 21 21 ARG C C 21 176.828 176.828 178.564 -1.736 19707 4618 1 10 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.420 -1.760 19707 4619 1 10 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.556 -2.266 19707 4620 1 10 . 1 1 21 21 ARG H H 21 8.444 8.444 8.223 0.221 19707 4621 1 10 . 1 1 22 22 LEU N N 22 119.327 119.327 119.530 -0.203 19707 4622 1 10 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.120 -0.125 19707 4623 1 10 . 1 1 22 22 LEU C C 22 175.664 175.664 178.590 -2.926 19707 4624 1 10 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.130 -3.262 19707 4625 1 10 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.575 -2.439 19707 4626 1 10 . 1 1 22 22 LEU H H 22 8.248 8.248 8.162 0.086 19707 4627 1 10 . 1 1 23 23 ALA N N 23 121.202 121.202 122.202 -1.000 19707 4628 1 10 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.962 -0.227 19707 4629 1 10 . 1 1 23 23 ALA C C 23 175.492 175.492 179.627 -4.135 19707 4630 1 10 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.321 -2.252 19707 4631 1 10 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.021 -3.954 19707 4632 1 10 . 1 1 23 23 ALA H H 23 8.392 8.392 8.650 -0.258 19707 4633 1 10 . 1 1 24 24 SER N N 24 112.377 112.377 115.107 -2.730 19707 4634 1 10 . 1 1 24 24 SER HA H 24 4.214 4.214 4.277 -0.063 19707 4635 1 10 . 1 1 24 24 SER C C 24 174.773 174.773 176.401 -1.628 19707 4636 1 10 . 1 1 24 24 SER CA C 24 59.258 59.258 62.706 -3.448 19707 4637 1 10 . 1 1 24 24 SER CB C 24 60.149 60.149 63.006 -2.857 19707 4638 1 10 . 1 1 24 24 SER H H 24 7.690 7.690 7.988 -0.298 19707 4639 1 10 . 1 1 25 25 ILE N N 25 123.886 123.886 122.361 1.525 19707 4640 1 10 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.031 -0.189 19707 4641 1 10 . 1 1 25 25 ILE C C 25 176.487 176.487 178.166 -1.679 19707 4642 1 10 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.317 -0.324 19707 4643 1 10 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.421 -0.489 19707 4644 1 10 . 1 1 25 25 ILE H H 25 7.837 7.837 8.085 -0.248 19707 4645 1 10 . 1 1 26 26 VAL N N 26 122.538 122.538 121.262 1.276 19707 4646 1 10 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.625 -0.237 19707 4647 1 10 . 1 1 26 26 VAL C C 26 174.624 174.624 177.729 -3.105 19707 4648 1 10 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.587 -2.672 19707 4649 1 10 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.288 -3.393 19707 4650 1 10 . 1 1 26 26 VAL H H 26 8.804 8.804 8.639 0.165 19707 4651 1 10 . 1 1 27 27 ASP N N 27 120.433 120.433 120.052 0.381 19707 4652 1 10 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.313 -0.149 19707 4653 1 10 . 1 1 27 27 ASP C C 27 174.966 174.966 178.427 -3.461 19707 4654 1 10 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.479 -2.150 19707 4655 1 10 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.650 -2.796 19707 4656 1 10 . 1 1 27 27 ASP H H 27 8.719 8.719 8.486 0.233 19707 4657 1 10 . 1 1 28 28 SER N N 28 112.397 112.397 115.651 -3.254 19707 4658 1 10 . 1 1 28 28 SER HA H 28 4.073 4.073 4.176 -0.103 19707 4659 1 10 . 1 1 28 28 SER C C 28 174.405 174.405 176.732 -2.327 19707 4660 1 10 . 1 1 28 28 SER CA C 28 59.115 59.115 61.955 -2.840 19707 4661 1 10 . 1 1 28 28 SER CB C 28 60.125 60.125 63.098 -2.973 19707 4662 1 10 . 1 1 28 28 SER H H 28 7.599 7.599 8.148 -0.549 19707 4663 1 10 . 1 1 29 29 ARG N N 29 123.945 123.945 122.319 1.626 19707 4664 1 10 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.982 0.045 19707 4665 1 10 . 1 1 29 29 ARG C C 29 175.902 175.902 178.050 -2.148 19707 4666 1 10 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.785 -3.511 19707 4667 1 10 . 1 1 29 29 ARG CB C 29 27.740 27.740 28.992 -1.252 19707 4668 1 10 . 1 1 29 29 ARG H H 29 7.769 7.769 7.688 0.081 19707 4669 1 10 . 1 1 30 30 LEU N N 30 121.580 121.580 120.502 1.078 19707 4670 1 10 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.984 -0.235 19707 4671 1 10 . 1 1 30 30 LEU C C 30 177.474 177.474 179.641 -2.167 19707 4672 1 10 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.825 -2.512 19707 4673 1 10 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.805 -2.776 19707 4674 1 10 . 1 1 30 30 LEU H H 30 8.665 8.665 8.270 0.395 19707 4675 1 10 . 1 1 31 31 ILE N N 31 119.330 119.330 117.368 1.962 19707 4676 1 10 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.754 -0.063 19707 4677 1 10 . 1 1 31 31 ILE C C 31 175.341 175.341 177.780 -2.439 19707 4678 1 10 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.026 -2.514 19707 4679 1 10 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.894 -2.327 19707 4680 1 10 . 1 1 31 31 ILE H H 31 8.226 8.226 8.419 -0.193 19707 4681 1 10 . 1 1 32 32 GLY N N 32 106.092 106.092 105.858 0.234 19707 4682 1 10 . 1 1 32 32 GLY C C 32 172.413 172.413 174.904 -2.491 19707 4683 1 10 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.607 -3.110 19707 4684 1 10 . 1 1 32 32 GLY H H 32 7.767 7.767 7.717 0.050 19707 4685 1 10 . 1 1 33 33 THR N N 33 110.966 110.966 112.714 -1.748 19707 4686 1 10 . 1 1 33 33 THR HA H 33 4.455 4.455 4.354 0.101 19707 4687 1 10 . 1 1 33 33 THR C C 33 172.714 172.714 174.723 -2.009 19707 4688 1 10 . 1 1 33 33 THR CA C 33 60.032 60.032 62.381 -2.349 19707 4689 1 10 . 1 1 33 33 THR CB C 33 68.287 68.287 69.775 -1.488 19707 4690 1 10 . 1 1 33 33 THR H H 33 8.102 8.102 7.878 0.224 19707 4691 1 10 . 1 1 34 34 GLY N N 34 110.320 110.320 110.535 -0.215 19707 4692 1 10 . 1 1 34 34 GLY C C 34 170.505 170.505 173.791 -3.286 19707 4693 1 10 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.112 -2.529 19707 4694 1 10 . 1 1 34 34 GLY H H 34 8.072 8.072 8.078 -0.006 19707 4695 1 10 . 1 1 35 35 SER N N 35 112.944 112.944 114.427 -1.483 19707 4696 1 10 . 1 1 35 35 SER HA H 35 4.385 4.385 4.833 -0.448 19707 4697 1 10 . 1 1 35 35 SER C C 35 169.537 169.537 172.466 -2.929 19707 4698 1 10 . 1 1 35 35 SER CA C 35 54.794 54.794 58.226 -3.432 19707 4699 1 10 . 1 1 35 35 SER CB C 35 62.029 62.029 66.746 -4.717 19707 4700 1 10 . 1 1 35 35 SER H H 35 7.719 7.719 7.573 0.146 19707 4701 1 10 . 1 1 36 36 VAL N N 36 118.566 118.566 121.671 -3.105 19707 4702 1 10 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.206 -0.173 19707 4703 1 10 . 1 1 36 36 VAL C C 36 169.876 169.876 173.873 -3.997 19707 4704 1 10 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.040 -1.475 19707 4705 1 10 . 1 1 36 36 VAL CB C 36 30.952 30.952 34.128 -3.176 19707 4706 1 10 . 1 1 36 36 VAL H H 36 8.490 8.490 8.210 0.280 19707 4707 1 10 . 1 1 37 37 ASP N N 37 121.640 121.640 125.170 -3.530 19707 4708 1 10 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.904 -0.102 19707 4709 1 10 . 1 1 37 37 ASP C C 37 172.806 172.806 176.257 -3.451 19707 4710 1 10 . 1 1 37 37 ASP CA C 37 49.043 49.043 53.013 -3.970 19707 4711 1 10 . 1 1 37 37 ASP CB C 37 40.206 40.206 44.394 -4.188 19707 4712 1 10 . 1 1 37 37 ASP H H 37 7.195 7.195 8.282 -1.087 19707 4713 1 10 . 1 1 38 38 GLU N N 38 120.018 120.018 120.571 -0.553 19707 4714 1 10 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.932 -0.275 19707 4715 1 10 . 1 1 38 38 GLU C C 38 174.753 174.753 177.161 -2.408 19707 4716 1 10 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.472 -2.980 19707 4717 1 10 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.747 -3.668 19707 4718 1 10 . 1 1 38 38 GLU H H 38 8.908 8.908 8.935 -0.027 19707 4719 1 10 . 1 1 39 39 ASP N N 39 118.668 118.668 116.941 1.727 19707 4720 1 10 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.469 -0.223 19707 4721 1 10 . 1 1 39 39 ASP C C 39 175.393 175.393 177.784 -2.391 19707 4722 1 10 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.549 -1.685 19707 4723 1 10 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.315 -3.345 19707 4724 1 10 . 1 1 39 39 ASP H H 39 8.242 8.242 8.748 -0.506 19707 4725 1 10 . 1 1 40 40 PHE N N 40 119.851 119.851 119.892 -0.041 19707 4726 1 10 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.400 -0.196 19707 4727 1 10 . 1 1 40 40 PHE C C 40 174.929 174.929 176.440 -1.511 19707 4728 1 10 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.481 -2.310 19707 4729 1 10 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.087 -3.253 19707 4730 1 10 . 1 1 40 40 PHE H H 40 8.037 8.037 7.832 0.205 19707 4731 1 10 . 1 1 41 41 LEU N N 41 117.882 117.882 118.013 -0.131 19707 4732 1 10 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.202 -0.680 19707 4733 1 10 . 1 1 41 41 LEU C C 41 175.938 175.938 178.868 -2.930 19707 4734 1 10 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.666 -1.806 19707 4735 1 10 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.440 -3.209 19707 4736 1 10 . 1 1 41 41 LEU H H 41 7.816 7.816 7.800 0.016 19707 4737 1 10 . 1 1 42 42 ARG N N 42 118.360 118.360 118.983 -0.623 19707 4738 1 10 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.016 -0.276 19707 4739 1 10 . 1 1 42 42 ARG C C 42 175.435 175.435 177.171 -1.736 19707 4740 1 10 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.021 -2.050 19707 4741 1 10 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.781 -2.517 19707 4742 1 10 . 1 1 42 42 ARG H H 42 8.540 8.540 8.028 0.512 19707 4743 1 10 . 1 1 43 43 GLU N N 43 114.947 114.947 116.872 -1.925 19707 4744 1 10 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.222 -0.172 19707 4745 1 10 . 1 1 43 43 GLU C C 43 174.518 174.518 177.425 -2.907 19707 4746 1 10 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.635 -3.064 19707 4747 1 10 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.056 -3.015 19707 4748 1 10 . 1 1 43 43 GLU H H 43 7.223 7.223 8.142 -0.919 19707 4749 1 10 . 1 1 44 44 GLN N N 44 114.109 114.109 116.467 -2.358 19707 4750 1 10 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.328 -0.222 19707 4751 1 10 . 1 1 44 44 GLN C C 44 173.777 173.777 177.439 -3.662 19707 4752 1 10 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.788 -3.607 19707 4753 1 10 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.563 -3.693 19707 4754 1 10 . 1 1 44 44 GLN H H 44 7.372 7.372 8.069 -0.697 19707 4755 1 10 . 1 1 45 45 ILE N N 45 117.470 117.470 118.272 -0.802 19707 4756 1 10 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.734 0.214 19707 4757 1 10 . 1 1 45 45 ILE C C 45 172.305 172.305 177.065 -4.760 19707 4758 1 10 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.772 -5.267 19707 4759 1 10 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.669 -1.969 19707 4760 1 10 . 1 1 45 45 ILE H H 45 7.235 7.235 7.513 -0.278 19707 4761 1 10 . 1 1 46 46 ARG N N 46 122.996 122.996 114.967 8.029 19707 4762 1 10 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.048 0.142 19707 4763 1 10 . 1 1 46 46 ARG C C 46 172.992 172.992 175.550 -2.558 19707 4764 1 10 . 1 1 46 46 ARG CA C 46 53.761 53.761 57.916 -4.155 19707 4765 1 10 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.025 -0.073 19707 4766 1 10 . 1 1 46 46 ARG H H 46 8.336 8.336 8.714 -0.378 19707 4767 1 10 . 1 1 47 47 ASP N N 47 118.676 118.676 116.780 1.896 19707 4768 1 10 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.627 -0.179 19707 4769 1 10 . 1 1 47 47 ASP C C 47 172.520 172.520 174.923 -2.403 19707 4770 1 10 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.362 -2.472 19707 4771 1 10 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.507 -4.850 19707 4772 1 10 . 1 1 47 47 ASP H H 47 8.313 8.313 8.021 0.292 19707 4773 1 10 . 1 1 48 48 ALA N N 48 120.922 120.922 121.869 -0.947 19707 4774 1 10 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.533 -0.164 19707 4775 1 10 . 1 1 48 48 ALA C C 48 174.295 174.295 177.133 -2.838 19707 4776 1 10 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.649 -2.012 19707 4777 1 10 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.994 -3.780 19707 4778 1 10 . 1 1 48 48 ALA H H 48 7.824 7.824 7.402 0.422 19707 4779 1 10 . 1 1 49 49 ARG N N 49 118.644 118.644 120.109 -1.465 19707 4780 1 10 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.077 0.265 19707 4781 1 10 . 1 1 49 49 ARG C C 49 172.504 172.504 176.424 -3.920 19707 4782 1 10 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.566 -3.657 19707 4783 1 10 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.923 -2.580 19707 4784 1 10 . 1 1 49 49 ARG H H 49 7.911 7.911 8.381 -0.470 19707 4785 1 10 . 1 1 50 50 TYR N N 50 119.470 119.470 114.980 4.490 19707 4786 1 10 . 1 1 50 50 TYR HA H 50 5.291 5.291 4.962 0.330 19707 4787 1 10 . 1 1 50 50 TYR C C 50 170.470 170.470 174.108 -3.638 19707 4788 1 10 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.168 -1.900 19707 4789 1 10 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.292 -0.779 19707 4790 1 10 . 1 1 50 50 TYR H H 50 7.639 7.639 8.015 -0.376 19707 4791 1 10 . 1 1 51 51 ALA N N 51 127.418 127.418 125.392 2.026 19707 4792 1 10 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.168 0.053 19707 4793 1 10 . 1 1 51 51 ALA C C 51 171.328 171.328 175.570 -4.242 19707 4794 1 10 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.248 -2.815 19707 4795 1 10 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.696 -1.384 19707 4796 1 10 . 1 1 51 51 ALA H H 51 8.222 8.222 8.584 -0.362 19707 4797 1 10 . 1 1 52 52 VAL N N 52 117.832 117.832 121.821 -3.989 19707 4798 1 10 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.170 -0.503 19707 4799 1 10 . 1 1 52 52 VAL C C 52 172.436 172.436 174.215 -1.779 19707 4800 1 10 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.703 -2.946 19707 4801 1 10 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.291 -4.188 19707 4802 1 10 . 1 1 52 52 VAL H H 52 8.753 8.753 8.995 -0.242 19707 4803 1 10 . 1 1 53 53 ILE N N 53 128.027 128.027 125.267 2.760 19707 4804 1 10 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.617 0.225 19707 4805 1 10 . 1 1 53 53 ILE C C 53 172.110 172.110 173.663 -1.553 19707 4806 1 10 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.059 -2.306 19707 4807 1 10 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.464 -4.305 19707 4808 1 10 . 1 1 53 53 ILE H H 53 9.261 9.261 8.991 0.270 19707 4809 1 10 . 1 1 54 54 ARG N N 54 127.885 127.885 128.298 -0.413 19707 4810 1 10 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.685 0.068 19707 4811 1 10 . 1 1 54 54 ARG C C 54 172.285 172.285 173.946 -1.661 19707 4812 1 10 . 1 1 54 54 ARG CA C 54 52.260 52.260 54.451 -2.191 19707 4813 1 10 . 1 1 54 54 ARG CB C 54 27.892 27.892 31.089 -3.197 19707 4814 1 10 . 1 1 54 54 ARG H H 54 8.686 8.686 8.726 -0.040 19707 4815 1 10 . 1 1 55 55 ILE N N 55 129.907 129.907 124.635 5.272 19707 4816 1 10 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.430 -0.277 19707 4817 1 10 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.842 -2.247 19707 4818 1 10 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.239 -1.626 19707 4819 1 10 . 1 1 55 55 ILE H H 55 9.292 9.292 8.288 1.004 19707 4820 1 10 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.425 -0.233 19707 4821 1 10 . 1 1 56 56 PRO C C 56 174.787 174.787 177.898 -3.111 19707 4822 1 10 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.740 -2.006 19707 4823 1 10 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.677 -2.764 19707 4824 1 10 . 1 1 57 57 GLY N N 57 111.828 111.828 111.094 0.734 19707 4825 1 10 . 1 1 57 57 GLY C C 57 171.039 171.039 173.622 -2.583 19707 4826 1 10 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.843 -2.026 19707 4827 1 10 . 1 1 57 57 GLY H H 57 8.708 8.708 8.735 -0.027 19707 4828 1 10 . 1 1 58 58 GLN N N 58 118.457 118.457 119.676 -1.219 19707 4829 1 10 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.844 0.056 19707 4830 1 10 . 1 1 58 58 GLN CA C 58 50.272 50.272 52.994 -2.722 19707 4831 1 10 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.760 -2.606 19707 4832 1 10 . 1 1 58 58 GLN H H 58 7.909 7.909 7.567 0.342 19707 4833 1 10 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.446 -0.010 19707 4834 1 10 . 1 1 59 59 PRO C C 59 174.607 174.607 176.466 -1.859 19707 4835 1 10 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.870 -2.815 19707 4836 1 10 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.239 -3.062 19707 4837 1 10 . 1 1 60 60 VAL N N 60 122.695 122.695 120.634 2.061 19707 4838 1 10 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.031 -0.076 19707 4839 1 10 . 1 1 60 60 VAL C C 60 172.403 172.403 176.143 -3.740 19707 4840 1 10 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.552 -1.657 19707 4841 1 10 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.337 -2.695 19707 4842 1 10 . 1 1 60 60 VAL H H 60 8.364 8.364 8.157 0.207 19707 4843 1 10 . 1 1 61 61 VAL N N 61 126.097 126.097 127.969 -1.872 19707 4844 1 10 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.363 -0.063 19707 4845 1 10 . 1 1 61 61 VAL C C 61 170.891 170.891 174.627 -3.736 19707 4846 1 10 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.083 -2.269 19707 4847 1 10 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.371 -3.173 19707 4848 1 10 . 1 1 61 61 VAL H H 61 8.023 8.023 8.173 -0.150 19707 4849 1 10 . 1 1 62 62 GLU N N 62 126.097 126.097 125.366 0.731 19707 4850 1 10 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.013 0.146 19707 4851 1 10 . 1 1 62 62 GLU C C 62 172.252 172.252 175.362 -3.110 19707 4852 1 10 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.058 -3.518 19707 4853 1 10 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.678 -2.378 19707 4854 1 10 . 1 1 62 62 GLU H H 62 8.591 8.591 8.517 0.074 19707 4855 1 10 . 1 1 63 63 VAL N N 63 120.374 120.374 123.719 -3.345 19707 4856 1 10 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.145 0.248 19707 4857 1 10 . 1 1 63 63 VAL C C 63 171.040 171.040 176.560 -5.520 19707 4858 1 10 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.651 -3.818 19707 4859 1 10 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.980 -0.403 19707 4860 1 10 . 1 1 63 63 VAL H H 63 8.732 8.732 8.863 -0.131 19707 4861 1 10 . 1 1 64 64 GLY N N 64 109.935 109.935 114.137 -4.202 19707 4862 1 10 . 1 1 64 64 GLY C C 64 171.656 171.656 173.776 -2.120 19707 4863 1 10 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.004 -4.827 19707 4864 1 10 . 1 1 64 64 GLY H H 64 8.259 8.259 8.492 -0.233 19707 4865 1 10 . 1 1 65 65 THR N N 65 115.478 115.478 115.430 0.048 19707 4866 1 10 . 1 1 65 65 THR HA H 65 4.342 4.342 4.293 0.049 19707 4867 1 10 . 1 1 65 65 THR C C 65 170.663 170.663 172.392 -1.729 19707 4868 1 10 . 1 1 65 65 THR CA C 65 58.357 58.357 59.884 -1.527 19707 4869 1 10 . 1 1 65 65 THR CB C 65 67.923 67.923 71.465 -3.542 19707 4870 1 10 . 1 1 65 65 THR H H 65 8.123 8.123 7.539 0.584 19707 4871 1 10 . 1 1 66 66 LYS N N 66 130.775 130.775 124.337 6.438 19707 4872 1 10 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.192 -1.262 19707 4873 1 10 . 1 1 66 66 LYS CA C 66 52.190 52.190 55.115 -2.925 19707 4874 1 10 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.910 -3.220 19707 4875 1 10 . 1 1 66 66 LYS H H 66 8.472 8.472 8.141 0.331 19707 4876 1 10 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.674 -0.263 19707 4877 1 10 . 1 1 67 67 PRO C C 67 173.211 173.211 176.843 -3.632 19707 4878 1 10 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.449 -2.883 19707 4879 1 10 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.489 -3.086 19707 4880 1 10 . 1 1 68 68 THR N N 68 111.983 111.983 114.012 -2.029 19707 4881 1 10 . 1 1 68 68 THR HA H 68 4.277 4.277 4.246 0.031 19707 4882 1 10 . 1 1 68 68 THR C C 68 171.720 171.720 175.672 -3.952 19707 4883 1 10 . 1 1 68 68 THR CA C 68 58.193 58.193 63.211 -5.018 19707 4884 1 10 . 1 1 68 68 THR CB C 68 67.723 67.723 69.246 -1.523 19707 4885 1 10 . 1 1 68 68 THR H H 68 8.091 8.091 8.240 -0.149 19707 4886 1 10 . 1 1 69 69 GLY N N 69 109.918 109.918 108.462 1.456 19707 4887 1 10 . 1 1 69 69 GLY C C 69 170.783 170.783 174.432 -3.649 19707 4888 1 10 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.709 -2.653 19707 4889 1 10 . 1 1 69 69 GLY H H 69 8.119 8.119 8.033 0.086 19707 4890 1 10 . 1 1 70 70 ASP N N 70 123.294 123.294 124.889 -1.595 19707 4891 1 10 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.836 -0.287 19707 4892 1 10 . 1 1 70 70 ASP C C 70 173.651 173.651 175.209 -1.558 19707 4893 1 10 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.794 -2.933 19707 4894 1 10 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.025 -1.292 19707 4895 1 10 . 1 1 70 70 ASP H H 70 8.444 8.444 8.691 -0.247 19707 4896 1 10 . 1 1 71 71 VAL N N 71 117.772 117.772 113.194 4.578 19707 4897 1 10 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.071 -0.364 19707 4898 1 10 . 1 1 71 71 VAL C C 71 172.992 172.992 174.265 -1.273 19707 4899 1 10 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.106 -1.730 19707 4900 1 10 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.629 -2.607 19707 4901 1 10 . 1 1 71 71 VAL H H 71 8.173 8.173 7.734 0.439 19707 4902 1 10 . 1 1 72 72 LEU N N 72 123.435 123.435 122.479 0.956 19707 4903 1 10 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.612 0.024 19707 4904 1 10 . 1 1 72 72 LEU C C 72 173.189 173.189 175.874 -2.685 19707 4905 1 10 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.213 -3.006 19707 4906 1 10 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.606 -1.968 19707 4907 1 10 . 1 1 72 72 LEU H H 72 8.859 8.859 8.853 0.006 19707 4908 1 10 . 1 1 73 73 GLN N N 73 119.520 119.520 121.714 -2.194 19707 4909 1 10 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.137 0.208 19707 4910 1 10 . 1 1 73 73 GLN C C 73 172.249 172.249 175.517 -3.268 19707 4911 1 10 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.511 -3.178 19707 4912 1 10 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.619 -1.849 19707 4913 1 10 . 1 1 73 73 GLN H H 73 9.196 9.196 8.344 0.852 19707 4914 1 10 . 1 1 74 74 GLY N N 74 113.513 113.513 111.609 1.904 19707 4915 1 10 . 1 1 74 74 GLY C C 74 169.072 169.072 171.949 -2.877 19707 4916 1 10 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.606 -2.309 19707 4917 1 10 . 1 1 74 74 GLY H H 74 9.373 9.373 9.128 0.245 19707 4918 1 10 . 1 1 75 75 ARG N N 75 122.479 122.479 123.209 -0.730 19707 4919 1 10 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.426 0.076 19707 4920 1 10 . 1 1 75 75 ARG C C 75 172.348 172.348 174.095 -1.747 19707 4921 1 10 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.594 -3.836 19707 4922 1 10 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.231 -2.413 19707 4923 1 10 . 1 1 75 75 ARG H H 75 8.615 8.615 8.465 0.150 19707 4924 1 10 . 1 1 76 76 ALA N N 76 122.346 122.346 128.083 -5.737 19707 4925 1 10 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.824 -0.288 19707 4926 1 10 . 1 1 76 76 ALA C C 76 172.704 172.704 174.657 -1.953 19707 4927 1 10 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.372 -2.345 19707 4928 1 10 . 1 1 76 76 ALA CB C 76 20.025 20.025 23.090 -3.065 19707 4929 1 10 . 1 1 76 76 ALA H H 76 8.590 8.590 9.079 -0.489 19707 4930 1 10 . 1 1 77 77 THR N N 77 116.961 116.961 117.042 -0.081 19707 4931 1 10 . 1 1 77 77 THR HA H 77 4.988 4.988 5.161 -0.173 19707 4932 1 10 . 1 1 77 77 THR C C 77 172.800 172.800 174.743 -1.943 19707 4933 1 10 . 1 1 77 77 THR CA C 77 58.344 58.344 61.010 -2.666 19707 4934 1 10 . 1 1 77 77 THR CB C 77 67.712 67.712 70.273 -2.561 19707 4935 1 10 . 1 1 77 77 THR H H 77 8.491 8.491 8.300 0.191 19707 4936 1 10 . 1 1 78 78 GLY N N 78 111.103 111.103 113.330 -2.227 19707 4937 1 10 . 1 1 78 78 GLY C C 78 172.567 172.567 174.458 -1.891 19707 4938 1 10 . 1 1 78 78 GLY CA C 78 41.309 41.309 44.067 -2.758 19707 4939 1 10 . 1 1 78 78 GLY H H 78 8.649 8.649 8.588 0.061 19707 4940 1 10 . 1 1 79 79 GLU N N 79 123.423 123.423 119.864 3.559 19707 4941 1 10 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.286 -0.290 19707 4942 1 10 . 1 1 79 79 GLU C C 79 175.466 175.466 177.463 -1.997 19707 4943 1 10 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.238 -2.779 19707 4944 1 10 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.619 -3.552 19707 4945 1 10 . 1 1 79 79 GLU H H 79 10.375 10.375 8.867 1.508 19707 4946 1 10 . 1 1 80 80 GLU N N 80 113.846 113.846 117.681 -3.835 19707 4947 1 10 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.396 -0.038 19707 4948 1 10 . 1 1 80 80 GLU C C 80 173.293 173.293 176.855 -3.562 19707 4949 1 10 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.970 -4.194 19707 4950 1 10 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.681 -4.950 19707 4951 1 10 . 1 1 80 80 GLU H H 80 7.679 7.679 8.290 -0.611 19707 4952 1 10 . 1 1 81 81 GLY N N 81 105.493 105.493 108.856 -3.363 19707 4953 1 10 . 1 1 81 81 GLY C C 81 170.427 170.427 174.070 -3.643 19707 4954 1 10 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.039 -2.427 19707 4955 1 10 . 1 1 81 81 GLY H H 81 7.476 7.476 7.583 -0.107 19707 4956 1 10 . 1 1 82 82 GLU N N 82 122.160 122.160 118.999 3.161 19707 4957 1 10 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.361 0.593 19707 4958 1 10 . 1 1 82 82 GLU C C 82 171.004 171.004 175.512 -4.508 19707 4959 1 10 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.586 -4.264 19707 4960 1 10 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.947 -4.881 19707 4961 1 10 . 1 1 82 82 GLU H H 82 9.585 9.585 8.000 1.585 19707 4962 1 10 . 1 1 83 83 THR N N 83 114.756 114.756 116.365 -1.609 19707 4963 1 10 . 1 1 83 83 THR HA H 83 4.990 4.990 5.198 -0.208 19707 4964 1 10 . 1 1 83 83 THR C C 83 170.909 170.909 173.354 -2.445 19707 4965 1 10 . 1 1 83 83 THR CA C 83 57.957 57.957 61.965 -4.008 19707 4966 1 10 . 1 1 83 83 THR CB C 83 68.271 68.271 71.087 -2.816 19707 4967 1 10 . 1 1 83 83 THR H H 83 8.490 8.490 8.418 0.072 19707 4968 1 10 . 1 1 84 84 VAL N N 84 122.639 122.639 126.109 -3.470 19707 4969 1 10 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.662 -0.007 19707 4970 1 10 . 1 1 84 84 VAL C C 84 170.962 170.962 173.449 -2.487 19707 4971 1 10 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.776 -2.478 19707 4972 1 10 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.215 -2.991 19707 4973 1 10 . 1 1 84 84 VAL H H 84 9.001 9.001 9.169 -0.168 19707 4974 1 10 . 1 1 85 85 LEU N N 85 129.903 129.903 127.060 2.843 19707 4975 1 10 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.521 -0.129 19707 4976 1 10 . 1 1 85 85 LEU C C 85 172.346 172.346 174.150 -1.804 19707 4977 1 10 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.403 -2.606 19707 4978 1 10 . 1 1 85 85 LEU CB C 85 42.515 42.515 47.002 -4.487 19707 4979 1 10 . 1 1 85 85 LEU H H 85 8.610 8.610 8.971 -0.361 19707 4980 1 10 . 1 1 86 86 VAL N N 86 122.778 122.778 123.409 -0.631 19707 4981 1 10 . 1 1 86 86 VAL HA H 86 5.041 5.041 5.030 0.011 19707 4982 1 10 . 1 1 86 86 VAL C C 86 172.570 172.570 173.765 -1.195 19707 4983 1 10 . 1 1 86 86 VAL CA C 86 57.200 57.200 59.606 -2.406 19707 4984 1 10 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.877 -3.602 19707 4985 1 10 . 1 1 86 86 VAL H H 86 9.228 9.228 9.171 0.057 19707 4986 1 10 . 1 1 87 87 GLU N N 87 120.437 120.437 127.203 -6.766 19707 4987 1 10 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.528 0.203 19707 4988 1 10 . 1 1 87 87 GLU C C 87 172.267 172.267 174.975 -2.708 19707 4989 1 10 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.693 -3.344 19707 4990 1 10 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.999 -2.875 19707 4991 1 10 . 1 1 87 87 GLU H H 87 8.851 8.851 9.260 -0.409 19707 4992 1 10 . 1 1 88 88 GLU N N 88 118.525 118.525 121.531 -3.006 19707 4993 1 10 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.796 0.205 19707 4994 1 10 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.841 -2.924 19707 4995 1 10 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.176 -2.229 19707 4996 1 10 . 1 1 88 88 GLU H H 88 8.380 8.380 8.630 -0.250 19707 4997 1 10 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.294 0.235 19707 4998 1 10 . 1 1 89 89 PRO C C 89 172.774 172.774 176.702 -3.928 19707 4999 1 10 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.248 -2.867 19707 5000 1 10 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.089 -2.755 19707 5001 1 11 . 1 1 2 2 SER N N 2 115.963 115.963 115.354 0.609 19707 5002 1 11 . 1 1 2 2 SER HA H 2 4.408 4.408 4.999 -0.591 19707 5003 1 11 . 1 1 2 2 SER C C 2 171.788 171.788 173.814 -2.026 19707 5004 1 11 . 1 1 2 2 SER CA C 2 55.870 55.870 58.241 -2.371 19707 5005 1 11 . 1 1 2 2 SER CB C 2 61.022 61.022 65.340 -4.318 19707 5006 1 11 . 1 1 2 2 SER H H 2 8.661 8.661 8.754 -0.093 19707 5007 1 11 . 1 1 3 3 GLU N N 3 122.941 122.941 120.971 1.970 19707 5008 1 11 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.589 -0.269 19707 5009 1 11 . 1 1 3 3 GLU C C 3 173.817 173.817 174.974 -1.157 19707 5010 1 11 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.459 -1.505 19707 5011 1 11 . 1 1 3 3 GLU CB C 3 26.837 26.837 31.125 -4.288 19707 5012 1 11 . 1 1 3 3 GLU H H 3 8.706 8.706 8.791 -0.085 19707 5013 1 11 . 1 1 4 4 THR N N 4 116.182 116.182 118.173 -1.991 19707 5014 1 11 . 1 1 4 4 THR HA H 4 4.233 4.233 4.407 -0.174 19707 5015 1 11 . 1 1 4 4 THR C C 4 171.719 171.719 174.825 -3.106 19707 5016 1 11 . 1 1 4 4 THR CA C 4 59.414 59.414 62.649 -3.235 19707 5017 1 11 . 1 1 4 4 THR CB C 4 67.009 67.009 69.596 -2.587 19707 5018 1 11 . 1 1 4 4 THR H H 4 8.165 8.165 8.298 -0.133 19707 5019 1 11 . 1 1 5 5 ARG N N 5 124.184 124.184 122.375 1.809 19707 5020 1 11 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.349 0.011 19707 5021 1 11 . 1 1 5 5 ARG C C 5 173.520 173.520 175.830 -2.310 19707 5022 1 11 . 1 1 5 5 ARG CA C 5 53.343 53.343 56.433 -3.090 19707 5023 1 11 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.395 -2.230 19707 5024 1 11 . 1 1 5 5 ARG H H 5 8.354 8.354 8.322 0.032 19707 5025 1 11 . 1 1 6 6 THR N N 6 116.652 116.652 118.070 -1.418 19707 5026 1 11 . 1 1 6 6 THR HA H 6 4.263 4.263 4.316 -0.053 19707 5027 1 11 . 1 1 6 6 THR C C 6 171.784 171.784 174.157 -2.373 19707 5028 1 11 . 1 1 6 6 THR CA C 6 59.218 59.218 62.438 -3.220 19707 5029 1 11 . 1 1 6 6 THR CB C 6 67.213 67.213 69.409 -2.196 19707 5030 1 11 . 1 1 6 6 THR H H 6 8.224 8.224 7.867 0.357 19707 5031 1 11 . 1 1 7 7 ILE N N 7 123.882 123.882 125.396 -1.514 19707 5032 1 11 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.246 -0.108 19707 5033 1 11 . 1 1 7 7 ILE C C 7 173.572 173.572 177.517 -3.945 19707 5034 1 11 . 1 1 7 7 ILE CA C 7 58.482 58.482 59.894 -1.412 19707 5035 1 11 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.656 -2.587 19707 5036 1 11 . 1 1 7 7 ILE H H 7 8.247 8.247 8.418 -0.171 19707 5037 1 11 . 1 1 8 8 SER N N 8 120.287 120.287 122.892 -2.605 19707 5038 1 11 . 1 1 8 8 SER HA H 8 4.445 4.445 4.459 -0.014 19707 5039 1 11 . 1 1 8 8 SER C C 8 171.926 171.926 174.487 -2.561 19707 5040 1 11 . 1 1 8 8 SER CA C 8 55.522 55.522 58.669 -3.147 19707 5041 1 11 . 1 1 8 8 SER CB C 8 61.073 61.073 62.015 -0.942 19707 5042 1 11 . 1 1 8 8 SER H H 8 8.402 8.402 8.840 -0.438 19707 5043 1 11 . 1 1 9 9 SER N N 9 118.425 118.425 118.910 -0.485 19707 5044 1 11 . 1 1 9 9 SER HA H 9 4.525 4.525 4.330 0.195 19707 5045 1 11 . 1 1 9 9 SER C C 9 172.663 172.663 174.084 -1.421 19707 5046 1 11 . 1 1 9 9 SER CA C 9 55.897 55.897 59.578 -3.681 19707 5047 1 11 . 1 1 9 9 SER CB C 9 61.375 61.375 62.081 -0.706 19707 5048 1 11 . 1 1 9 9 SER H H 9 8.362 8.362 8.032 0.330 19707 5049 1 11 . 1 1 10 10 THR N N 10 115.676 115.676 113.679 1.997 19707 5050 1 11 . 1 1 10 10 THR HA H 10 4.232 4.232 4.446 -0.214 19707 5051 1 11 . 1 1 10 10 THR C C 10 173.070 173.070 175.498 -2.428 19707 5052 1 11 . 1 1 10 10 THR CA C 10 60.318 60.318 63.168 -2.850 19707 5053 1 11 . 1 1 10 10 THR CB C 10 67.205 67.205 68.804 -1.599 19707 5054 1 11 . 1 1 10 10 THR H H 10 8.274 8.274 8.064 0.210 19707 5055 1 11 . 1 1 11 11 ALA N N 11 124.726 124.726 123.632 1.094 19707 5056 1 11 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.298 -0.311 19707 5057 1 11 . 1 1 11 11 ALA C C 11 176.825 176.825 179.547 -2.722 19707 5058 1 11 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.909 -2.368 19707 5059 1 11 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.319 -2.430 19707 5060 1 11 . 1 1 11 11 ALA H H 11 8.347 8.347 8.164 0.183 19707 5061 1 11 . 1 1 12 12 GLN N N 12 117.915 117.915 117.511 0.404 19707 5062 1 11 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.129 -0.340 19707 5063 1 11 . 1 1 12 12 GLN C C 12 174.697 174.697 177.528 -2.831 19707 5064 1 11 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.795 -2.791 19707 5065 1 11 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.647 -2.422 19707 5066 1 11 . 1 1 12 12 GLN H H 12 8.194 8.194 8.110 0.084 19707 5067 1 11 . 1 1 13 13 GLU N N 13 118.510 118.510 119.331 -0.821 19707 5068 1 11 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.122 -0.019 19707 5069 1 11 . 1 1 13 13 GLU C C 13 176.192 176.192 179.232 -3.040 19707 5070 1 11 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.847 -2.532 19707 5071 1 11 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.724 -3.692 19707 5072 1 11 . 1 1 13 13 GLU H H 13 7.917 7.917 7.875 0.042 19707 5073 1 11 . 1 1 14 14 ARG N N 14 118.193 118.193 119.605 -1.412 19707 5074 1 11 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.049 -0.081 19707 5075 1 11 . 1 1 14 14 ARG C C 14 176.764 176.764 178.568 -1.804 19707 5076 1 11 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.132 -1.849 19707 5077 1 11 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.645 -2.408 19707 5078 1 11 . 1 1 14 14 ARG H H 14 7.907 7.907 8.092 -0.185 19707 5079 1 11 . 1 1 15 15 VAL N N 15 117.991 117.991 115.327 2.664 19707 5080 1 11 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.923 -0.020 19707 5081 1 11 . 1 1 15 15 VAL C C 15 174.922 174.922 177.638 -2.716 19707 5082 1 11 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.869 -2.038 19707 5083 1 11 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.342 -2.619 19707 5084 1 11 . 1 1 15 15 VAL H H 15 7.658 7.658 7.465 0.193 19707 5085 1 11 . 1 1 16 16 ASP N N 16 124.314 124.314 120.496 3.818 19707 5086 1 11 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.431 -0.115 19707 5087 1 11 . 1 1 16 16 ASP C C 16 176.462 176.462 177.801 -1.339 19707 5088 1 11 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.330 -2.003 19707 5089 1 11 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.391 -4.722 19707 5090 1 11 . 1 1 16 16 ASP H H 16 8.291 8.291 8.128 0.163 19707 5091 1 11 . 1 1 17 17 LEU N N 17 120.212 120.212 119.619 0.593 19707 5092 1 11 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.133 -0.079 19707 5093 1 11 . 1 1 17 17 LEU C C 17 177.171 177.171 179.009 -1.838 19707 5094 1 11 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.549 -2.569 19707 5095 1 11 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.251 -2.406 19707 5096 1 11 . 1 1 17 17 LEU H H 17 8.172 8.172 7.547 0.625 19707 5097 1 11 . 1 1 18 18 GLU N N 18 120.587 120.587 119.500 1.087 19707 5098 1 11 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.979 0.214 19707 5099 1 11 . 1 1 18 18 GLU C C 18 175.997 175.997 178.723 -2.726 19707 5100 1 11 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.474 -3.372 19707 5101 1 11 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.858 -2.786 19707 5102 1 11 . 1 1 18 18 GLU H H 18 7.876 7.876 7.865 0.011 19707 5103 1 11 . 1 1 19 19 ALA N N 19 121.800 121.800 122.544 -0.744 19707 5104 1 11 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.137 -0.346 19707 5105 1 11 . 1 1 19 19 ALA C C 19 175.708 175.708 179.833 -4.125 19707 5106 1 11 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.855 -2.003 19707 5107 1 11 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.369 -4.215 19707 5108 1 11 . 1 1 19 19 ALA H H 19 7.792 7.792 7.515 0.277 19707 5109 1 11 . 1 1 20 20 VAL N N 20 118.680 118.680 119.515 -0.835 19707 5110 1 11 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.569 -0.269 19707 5111 1 11 . 1 1 20 20 VAL C C 20 176.276 176.276 177.929 -1.653 19707 5112 1 11 . 1 1 20 20 VAL CA C 20 63.807 63.807 67.170 -3.363 19707 5113 1 11 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.317 -1.766 19707 5114 1 11 . 1 1 20 20 VAL H H 20 7.712 7.712 8.062 -0.350 19707 5115 1 11 . 1 1 21 21 ARG N N 21 121.935 121.935 119.829 2.106 19707 5116 1 11 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.038 -0.043 19707 5117 1 11 . 1 1 21 21 ARG C C 21 176.828 176.828 179.091 -2.263 19707 5118 1 11 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.904 -2.244 19707 5119 1 11 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.619 -2.329 19707 5120 1 11 . 1 1 21 21 ARG H H 21 8.444 8.444 8.329 0.115 19707 5121 1 11 . 1 1 22 22 LEU N N 22 119.327 119.327 120.044 -0.717 19707 5122 1 11 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.108 -0.113 19707 5123 1 11 . 1 1 22 22 LEU C C 22 175.664 175.664 178.550 -2.886 19707 5124 1 11 . 1 1 22 22 LEU CA C 22 54.868 54.868 57.875 -3.007 19707 5125 1 11 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.417 -2.282 19707 5126 1 11 . 1 1 22 22 LEU H H 22 8.248 8.248 7.945 0.303 19707 5127 1 11 . 1 1 23 23 ALA N N 23 121.202 121.202 122.459 -1.257 19707 5128 1 11 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.899 -0.164 19707 5129 1 11 . 1 1 23 23 ALA C C 23 175.492 175.492 179.479 -3.987 19707 5130 1 11 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.317 -2.248 19707 5131 1 11 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.830 -3.763 19707 5132 1 11 . 1 1 23 23 ALA H H 23 8.392 8.392 8.480 -0.088 19707 5133 1 11 . 1 1 24 24 SER N N 24 112.377 112.377 115.179 -2.802 19707 5134 1 11 . 1 1 24 24 SER HA H 24 4.214 4.214 4.254 -0.040 19707 5135 1 11 . 1 1 24 24 SER C C 24 174.773 174.773 176.578 -1.805 19707 5136 1 11 . 1 1 24 24 SER CA C 24 59.258 59.258 61.384 -2.126 19707 5137 1 11 . 1 1 24 24 SER CB C 24 60.149 60.149 63.355 -3.206 19707 5138 1 11 . 1 1 24 24 SER H H 24 7.690 7.690 7.875 -0.185 19707 5139 1 11 . 1 1 25 25 ILE N N 25 123.886 123.886 122.485 1.401 19707 5140 1 11 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.017 -0.175 19707 5141 1 11 . 1 1 25 25 ILE C C 25 176.487 176.487 178.255 -1.768 19707 5142 1 11 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.350 -0.357 19707 5143 1 11 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.348 -0.416 19707 5144 1 11 . 1 1 25 25 ILE H H 25 7.837 7.837 8.241 -0.404 19707 5145 1 11 . 1 1 26 26 VAL N N 26 122.538 122.538 121.774 0.764 19707 5146 1 11 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.662 -0.274 19707 5147 1 11 . 1 1 26 26 VAL C C 26 174.624 174.624 178.023 -3.399 19707 5148 1 11 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.463 -2.548 19707 5149 1 11 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.269 -3.374 19707 5150 1 11 . 1 1 26 26 VAL H H 26 8.804 8.804 8.675 0.129 19707 5151 1 11 . 1 1 27 27 ASP N N 27 120.433 120.433 120.866 -0.433 19707 5152 1 11 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.307 -0.143 19707 5153 1 11 . 1 1 27 27 ASP C C 27 174.966 174.966 179.034 -4.068 19707 5154 1 11 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.820 -2.491 19707 5155 1 11 . 1 1 27 27 ASP CB C 27 37.854 37.854 39.935 -2.081 19707 5156 1 11 . 1 1 27 27 ASP H H 27 8.719 8.719 8.667 0.052 19707 5157 1 11 . 1 1 28 28 SER N N 28 112.397 112.397 114.987 -2.590 19707 5158 1 11 . 1 1 28 28 SER HA H 28 4.073 4.073 4.228 -0.155 19707 5159 1 11 . 1 1 28 28 SER C C 28 174.405 174.405 176.449 -2.044 19707 5160 1 11 . 1 1 28 28 SER CA C 28 59.115 59.115 61.759 -2.644 19707 5161 1 11 . 1 1 28 28 SER CB C 28 60.125 60.125 63.106 -2.982 19707 5162 1 11 . 1 1 28 28 SER H H 28 7.599 7.599 8.444 -0.845 19707 5163 1 11 . 1 1 29 29 ARG N N 29 123.945 123.945 122.401 1.544 19707 5164 1 11 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.976 0.051 19707 5165 1 11 . 1 1 29 29 ARG C C 29 175.902 175.902 177.922 -2.020 19707 5166 1 11 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.905 -3.631 19707 5167 1 11 . 1 1 29 29 ARG CB C 29 27.740 27.740 28.965 -1.224 19707 5168 1 11 . 1 1 29 29 ARG H H 29 7.769 7.769 7.496 0.273 19707 5169 1 11 . 1 1 30 30 LEU N N 30 121.580 121.580 120.123 1.457 19707 5170 1 11 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.940 -0.191 19707 5171 1 11 . 1 1 30 30 LEU C C 30 177.474 177.474 179.116 -1.642 19707 5172 1 11 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.878 -2.565 19707 5173 1 11 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.823 -2.794 19707 5174 1 11 . 1 1 30 30 LEU H H 30 8.665 8.665 8.301 0.364 19707 5175 1 11 . 1 1 31 31 ILE N N 31 119.330 119.330 118.069 1.261 19707 5176 1 11 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.814 -0.123 19707 5177 1 11 . 1 1 31 31 ILE C C 31 175.341 175.341 177.806 -2.465 19707 5178 1 11 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.084 -2.572 19707 5179 1 11 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.813 -2.246 19707 5180 1 11 . 1 1 31 31 ILE H H 31 8.226 8.226 8.546 -0.320 19707 5181 1 11 . 1 1 32 32 GLY N N 32 106.092 106.092 105.879 0.213 19707 5182 1 11 . 1 1 32 32 GLY C C 32 172.413 172.413 174.884 -2.471 19707 5183 1 11 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.617 -3.120 19707 5184 1 11 . 1 1 32 32 GLY H H 32 7.767 7.767 7.631 0.136 19707 5185 1 11 . 1 1 33 33 THR N N 33 110.966 110.966 112.835 -1.869 19707 5186 1 11 . 1 1 33 33 THR HA H 33 4.455 4.455 4.356 0.099 19707 5187 1 11 . 1 1 33 33 THR C C 33 172.714 172.714 174.768 -2.054 19707 5188 1 11 . 1 1 33 33 THR CA C 33 60.032 60.032 62.380 -2.348 19707 5189 1 11 . 1 1 33 33 THR CB C 33 68.287 68.287 69.840 -1.553 19707 5190 1 11 . 1 1 33 33 THR H H 33 8.102 8.102 7.877 0.225 19707 5191 1 11 . 1 1 34 34 GLY N N 34 110.320 110.320 110.569 -0.249 19707 5192 1 11 . 1 1 34 34 GLY C C 34 170.505 170.505 173.803 -3.298 19707 5193 1 11 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.097 -2.514 19707 5194 1 11 . 1 1 34 34 GLY H H 34 8.072 8.072 8.229 -0.157 19707 5195 1 11 . 1 1 35 35 SER N N 35 112.944 112.944 113.813 -0.869 19707 5196 1 11 . 1 1 35 35 SER HA H 35 4.385 4.385 4.677 -0.292 19707 5197 1 11 . 1 1 35 35 SER C C 35 169.537 169.537 172.573 -3.036 19707 5198 1 11 . 1 1 35 35 SER CA C 35 54.794 54.794 57.952 -3.158 19707 5199 1 11 . 1 1 35 35 SER CB C 35 62.029 62.029 66.172 -4.143 19707 5200 1 11 . 1 1 35 35 SER H H 35 7.719 7.719 7.634 0.085 19707 5201 1 11 . 1 1 36 36 VAL N N 36 118.566 118.566 122.456 -3.890 19707 5202 1 11 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.302 -0.269 19707 5203 1 11 . 1 1 36 36 VAL C C 36 169.876 169.876 173.924 -4.048 19707 5204 1 11 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.022 -1.457 19707 5205 1 11 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.449 -2.497 19707 5206 1 11 . 1 1 36 36 VAL H H 36 8.490 8.490 8.479 0.011 19707 5207 1 11 . 1 1 37 37 ASP N N 37 121.640 121.640 128.140 -6.500 19707 5208 1 11 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.933 -0.131 19707 5209 1 11 . 1 1 37 37 ASP C C 37 172.806 172.806 176.228 -3.422 19707 5210 1 11 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.714 -3.671 19707 5211 1 11 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.769 -3.563 19707 5212 1 11 . 1 1 37 37 ASP H H 37 7.195 7.195 8.055 -0.860 19707 5213 1 11 . 1 1 38 38 GLU N N 38 120.018 120.018 120.740 -0.722 19707 5214 1 11 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.927 -0.270 19707 5215 1 11 . 1 1 38 38 GLU C C 38 174.753 174.753 177.950 -3.197 19707 5216 1 11 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.532 -3.040 19707 5217 1 11 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.821 -3.742 19707 5218 1 11 . 1 1 38 38 GLU H H 38 8.908 8.908 8.792 0.116 19707 5219 1 11 . 1 1 39 39 ASP N N 39 118.668 118.668 117.644 1.024 19707 5220 1 11 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.470 -0.224 19707 5221 1 11 . 1 1 39 39 ASP C C 39 175.393 175.393 177.734 -2.341 19707 5222 1 11 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.328 -1.464 19707 5223 1 11 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.505 -3.535 19707 5224 1 11 . 1 1 39 39 ASP H H 39 8.242 8.242 8.630 -0.388 19707 5225 1 11 . 1 1 40 40 PHE N N 40 119.851 119.851 119.107 0.744 19707 5226 1 11 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.418 -0.214 19707 5227 1 11 . 1 1 40 40 PHE C C 40 174.929 174.929 176.127 -1.198 19707 5228 1 11 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.575 -2.404 19707 5229 1 11 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.871 -3.038 19707 5230 1 11 . 1 1 40 40 PHE H H 40 8.037 8.037 7.768 0.269 19707 5231 1 11 . 1 1 41 41 LEU N N 41 117.882 117.882 117.993 -0.111 19707 5232 1 11 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.167 -0.645 19707 5233 1 11 . 1 1 41 41 LEU C C 41 175.938 175.938 178.852 -2.914 19707 5234 1 11 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.670 -1.810 19707 5235 1 11 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.404 -3.173 19707 5236 1 11 . 1 1 41 41 LEU H H 41 7.816 7.816 7.630 0.186 19707 5237 1 11 . 1 1 42 42 ARG N N 42 118.360 118.360 119.002 -0.642 19707 5238 1 11 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.008 -0.268 19707 5239 1 11 . 1 1 42 42 ARG C C 42 175.435 175.435 177.011 -1.576 19707 5240 1 11 . 1 1 42 42 ARG CA C 42 56.971 56.971 58.980 -2.009 19707 5241 1 11 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.917 -2.653 19707 5242 1 11 . 1 1 42 42 ARG H H 42 8.540 8.540 8.211 0.329 19707 5243 1 11 . 1 1 43 43 GLU N N 43 114.947 114.947 116.193 -1.246 19707 5244 1 11 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.298 -0.248 19707 5245 1 11 . 1 1 43 43 GLU C C 43 174.518 174.518 177.273 -2.755 19707 5246 1 11 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.175 -2.604 19707 5247 1 11 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.058 -3.017 19707 5248 1 11 . 1 1 43 43 GLU H H 43 7.223 7.223 8.181 -0.958 19707 5249 1 11 . 1 1 44 44 GLN N N 44 114.109 114.109 117.582 -3.473 19707 5250 1 11 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.338 -0.232 19707 5251 1 11 . 1 1 44 44 GLN C C 44 173.777 173.777 177.604 -3.827 19707 5252 1 11 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.645 -3.464 19707 5253 1 11 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.731 -3.861 19707 5254 1 11 . 1 1 44 44 GLN H H 44 7.372 7.372 7.990 -0.618 19707 5255 1 11 . 1 1 45 45 ILE N N 45 117.470 117.470 115.466 2.004 19707 5256 1 11 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.751 0.197 19707 5257 1 11 . 1 1 45 45 ILE C C 45 172.305 172.305 177.381 -5.076 19707 5258 1 11 . 1 1 45 45 ILE CA C 45 58.505 58.505 64.174 -5.669 19707 5259 1 11 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.805 -2.105 19707 5260 1 11 . 1 1 45 45 ILE H H 45 7.235 7.235 7.643 -0.408 19707 5261 1 11 . 1 1 46 46 ARG N N 46 122.996 122.996 116.435 6.561 19707 5262 1 11 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.986 0.204 19707 5263 1 11 . 1 1 46 46 ARG C C 46 172.992 172.992 175.623 -2.631 19707 5264 1 11 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.207 -4.446 19707 5265 1 11 . 1 1 46 46 ARG CB C 46 27.952 27.952 29.127 -1.175 19707 5266 1 11 . 1 1 46 46 ARG H H 46 8.336 8.336 8.642 -0.306 19707 5267 1 11 . 1 1 47 47 ASP N N 47 118.676 118.676 115.431 3.245 19707 5268 1 11 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.654 -0.206 19707 5269 1 11 . 1 1 47 47 ASP C C 47 172.520 172.520 174.829 -2.309 19707 5270 1 11 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.299 -2.409 19707 5271 1 11 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.534 -4.877 19707 5272 1 11 . 1 1 47 47 ASP H H 47 8.313 8.313 8.032 0.281 19707 5273 1 11 . 1 1 48 48 ALA N N 48 120.922 120.922 122.984 -2.062 19707 5274 1 11 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.537 -0.168 19707 5275 1 11 . 1 1 48 48 ALA C C 48 174.295 174.295 177.216 -2.921 19707 5276 1 11 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.789 -2.152 19707 5277 1 11 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.669 -3.455 19707 5278 1 11 . 1 1 48 48 ALA H H 48 7.824 7.824 7.265 0.559 19707 5279 1 11 . 1 1 49 49 ARG N N 49 118.644 118.644 119.683 -1.039 19707 5280 1 11 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.007 0.335 19707 5281 1 11 . 1 1 49 49 ARG C C 49 172.504 172.504 176.429 -3.925 19707 5282 1 11 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.689 -3.780 19707 5283 1 11 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.450 -2.107 19707 5284 1 11 . 1 1 49 49 ARG H H 49 7.911 7.911 8.737 -0.826 19707 5285 1 11 . 1 1 50 50 TYR N N 50 119.470 119.470 114.339 5.131 19707 5286 1 11 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.001 0.290 19707 5287 1 11 . 1 1 50 50 TYR C C 50 170.470 170.470 174.282 -3.812 19707 5288 1 11 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.321 -2.053 19707 5289 1 11 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.407 -0.895 19707 5290 1 11 . 1 1 50 50 TYR H H 50 7.639 7.639 7.844 -0.205 19707 5291 1 11 . 1 1 51 51 ALA N N 51 127.418 127.418 125.254 2.164 19707 5292 1 11 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.172 0.049 19707 5293 1 11 . 1 1 51 51 ALA C C 51 171.328 171.328 175.349 -4.021 19707 5294 1 11 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.458 -3.025 19707 5295 1 11 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.693 -1.381 19707 5296 1 11 . 1 1 51 51 ALA H H 51 8.222 8.222 8.722 -0.500 19707 5297 1 11 . 1 1 52 52 VAL N N 52 117.832 117.832 122.146 -4.314 19707 5298 1 11 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.162 -0.495 19707 5299 1 11 . 1 1 52 52 VAL C C 52 172.436 172.436 174.178 -1.742 19707 5300 1 11 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.337 -3.580 19707 5301 1 11 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.500 -4.397 19707 5302 1 11 . 1 1 52 52 VAL H H 52 8.753 8.753 9.192 -0.439 19707 5303 1 11 . 1 1 53 53 ILE N N 53 128.027 128.027 126.062 1.965 19707 5304 1 11 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.659 0.183 19707 5305 1 11 . 1 1 53 53 ILE C C 53 172.110 172.110 174.021 -1.911 19707 5306 1 11 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.121 -2.368 19707 5307 1 11 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.488 -4.329 19707 5308 1 11 . 1 1 53 53 ILE H H 53 9.261 9.261 9.065 0.196 19707 5309 1 11 . 1 1 54 54 ARG N N 54 127.885 127.885 127.712 0.173 19707 5310 1 11 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.724 0.029 19707 5311 1 11 . 1 1 54 54 ARG C C 54 172.285 172.285 174.302 -2.017 19707 5312 1 11 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.593 -1.333 19707 5313 1 11 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.505 -2.613 19707 5314 1 11 . 1 1 54 54 ARG H H 54 8.686 8.686 8.899 -0.213 19707 5315 1 11 . 1 1 55 55 ILE N N 55 129.907 129.907 123.840 6.067 19707 5316 1 11 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.406 -0.253 19707 5317 1 11 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.747 -2.152 19707 5318 1 11 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.720 -2.107 19707 5319 1 11 . 1 1 55 55 ILE H H 55 9.292 9.292 8.382 0.910 19707 5320 1 11 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.442 -0.250 19707 5321 1 11 . 1 1 56 56 PRO C C 56 174.787 174.787 177.887 -3.100 19707 5322 1 11 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.781 -2.047 19707 5323 1 11 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.733 -2.820 19707 5324 1 11 . 1 1 57 57 GLY N N 57 111.828 111.828 110.883 0.945 19707 5325 1 11 . 1 1 57 57 GLY C C 57 171.039 171.039 173.642 -2.603 19707 5326 1 11 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.837 -2.020 19707 5327 1 11 . 1 1 57 57 GLY H H 57 8.708 8.708 8.734 -0.026 19707 5328 1 11 . 1 1 58 58 GLN N N 58 118.457 118.457 119.939 -1.482 19707 5329 1 11 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.807 0.093 19707 5330 1 11 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.041 -2.769 19707 5331 1 11 . 1 1 58 58 GLN CB C 58 27.154 27.154 30.161 -3.007 19707 5332 1 11 . 1 1 58 58 GLN H H 58 7.909 7.909 7.624 0.285 19707 5333 1 11 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.424 0.012 19707 5334 1 11 . 1 1 59 59 PRO C C 59 174.607 174.607 177.151 -2.544 19707 5335 1 11 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.798 -2.743 19707 5336 1 11 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.052 -2.875 19707 5337 1 11 . 1 1 60 60 VAL N N 60 122.695 122.695 121.185 1.510 19707 5338 1 11 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.182 -0.227 19707 5339 1 11 . 1 1 60 60 VAL C C 60 172.403 172.403 175.253 -2.850 19707 5340 1 11 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.954 -2.059 19707 5341 1 11 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.543 -2.901 19707 5342 1 11 . 1 1 60 60 VAL H H 60 8.364 8.364 8.346 0.018 19707 5343 1 11 . 1 1 61 61 VAL N N 61 126.097 126.097 128.319 -2.222 19707 5344 1 11 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.423 -0.123 19707 5345 1 11 . 1 1 61 61 VAL C C 61 170.891 170.891 174.285 -3.394 19707 5346 1 11 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.313 -2.499 19707 5347 1 11 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.506 -3.308 19707 5348 1 11 . 1 1 61 61 VAL H H 61 8.023 8.023 7.979 0.044 19707 5349 1 11 . 1 1 62 62 GLU N N 62 126.097 126.097 125.799 0.298 19707 5350 1 11 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.985 0.174 19707 5351 1 11 . 1 1 62 62 GLU C C 62 172.252 172.252 175.506 -3.254 19707 5352 1 11 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.309 -3.769 19707 5353 1 11 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.745 -2.445 19707 5354 1 11 . 1 1 62 62 GLU H H 62 8.591 8.591 8.540 0.051 19707 5355 1 11 . 1 1 63 63 VAL N N 63 120.374 120.374 124.044 -3.670 19707 5356 1 11 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.278 0.115 19707 5357 1 11 . 1 1 63 63 VAL C C 63 171.040 171.040 176.379 -5.339 19707 5358 1 11 . 1 1 63 63 VAL CA C 63 57.833 57.833 62.051 -4.218 19707 5359 1 11 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.981 -0.404 19707 5360 1 11 . 1 1 63 63 VAL H H 63 8.732 8.732 8.899 -0.167 19707 5361 1 11 . 1 1 64 64 GLY N N 64 109.935 109.935 113.337 -3.402 19707 5362 1 11 . 1 1 64 64 GLY C C 64 171.656 171.656 173.671 -2.015 19707 5363 1 11 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.332 -5.155 19707 5364 1 11 . 1 1 64 64 GLY H H 64 8.259 8.259 8.583 -0.324 19707 5365 1 11 . 1 1 65 65 THR N N 65 115.478 115.478 114.956 0.522 19707 5366 1 11 . 1 1 65 65 THR HA H 65 4.342 4.342 4.318 0.024 19707 5367 1 11 . 1 1 65 65 THR C C 65 170.663 170.663 172.813 -2.150 19707 5368 1 11 . 1 1 65 65 THR CA C 65 58.357 58.357 60.267 -1.910 19707 5369 1 11 . 1 1 65 65 THR CB C 65 67.923 67.923 70.907 -2.984 19707 5370 1 11 . 1 1 65 65 THR H H 65 8.123 8.123 7.736 0.387 19707 5371 1 11 . 1 1 66 66 LYS N N 66 130.775 130.775 124.277 6.498 19707 5372 1 11 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.203 -1.273 19707 5373 1 11 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.887 -2.697 19707 5374 1 11 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.752 -3.062 19707 5375 1 11 . 1 1 66 66 LYS H H 66 8.472 8.472 8.205 0.267 19707 5376 1 11 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.626 -0.215 19707 5377 1 11 . 1 1 67 67 PRO C C 67 173.211 173.211 176.660 -3.449 19707 5378 1 11 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.382 -2.816 19707 5379 1 11 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.509 -3.106 19707 5380 1 11 . 1 1 68 68 THR N N 68 111.983 111.983 114.064 -2.081 19707 5381 1 11 . 1 1 68 68 THR HA H 68 4.277 4.277 4.272 0.005 19707 5382 1 11 . 1 1 68 68 THR C C 68 171.720 171.720 175.730 -4.010 19707 5383 1 11 . 1 1 68 68 THR CA C 68 58.193 58.193 63.035 -4.843 19707 5384 1 11 . 1 1 68 68 THR CB C 68 67.723 67.723 69.235 -1.512 19707 5385 1 11 . 1 1 68 68 THR H H 68 8.091 8.091 8.241 -0.150 19707 5386 1 11 . 1 1 69 69 GLY N N 69 109.918 109.918 108.453 1.465 19707 5387 1 11 . 1 1 69 69 GLY C C 69 170.783 170.783 174.561 -3.778 19707 5388 1 11 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.727 -2.671 19707 5389 1 11 . 1 1 69 69 GLY H H 69 8.119 8.119 8.030 0.088 19707 5390 1 11 . 1 1 70 70 ASP N N 70 123.294 123.294 124.332 -1.038 19707 5391 1 11 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.877 -0.328 19707 5392 1 11 . 1 1 70 70 ASP C C 70 173.651 173.651 175.035 -1.384 19707 5393 1 11 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.593 -2.732 19707 5394 1 11 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.668 -1.935 19707 5395 1 11 . 1 1 70 70 ASP H H 70 8.444 8.444 8.611 -0.167 19707 5396 1 11 . 1 1 71 71 VAL N N 71 117.772 117.772 113.851 3.921 19707 5397 1 11 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.050 -0.343 19707 5398 1 11 . 1 1 71 71 VAL C C 71 172.992 172.992 174.283 -1.291 19707 5399 1 11 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.131 -1.755 19707 5400 1 11 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.270 -2.248 19707 5401 1 11 . 1 1 71 71 VAL H H 71 8.173 8.173 7.665 0.508 19707 5402 1 11 . 1 1 72 72 LEU N N 72 123.435 123.435 122.985 0.450 19707 5403 1 11 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.450 0.186 19707 5404 1 11 . 1 1 72 72 LEU C C 72 173.189 173.189 176.315 -3.126 19707 5405 1 11 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.826 -3.619 19707 5406 1 11 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.879 -1.241 19707 5407 1 11 . 1 1 72 72 LEU H H 72 8.859 8.859 8.841 0.018 19707 5408 1 11 . 1 1 73 73 GLN N N 73 119.520 119.520 121.213 -1.693 19707 5409 1 11 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.080 0.265 19707 5410 1 11 . 1 1 73 73 GLN C C 73 172.249 172.249 175.676 -3.427 19707 5411 1 11 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.618 -3.285 19707 5412 1 11 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.118 -1.348 19707 5413 1 11 . 1 1 73 73 GLN H H 73 9.196 9.196 8.270 0.926 19707 5414 1 11 . 1 1 74 74 GLY N N 74 113.513 113.513 111.791 1.722 19707 5415 1 11 . 1 1 74 74 GLY C C 74 169.072 169.072 172.134 -3.062 19707 5416 1 11 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.926 -2.629 19707 5417 1 11 . 1 1 74 74 GLY H H 74 9.373 9.373 9.166 0.207 19707 5418 1 11 . 1 1 75 75 ARG N N 75 122.479 122.479 122.474 0.005 19707 5419 1 11 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.432 0.070 19707 5420 1 11 . 1 1 75 75 ARG C C 75 172.348 172.348 174.076 -1.728 19707 5421 1 11 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.515 -3.757 19707 5422 1 11 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.426 -2.608 19707 5423 1 11 . 1 1 75 75 ARG H H 75 8.615 8.615 8.382 0.233 19707 5424 1 11 . 1 1 76 76 ALA N N 76 122.346 122.346 126.956 -4.610 19707 5425 1 11 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.787 -0.251 19707 5426 1 11 . 1 1 76 76 ALA C C 76 172.704 172.704 174.462 -1.758 19707 5427 1 11 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.734 -2.707 19707 5428 1 11 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.863 -2.838 19707 5429 1 11 . 1 1 76 76 ALA H H 76 8.590 8.590 9.005 -0.415 19707 5430 1 11 . 1 1 77 77 THR N N 77 116.961 116.961 115.951 1.010 19707 5431 1 11 . 1 1 77 77 THR HA H 77 4.988 4.988 5.185 -0.197 19707 5432 1 11 . 1 1 77 77 THR C C 77 172.800 172.800 174.491 -1.691 19707 5433 1 11 . 1 1 77 77 THR CA C 77 58.344 58.344 60.935 -2.591 19707 5434 1 11 . 1 1 77 77 THR CB C 77 67.712 67.712 71.161 -3.449 19707 5435 1 11 . 1 1 77 77 THR H H 77 8.491 8.491 8.278 0.213 19707 5436 1 11 . 1 1 78 78 GLY N N 78 111.103 111.103 113.340 -2.237 19707 5437 1 11 . 1 1 78 78 GLY C C 78 172.567 172.567 175.204 -2.637 19707 5438 1 11 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.987 -2.679 19707 5439 1 11 . 1 1 78 78 GLY H H 78 8.649 8.649 9.348 -0.699 19707 5440 1 11 . 1 1 79 79 GLU N N 79 123.423 123.423 120.205 3.218 19707 5441 1 11 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.092 -0.096 19707 5442 1 11 . 1 1 79 79 GLU C C 79 175.466 175.466 177.798 -2.332 19707 5443 1 11 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.886 -3.426 19707 5444 1 11 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.782 -3.715 19707 5445 1 11 . 1 1 79 79 GLU H H 79 10.375 10.375 9.032 1.343 19707 5446 1 11 . 1 1 80 80 GLU N N 80 113.846 113.846 116.623 -2.777 19707 5447 1 11 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.307 0.051 19707 5448 1 11 . 1 1 80 80 GLU C C 80 173.293 173.293 177.023 -3.730 19707 5449 1 11 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.995 -4.219 19707 5450 1 11 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.532 -4.801 19707 5451 1 11 . 1 1 80 80 GLU H H 80 7.679 7.679 8.189 -0.510 19707 5452 1 11 . 1 1 81 81 GLY N N 81 105.493 105.493 108.697 -3.204 19707 5453 1 11 . 1 1 81 81 GLY C C 81 170.427 170.427 174.328 -3.901 19707 5454 1 11 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.239 -2.627 19707 5455 1 11 . 1 1 81 81 GLY H H 81 7.476 7.476 7.816 -0.340 19707 5456 1 11 . 1 1 82 82 GLU N N 82 122.160 122.160 119.049 3.111 19707 5457 1 11 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.459 0.495 19707 5458 1 11 . 1 1 82 82 GLU C C 82 171.004 171.004 174.906 -3.902 19707 5459 1 11 . 1 1 82 82 GLU CA C 82 51.321 51.321 54.992 -3.671 19707 5460 1 11 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.099 -5.033 19707 5461 1 11 . 1 1 82 82 GLU H H 82 9.585 9.585 8.023 1.562 19707 5462 1 11 . 1 1 83 83 THR N N 83 114.756 114.756 115.106 -0.350 19707 5463 1 11 . 1 1 83 83 THR HA H 83 4.990 4.990 5.143 -0.153 19707 5464 1 11 . 1 1 83 83 THR C C 83 170.909 170.909 172.953 -2.044 19707 5465 1 11 . 1 1 83 83 THR CA C 83 57.957 57.957 62.067 -4.110 19707 5466 1 11 . 1 1 83 83 THR CB C 83 68.271 68.271 71.503 -3.232 19707 5467 1 11 . 1 1 83 83 THR H H 83 8.490 8.490 8.120 0.370 19707 5468 1 11 . 1 1 84 84 VAL N N 84 122.639 122.639 126.110 -3.471 19707 5469 1 11 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.790 -0.135 19707 5470 1 11 . 1 1 84 84 VAL C C 84 170.962 170.962 173.984 -3.022 19707 5471 1 11 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.871 -2.574 19707 5472 1 11 . 1 1 84 84 VAL CB C 84 32.224 32.224 33.891 -1.667 19707 5473 1 11 . 1 1 84 84 VAL H H 84 9.001 9.001 9.060 -0.059 19707 5474 1 11 . 1 1 85 85 LEU N N 85 129.903 129.903 128.190 1.713 19707 5475 1 11 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.398 -0.006 19707 5476 1 11 . 1 1 85 85 LEU C C 85 172.346 172.346 174.610 -2.264 19707 5477 1 11 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.349 -2.553 19707 5478 1 11 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.636 -4.121 19707 5479 1 11 . 1 1 85 85 LEU H H 85 8.610 8.610 9.012 -0.402 19707 5480 1 11 . 1 1 86 86 VAL N N 86 122.778 122.778 124.612 -1.834 19707 5481 1 11 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.903 0.138 19707 5482 1 11 . 1 1 86 86 VAL C C 86 172.570 172.570 174.600 -2.030 19707 5483 1 11 . 1 1 86 86 VAL CA C 86 57.200 57.200 60.965 -3.765 19707 5484 1 11 . 1 1 86 86 VAL CB C 86 32.275 32.275 34.707 -2.432 19707 5485 1 11 . 1 1 86 86 VAL H H 86 9.228 9.228 9.142 0.086 19707 5486 1 11 . 1 1 87 87 GLU N N 87 120.437 120.437 126.447 -6.010 19707 5487 1 11 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.533 0.198 19707 5488 1 11 . 1 1 87 87 GLU C C 87 172.267 172.267 174.998 -2.731 19707 5489 1 11 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.562 -3.213 19707 5490 1 11 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.861 -2.736 19707 5491 1 11 . 1 1 87 87 GLU H H 87 8.851 8.851 9.243 -0.392 19707 5492 1 11 . 1 1 88 88 GLU N N 88 118.525 118.525 122.272 -3.747 19707 5493 1 11 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.767 0.234 19707 5494 1 11 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.133 -3.216 19707 5495 1 11 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.995 -3.048 19707 5496 1 11 . 1 1 88 88 GLU H H 88 8.380 8.380 8.570 -0.190 19707 5497 1 11 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.371 0.158 19707 5498 1 11 . 1 1 89 89 PRO C C 89 172.774 172.774 176.683 -3.909 19707 5499 1 11 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.259 -2.878 19707 5500 1 11 . 1 1 89 89 PRO CB C 89 29.334 29.334 31.995 -2.661 19707 5501 1 12 . 1 1 2 2 SER N N 2 115.963 115.963 116.653 -0.690 19707 5502 1 12 . 1 1 2 2 SER HA H 2 4.408 4.408 4.260 0.148 19707 5503 1 12 . 1 1 2 2 SER C C 2 171.788 171.788 173.347 -1.559 19707 5504 1 12 . 1 1 2 2 SER CA C 2 55.870 55.870 59.023 -3.153 19707 5505 1 12 . 1 1 2 2 SER CB C 2 61.022 61.022 63.077 -2.055 19707 5506 1 12 . 1 1 2 2 SER H H 2 8.661 8.661 8.369 0.292 19707 5507 1 12 . 1 1 3 3 GLU N N 3 122.941 122.941 120.328 2.613 19707 5508 1 12 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.562 -0.242 19707 5509 1 12 . 1 1 3 3 GLU C C 3 173.817 173.817 175.956 -2.139 19707 5510 1 12 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.526 -1.572 19707 5511 1 12 . 1 1 3 3 GLU CB C 3 26.837 26.837 31.087 -4.250 19707 5512 1 12 . 1 1 3 3 GLU H H 3 8.706 8.706 8.012 0.694 19707 5513 1 12 . 1 1 4 4 THR N N 4 116.182 116.182 117.453 -1.271 19707 5514 1 12 . 1 1 4 4 THR HA H 4 4.233 4.233 4.248 -0.015 19707 5515 1 12 . 1 1 4 4 THR C C 4 171.719 171.719 175.238 -3.519 19707 5516 1 12 . 1 1 4 4 THR CA C 4 59.414 59.414 62.859 -3.445 19707 5517 1 12 . 1 1 4 4 THR CB C 4 67.009 67.009 69.524 -2.515 19707 5518 1 12 . 1 1 4 4 THR H H 4 8.165 8.165 8.378 -0.213 19707 5519 1 12 . 1 1 5 5 ARG N N 5 124.184 124.184 123.051 1.133 19707 5520 1 12 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.098 0.262 19707 5521 1 12 . 1 1 5 5 ARG C C 5 173.520 173.520 175.844 -2.324 19707 5522 1 12 . 1 1 5 5 ARG CA C 5 53.343 53.343 57.416 -4.073 19707 5523 1 12 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.587 -2.422 19707 5524 1 12 . 1 1 5 5 ARG H H 5 8.354 8.354 8.657 -0.303 19707 5525 1 12 . 1 1 6 6 THR N N 6 116.652 116.652 117.546 -0.894 19707 5526 1 12 . 1 1 6 6 THR HA H 6 4.263 4.263 4.547 -0.284 19707 5527 1 12 . 1 1 6 6 THR C C 6 171.784 171.784 172.609 -0.825 19707 5528 1 12 . 1 1 6 6 THR CA C 6 59.218 59.218 61.398 -2.180 19707 5529 1 12 . 1 1 6 6 THR CB C 6 67.213 67.213 70.252 -3.039 19707 5530 1 12 . 1 1 6 6 THR H H 6 8.224 8.224 8.264 -0.040 19707 5531 1 12 . 1 1 7 7 ILE N N 7 123.882 123.882 124.118 -0.236 19707 5532 1 12 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.579 -0.441 19707 5533 1 12 . 1 1 7 7 ILE C C 7 173.572 173.572 175.588 -2.016 19707 5534 1 12 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.792 -2.310 19707 5535 1 12 . 1 1 7 7 ILE CB C 7 36.069 36.069 40.529 -4.460 19707 5536 1 12 . 1 1 7 7 ILE H H 7 8.247 8.247 8.302 -0.055 19707 5537 1 12 . 1 1 8 8 SER N N 8 120.287 120.287 121.592 -1.305 19707 5538 1 12 . 1 1 8 8 SER HA H 8 4.445 4.445 4.479 -0.034 19707 5539 1 12 . 1 1 8 8 SER C C 8 171.926 171.926 173.846 -1.920 19707 5540 1 12 . 1 1 8 8 SER CA C 8 55.522 55.522 58.282 -2.760 19707 5541 1 12 . 1 1 8 8 SER CB C 8 61.073 61.073 64.061 -2.988 19707 5542 1 12 . 1 1 8 8 SER H H 8 8.402 8.402 8.304 0.098 19707 5543 1 12 . 1 1 9 9 SER N N 9 118.425 118.425 116.283 2.142 19707 5544 1 12 . 1 1 9 9 SER HA H 9 4.525 4.525 4.810 -0.285 19707 5545 1 12 . 1 1 9 9 SER C C 9 172.663 172.663 173.836 -1.173 19707 5546 1 12 . 1 1 9 9 SER CA C 9 55.897 55.897 58.299 -2.402 19707 5547 1 12 . 1 1 9 9 SER CB C 9 61.375 61.375 63.849 -2.474 19707 5548 1 12 . 1 1 9 9 SER H H 9 8.362 8.362 8.733 -0.371 19707 5549 1 12 . 1 1 10 10 THR N N 10 115.676 115.676 113.181 2.495 19707 5550 1 12 . 1 1 10 10 THR HA H 10 4.232 4.232 4.549 -0.317 19707 5551 1 12 . 1 1 10 10 THR C C 10 173.070 173.070 175.409 -2.339 19707 5552 1 12 . 1 1 10 10 THR CA C 10 60.318 60.318 62.479 -2.161 19707 5553 1 12 . 1 1 10 10 THR CB C 10 67.205 67.205 69.583 -2.378 19707 5554 1 12 . 1 1 10 10 THR H H 10 8.274 8.274 7.544 0.730 19707 5555 1 12 . 1 1 11 11 ALA N N 11 124.726 124.726 124.525 0.201 19707 5556 1 12 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.132 -0.145 19707 5557 1 12 . 1 1 11 11 ALA C C 11 176.825 176.825 179.362 -2.537 19707 5558 1 12 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.061 -2.520 19707 5559 1 12 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.329 -2.440 19707 5560 1 12 . 1 1 11 11 ALA H H 11 8.347 8.347 8.287 0.060 19707 5561 1 12 . 1 1 12 12 GLN N N 12 117.915 117.915 117.780 0.135 19707 5562 1 12 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.066 -0.277 19707 5563 1 12 . 1 1 12 12 GLN C C 12 174.697 174.697 177.113 -2.416 19707 5564 1 12 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.139 -3.135 19707 5565 1 12 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.445 -2.220 19707 5566 1 12 . 1 1 12 12 GLN H H 12 8.194 8.194 7.808 0.386 19707 5567 1 12 . 1 1 13 13 GLU N N 13 118.510 118.510 119.432 -0.922 19707 5568 1 12 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.083 0.020 19707 5569 1 12 . 1 1 13 13 GLU C C 13 176.192 176.192 179.004 -2.812 19707 5570 1 12 . 1 1 13 13 GLU CA C 13 56.315 56.315 59.074 -2.759 19707 5571 1 12 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.448 -3.415 19707 5572 1 12 . 1 1 13 13 GLU H H 13 7.917 7.917 8.447 -0.530 19707 5573 1 12 . 1 1 14 14 ARG N N 14 118.193 118.193 120.018 -1.825 19707 5574 1 12 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.070 -0.102 19707 5575 1 12 . 1 1 14 14 ARG C C 14 176.764 176.764 178.601 -1.837 19707 5576 1 12 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.066 -1.783 19707 5577 1 12 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.651 -2.414 19707 5578 1 12 . 1 1 14 14 ARG H H 14 7.907 7.907 8.371 -0.464 19707 5579 1 12 . 1 1 15 15 VAL N N 15 117.991 117.991 114.451 3.540 19707 5580 1 12 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.880 0.023 19707 5581 1 12 . 1 1 15 15 VAL C C 15 174.922 174.922 177.572 -2.650 19707 5582 1 12 . 1 1 15 15 VAL CA C 15 62.831 62.831 65.004 -2.173 19707 5583 1 12 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.337 -2.615 19707 5584 1 12 . 1 1 15 15 VAL H H 15 7.658 7.658 7.527 0.131 19707 5585 1 12 . 1 1 16 16 ASP N N 16 124.314 124.314 121.154 3.160 19707 5586 1 12 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.536 -0.220 19707 5587 1 12 . 1 1 16 16 ASP C C 16 176.462 176.462 177.899 -1.437 19707 5588 1 12 . 1 1 16 16 ASP CA C 16 55.326 55.326 56.882 -1.556 19707 5589 1 12 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.330 -4.661 19707 5590 1 12 . 1 1 16 16 ASP H H 16 8.291 8.291 7.862 0.429 19707 5591 1 12 . 1 1 17 17 LEU N N 17 120.212 120.212 119.611 0.601 19707 5592 1 12 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.013 0.041 19707 5593 1 12 . 1 1 17 17 LEU C C 17 177.171 177.171 178.905 -1.734 19707 5594 1 12 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.984 -3.005 19707 5595 1 12 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.762 -2.917 19707 5596 1 12 . 1 1 17 17 LEU H H 17 8.172 8.172 7.560 0.612 19707 5597 1 12 . 1 1 18 18 GLU N N 18 120.587 120.587 118.937 1.650 19707 5598 1 12 . 1 1 18 18 GLU HA H 18 4.193 4.193 4.023 0.170 19707 5599 1 12 . 1 1 18 18 GLU C C 18 175.997 175.997 178.633 -2.636 19707 5600 1 12 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.351 -3.249 19707 5601 1 12 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.861 -2.789 19707 5602 1 12 . 1 1 18 18 GLU H H 18 7.876 7.876 8.064 -0.188 19707 5603 1 12 . 1 1 19 19 ALA N N 19 121.800 121.800 123.255 -1.455 19707 5604 1 12 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.090 -0.299 19707 5605 1 12 . 1 1 19 19 ALA C C 19 175.708 175.708 179.618 -3.910 19707 5606 1 12 . 1 1 19 19 ALA CA C 19 52.852 52.852 55.047 -2.196 19707 5607 1 12 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.451 -4.297 19707 5608 1 12 . 1 1 19 19 ALA H H 19 7.792 7.792 7.486 0.306 19707 5609 1 12 . 1 1 20 20 VAL N N 20 118.680 118.680 119.262 -0.582 19707 5610 1 12 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.717 -0.417 19707 5611 1 12 . 1 1 20 20 VAL C C 20 176.276 176.276 178.161 -1.885 19707 5612 1 12 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.347 -2.540 19707 5613 1 12 . 1 1 20 20 VAL CB C 20 29.551 29.551 30.995 -1.444 19707 5614 1 12 . 1 1 20 20 VAL H H 20 7.712 7.712 8.260 -0.548 19707 5615 1 12 . 1 1 21 21 ARG N N 21 121.935 121.935 120.909 1.026 19707 5616 1 12 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.081 -0.086 19707 5617 1 12 . 1 1 21 21 ARG C C 21 176.828 176.828 178.782 -1.954 19707 5618 1 12 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.476 -1.816 19707 5619 1 12 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.545 -2.255 19707 5620 1 12 . 1 1 21 21 ARG H H 21 8.444 8.444 8.348 0.096 19707 5621 1 12 . 1 1 22 22 LEU N N 22 119.327 119.327 119.600 -0.273 19707 5622 1 12 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.092 -0.097 19707 5623 1 12 . 1 1 22 22 LEU C C 22 175.664 175.664 178.607 -2.943 19707 5624 1 12 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.223 -3.355 19707 5625 1 12 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.554 -2.419 19707 5626 1 12 . 1 1 22 22 LEU H H 22 8.248 8.248 8.349 -0.101 19707 5627 1 12 . 1 1 23 23 ALA N N 23 121.202 121.202 122.096 -0.894 19707 5628 1 12 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.945 -0.210 19707 5629 1 12 . 1 1 23 23 ALA C C 23 175.492 175.492 179.604 -4.112 19707 5630 1 12 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.373 -2.304 19707 5631 1 12 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.019 -3.952 19707 5632 1 12 . 1 1 23 23 ALA H H 23 8.392 8.392 8.625 -0.233 19707 5633 1 12 . 1 1 24 24 SER N N 24 112.377 112.377 114.701 -2.324 19707 5634 1 12 . 1 1 24 24 SER HA H 24 4.214 4.214 4.232 -0.018 19707 5635 1 12 . 1 1 24 24 SER C C 24 174.773 174.773 176.381 -1.608 19707 5636 1 12 . 1 1 24 24 SER CA C 24 59.258 59.258 62.546 -3.288 19707 5637 1 12 . 1 1 24 24 SER CB C 24 60.149 60.149 63.126 -2.977 19707 5638 1 12 . 1 1 24 24 SER H H 24 7.690 7.690 7.923 -0.233 19707 5639 1 12 . 1 1 25 25 ILE N N 25 123.886 123.886 122.283 1.603 19707 5640 1 12 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.955 -0.113 19707 5641 1 12 . 1 1 25 25 ILE C C 25 176.487 176.487 178.103 -1.616 19707 5642 1 12 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.644 -0.651 19707 5643 1 12 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.469 -0.537 19707 5644 1 12 . 1 1 25 25 ILE H H 25 7.837 7.837 8.135 -0.298 19707 5645 1 12 . 1 1 26 26 VAL N N 26 122.538 122.538 120.807 1.731 19707 5646 1 12 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.724 -0.336 19707 5647 1 12 . 1 1 26 26 VAL C C 26 174.624 174.624 177.796 -3.172 19707 5648 1 12 . 1 1 26 26 VAL CA C 26 64.915 64.915 66.990 -2.075 19707 5649 1 12 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.184 -3.289 19707 5650 1 12 . 1 1 26 26 VAL H H 26 8.804 8.804 8.654 0.150 19707 5651 1 12 . 1 1 27 27 ASP N N 27 120.433 120.433 120.500 -0.067 19707 5652 1 12 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.292 -0.128 19707 5653 1 12 . 1 1 27 27 ASP C C 27 174.966 174.966 178.576 -3.610 19707 5654 1 12 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.533 -2.204 19707 5655 1 12 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.653 -2.799 19707 5656 1 12 . 1 1 27 27 ASP H H 27 8.719 8.719 8.236 0.483 19707 5657 1 12 . 1 1 28 28 SER N N 28 112.397 112.397 115.240 -2.843 19707 5658 1 12 . 1 1 28 28 SER HA H 28 4.073 4.073 4.159 -0.086 19707 5659 1 12 . 1 1 28 28 SER C C 28 174.405 174.405 176.720 -2.315 19707 5660 1 12 . 1 1 28 28 SER CA C 28 59.115 59.115 61.201 -2.086 19707 5661 1 12 . 1 1 28 28 SER CB C 28 60.125 60.125 63.230 -3.104 19707 5662 1 12 . 1 1 28 28 SER H H 28 7.599 7.599 7.948 -0.349 19707 5663 1 12 . 1 1 29 29 ARG N N 29 123.945 123.945 122.542 1.403 19707 5664 1 12 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.932 0.095 19707 5665 1 12 . 1 1 29 29 ARG C C 29 175.902 175.902 177.995 -2.093 19707 5666 1 12 . 1 1 29 29 ARG CA C 29 54.274 54.274 58.092 -3.818 19707 5667 1 12 . 1 1 29 29 ARG CB C 29 27.740 27.740 28.864 -1.124 19707 5668 1 12 . 1 1 29 29 ARG H H 29 7.769 7.769 7.490 0.279 19707 5669 1 12 . 1 1 30 30 LEU N N 30 121.580 121.580 120.304 1.276 19707 5670 1 12 . 1 1 30 30 LEU HA H 30 3.749 3.749 4.055 -0.306 19707 5671 1 12 . 1 1 30 30 LEU C C 30 177.474 177.474 179.677 -2.203 19707 5672 1 12 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.768 -2.455 19707 5673 1 12 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.800 -2.771 19707 5674 1 12 . 1 1 30 30 LEU H H 30 8.665 8.665 8.303 0.362 19707 5675 1 12 . 1 1 31 31 ILE N N 31 119.330 119.330 117.491 1.839 19707 5676 1 12 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.754 -0.063 19707 5677 1 12 . 1 1 31 31 ILE C C 31 175.341 175.341 177.788 -2.447 19707 5678 1 12 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.035 -2.523 19707 5679 1 12 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.906 -2.339 19707 5680 1 12 . 1 1 31 31 ILE H H 31 8.226 8.226 8.350 -0.124 19707 5681 1 12 . 1 1 32 32 GLY N N 32 106.092 106.092 106.024 0.068 19707 5682 1 12 . 1 1 32 32 GLY C C 32 172.413 172.413 175.191 -2.778 19707 5683 1 12 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.768 -3.271 19707 5684 1 12 . 1 1 32 32 GLY H H 32 7.767 7.767 7.829 -0.062 19707 5685 1 12 . 1 1 33 33 THR N N 33 110.966 110.966 112.968 -2.002 19707 5686 1 12 . 1 1 33 33 THR HA H 33 4.455 4.455 4.367 0.088 19707 5687 1 12 . 1 1 33 33 THR C C 33 172.714 172.714 174.942 -2.228 19707 5688 1 12 . 1 1 33 33 THR CA C 33 60.032 60.032 62.836 -2.804 19707 5689 1 12 . 1 1 33 33 THR CB C 33 68.287 68.287 70.087 -1.800 19707 5690 1 12 . 1 1 33 33 THR H H 33 8.102 8.102 7.843 0.259 19707 5691 1 12 . 1 1 34 34 GLY N N 34 110.320 110.320 111.150 -0.830 19707 5692 1 12 . 1 1 34 34 GLY C C 34 170.505 170.505 173.614 -3.109 19707 5693 1 12 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.102 -2.519 19707 5694 1 12 . 1 1 34 34 GLY H H 34 8.072 8.072 8.088 -0.016 19707 5695 1 12 . 1 1 35 35 SER N N 35 112.944 112.944 115.906 -2.962 19707 5696 1 12 . 1 1 35 35 SER HA H 35 4.385 4.385 4.912 -0.527 19707 5697 1 12 . 1 1 35 35 SER C C 35 169.537 169.537 172.967 -3.430 19707 5698 1 12 . 1 1 35 35 SER CA C 35 54.794 54.794 57.699 -2.905 19707 5699 1 12 . 1 1 35 35 SER CB C 35 62.029 62.029 65.982 -3.953 19707 5700 1 12 . 1 1 35 35 SER H H 35 7.719 7.719 7.699 0.020 19707 5701 1 12 . 1 1 36 36 VAL N N 36 118.566 118.566 124.340 -5.774 19707 5702 1 12 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.079 -0.046 19707 5703 1 12 . 1 1 36 36 VAL C C 36 169.876 169.876 174.729 -4.853 19707 5704 1 12 . 1 1 36 36 VAL CA C 36 58.565 58.565 61.272 -2.707 19707 5705 1 12 . 1 1 36 36 VAL CB C 36 30.952 30.952 32.507 -1.555 19707 5706 1 12 . 1 1 36 36 VAL H H 36 8.490 8.490 8.343 0.147 19707 5707 1 12 . 1 1 37 37 ASP N N 37 121.640 121.640 124.577 -2.937 19707 5708 1 12 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.900 -0.098 19707 5709 1 12 . 1 1 37 37 ASP C C 37 172.806 172.806 176.545 -3.739 19707 5710 1 12 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.903 -3.860 19707 5711 1 12 . 1 1 37 37 ASP CB C 37 40.206 40.206 44.119 -3.913 19707 5712 1 12 . 1 1 37 37 ASP H H 37 7.195 7.195 8.480 -1.285 19707 5713 1 12 . 1 1 38 38 GLU N N 38 120.018 120.018 121.307 -1.289 19707 5714 1 12 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.895 -0.238 19707 5715 1 12 . 1 1 38 38 GLU C C 38 174.753 174.753 177.587 -2.834 19707 5716 1 12 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.278 -2.786 19707 5717 1 12 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.805 -3.726 19707 5718 1 12 . 1 1 38 38 GLU H H 38 8.908 8.908 8.910 -0.002 19707 5719 1 12 . 1 1 39 39 ASP N N 39 118.668 118.668 117.733 0.935 19707 5720 1 12 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.463 -0.217 19707 5721 1 12 . 1 1 39 39 ASP C C 39 175.393 175.393 177.648 -2.255 19707 5722 1 12 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.383 -1.519 19707 5723 1 12 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.502 -3.532 19707 5724 1 12 . 1 1 39 39 ASP H H 39 8.242 8.242 8.625 -0.383 19707 5725 1 12 . 1 1 40 40 PHE N N 40 119.851 119.851 119.021 0.830 19707 5726 1 12 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.447 -0.243 19707 5727 1 12 . 1 1 40 40 PHE C C 40 174.929 174.929 175.964 -1.035 19707 5728 1 12 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.463 -2.292 19707 5729 1 12 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.924 -3.091 19707 5730 1 12 . 1 1 40 40 PHE H H 40 8.037 8.037 7.836 0.201 19707 5731 1 12 . 1 1 41 41 LEU N N 41 117.882 117.882 118.189 -0.307 19707 5732 1 12 . 1 1 41 41 LEU HA H 41 3.522 3.522 3.970 -0.448 19707 5733 1 12 . 1 1 41 41 LEU C C 41 175.938 175.938 178.663 -2.725 19707 5734 1 12 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.574 -1.714 19707 5735 1 12 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.233 -3.002 19707 5736 1 12 . 1 1 41 41 LEU H H 41 7.816 7.816 7.593 0.223 19707 5737 1 12 . 1 1 42 42 ARG N N 42 118.360 118.360 119.157 -0.797 19707 5738 1 12 . 1 1 42 42 ARG HA H 42 3.740 3.740 3.955 -0.215 19707 5739 1 12 . 1 1 42 42 ARG C C 42 175.435 175.435 176.932 -1.497 19707 5740 1 12 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.035 -2.064 19707 5741 1 12 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.973 -2.709 19707 5742 1 12 . 1 1 42 42 ARG H H 42 8.540 8.540 8.047 0.493 19707 5743 1 12 . 1 1 43 43 GLU N N 43 114.947 114.947 116.603 -1.656 19707 5744 1 12 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.282 -0.232 19707 5745 1 12 . 1 1 43 43 GLU C C 43 174.518 174.518 177.064 -2.546 19707 5746 1 12 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.175 -2.604 19707 5747 1 12 . 1 1 43 43 GLU CB C 43 26.041 26.041 28.897 -2.856 19707 5748 1 12 . 1 1 43 43 GLU H H 43 7.223 7.223 8.208 -0.985 19707 5749 1 12 . 1 1 44 44 GLN N N 44 114.109 114.109 116.850 -2.741 19707 5750 1 12 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.296 -0.190 19707 5751 1 12 . 1 1 44 44 GLN C C 44 173.777 173.777 177.420 -3.643 19707 5752 1 12 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.435 -3.254 19707 5753 1 12 . 1 1 44 44 GLN CB C 44 25.870 25.870 30.091 -4.221 19707 5754 1 12 . 1 1 44 44 GLN H H 44 7.372 7.372 8.010 -0.638 19707 5755 1 12 . 1 1 45 45 ILE N N 45 117.470 117.470 115.342 2.128 19707 5756 1 12 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.754 0.194 19707 5757 1 12 . 1 1 45 45 ILE C C 45 172.305 172.305 176.448 -4.143 19707 5758 1 12 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.965 -5.460 19707 5759 1 12 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.981 -2.281 19707 5760 1 12 . 1 1 45 45 ILE H H 45 7.235 7.235 7.403 -0.168 19707 5761 1 12 . 1 1 46 46 ARG N N 46 122.996 122.996 113.942 9.054 19707 5762 1 12 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.940 0.250 19707 5763 1 12 . 1 1 46 46 ARG C C 46 172.992 172.992 175.219 -2.227 19707 5764 1 12 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.251 -4.490 19707 5765 1 12 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.137 -0.185 19707 5766 1 12 . 1 1 46 46 ARG H H 46 8.336 8.336 8.500 -0.164 19707 5767 1 12 . 1 1 47 47 ASP N N 47 118.676 118.676 117.584 1.092 19707 5768 1 12 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.585 -0.137 19707 5769 1 12 . 1 1 47 47 ASP C C 47 172.520 172.520 174.856 -2.336 19707 5770 1 12 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.600 -2.710 19707 5771 1 12 . 1 1 47 47 ASP CB C 47 37.657 37.657 41.879 -4.222 19707 5772 1 12 . 1 1 47 47 ASP H H 47 8.313 8.313 7.963 0.350 19707 5773 1 12 . 1 1 48 48 ALA N N 48 120.922 120.922 123.890 -2.968 19707 5774 1 12 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.137 0.232 19707 5775 1 12 . 1 1 48 48 ALA C C 48 174.295 174.295 177.683 -3.388 19707 5776 1 12 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.781 -3.144 19707 5777 1 12 . 1 1 48 48 ALA CB C 48 16.214 16.214 18.915 -2.701 19707 5778 1 12 . 1 1 48 48 ALA H H 48 7.824 7.824 7.949 -0.125 19707 5779 1 12 . 1 1 49 49 ARG N N 49 118.644 118.644 125.207 -6.563 19707 5780 1 12 . 1 1 49 49 ARG HA H 49 4.342 4.342 3.896 0.446 19707 5781 1 12 . 1 1 49 49 ARG C C 49 172.504 172.504 176.013 -3.509 19707 5782 1 12 . 1 1 49 49 ARG CA C 49 53.909 53.909 58.024 -4.115 19707 5783 1 12 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.633 -2.290 19707 5784 1 12 . 1 1 49 49 ARG H H 49 7.911 7.911 8.221 -0.310 19707 5785 1 12 . 1 1 50 50 TYR N N 50 119.470 119.470 115.012 4.458 19707 5786 1 12 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.074 0.217 19707 5787 1 12 . 1 1 50 50 TYR C C 50 170.470 170.470 174.306 -3.836 19707 5788 1 12 . 1 1 50 50 TYR CA C 50 53.268 53.268 54.775 -1.507 19707 5789 1 12 . 1 1 50 50 TYR CB C 50 39.513 39.513 39.864 -0.351 19707 5790 1 12 . 1 1 50 50 TYR H H 50 7.639 7.639 7.972 -0.333 19707 5791 1 12 . 1 1 51 51 ALA N N 51 127.418 127.418 126.635 0.783 19707 5792 1 12 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.040 0.181 19707 5793 1 12 . 1 1 51 51 ALA C C 51 171.328 171.328 175.622 -4.294 19707 5794 1 12 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.577 -3.144 19707 5795 1 12 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.235 -0.923 19707 5796 1 12 . 1 1 51 51 ALA H H 51 8.222 8.222 8.771 -0.549 19707 5797 1 12 . 1 1 52 52 VAL N N 52 117.832 117.832 121.186 -3.354 19707 5798 1 12 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.178 -0.511 19707 5799 1 12 . 1 1 52 52 VAL C C 52 172.436 172.436 174.347 -1.911 19707 5800 1 12 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.807 -3.050 19707 5801 1 12 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.193 -4.090 19707 5802 1 12 . 1 1 52 52 VAL H H 52 8.753 8.753 9.014 -0.261 19707 5803 1 12 . 1 1 53 53 ILE N N 53 128.027 128.027 126.224 1.803 19707 5804 1 12 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.537 0.305 19707 5805 1 12 . 1 1 53 53 ILE C C 53 172.110 172.110 174.591 -2.481 19707 5806 1 12 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.446 -2.693 19707 5807 1 12 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.430 -3.271 19707 5808 1 12 . 1 1 53 53 ILE H H 53 9.261 9.261 9.041 0.220 19707 5809 1 12 . 1 1 54 54 ARG N N 54 127.885 127.885 126.700 1.185 19707 5810 1 12 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.670 0.083 19707 5811 1 12 . 1 1 54 54 ARG C C 54 172.285 172.285 174.606 -2.321 19707 5812 1 12 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.900 -1.640 19707 5813 1 12 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.736 -2.845 19707 5814 1 12 . 1 1 54 54 ARG H H 54 8.686 8.686 8.868 -0.182 19707 5815 1 12 . 1 1 55 55 ILE N N 55 129.907 129.907 123.895 6.012 19707 5816 1 12 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.337 -0.184 19707 5817 1 12 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.406 -2.811 19707 5818 1 12 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.034 -1.421 19707 5819 1 12 . 1 1 55 55 ILE H H 55 9.292 9.292 8.345 0.947 19707 5820 1 12 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.427 -0.235 19707 5821 1 12 . 1 1 56 56 PRO C C 56 174.787 174.787 177.931 -3.144 19707 5822 1 12 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.694 -1.960 19707 5823 1 12 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.682 -2.769 19707 5824 1 12 . 1 1 57 57 GLY N N 57 111.828 111.828 111.218 0.610 19707 5825 1 12 . 1 1 57 57 GLY C C 57 171.039 171.039 173.663 -2.624 19707 5826 1 12 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.848 -2.031 19707 5827 1 12 . 1 1 57 57 GLY H H 57 8.708 8.708 8.744 -0.036 19707 5828 1 12 . 1 1 58 58 GLN N N 58 118.457 118.457 119.713 -1.256 19707 5829 1 12 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.768 0.132 19707 5830 1 12 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.137 -2.865 19707 5831 1 12 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.685 -2.531 19707 5832 1 12 . 1 1 58 58 GLN H H 58 7.909 7.909 7.540 0.369 19707 5833 1 12 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.409 0.027 19707 5834 1 12 . 1 1 59 59 PRO C C 59 174.607 174.607 176.168 -1.561 19707 5835 1 12 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.957 -2.902 19707 5836 1 12 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.036 -2.860 19707 5837 1 12 . 1 1 60 60 VAL N N 60 122.695 122.695 122.469 0.226 19707 5838 1 12 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.026 -0.071 19707 5839 1 12 . 1 1 60 60 VAL C C 60 172.403 172.403 176.300 -3.897 19707 5840 1 12 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.839 -1.944 19707 5841 1 12 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.302 -2.660 19707 5842 1 12 . 1 1 60 60 VAL H H 60 8.364 8.364 8.263 0.101 19707 5843 1 12 . 1 1 61 61 VAL N N 61 126.097 126.097 128.388 -2.291 19707 5844 1 12 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.311 -0.011 19707 5845 1 12 . 1 1 61 61 VAL C C 61 170.891 170.891 174.597 -3.706 19707 5846 1 12 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.612 -2.798 19707 5847 1 12 . 1 1 61 61 VAL CB C 61 31.198 31.198 33.876 -2.678 19707 5848 1 12 . 1 1 61 61 VAL H H 61 8.023 8.023 8.328 -0.305 19707 5849 1 12 . 1 1 62 62 GLU N N 62 126.097 126.097 126.091 0.006 19707 5850 1 12 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.927 0.232 19707 5851 1 12 . 1 1 62 62 GLU C C 62 172.252 172.252 175.157 -2.905 19707 5852 1 12 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.093 -3.553 19707 5853 1 12 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.188 -1.888 19707 5854 1 12 . 1 1 62 62 GLU H H 62 8.591 8.591 8.515 0.076 19707 5855 1 12 . 1 1 63 63 VAL N N 63 120.374 120.374 123.519 -3.145 19707 5856 1 12 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.166 0.227 19707 5857 1 12 . 1 1 63 63 VAL C C 63 171.040 171.040 177.003 -5.963 19707 5858 1 12 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.643 -3.810 19707 5859 1 12 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.496 0.081 19707 5860 1 12 . 1 1 63 63 VAL H H 63 8.732 8.732 8.813 -0.081 19707 5861 1 12 . 1 1 64 64 GLY N N 64 109.935 109.935 115.530 -5.595 19707 5862 1 12 . 1 1 64 64 GLY C C 64 171.656 171.656 173.844 -2.188 19707 5863 1 12 . 1 1 64 64 GLY CA C 64 41.177 41.177 45.852 -4.675 19707 5864 1 12 . 1 1 64 64 GLY H H 64 8.259 8.259 8.385 -0.126 19707 5865 1 12 . 1 1 65 65 THR N N 65 115.478 115.478 115.507 -0.029 19707 5866 1 12 . 1 1 65 65 THR HA H 65 4.342 4.342 4.354 -0.012 19707 5867 1 12 . 1 1 65 65 THR C C 65 170.663 170.663 171.966 -1.303 19707 5868 1 12 . 1 1 65 65 THR CA C 65 58.357 58.357 60.090 -1.733 19707 5869 1 12 . 1 1 65 65 THR CB C 65 67.923 67.923 71.631 -3.708 19707 5870 1 12 . 1 1 65 65 THR H H 65 8.123 8.123 7.660 0.463 19707 5871 1 12 . 1 1 66 66 LYS N N 66 130.775 130.775 124.359 6.416 19707 5872 1 12 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.116 -1.186 19707 5873 1 12 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.390 -2.200 19707 5874 1 12 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.897 -3.207 19707 5875 1 12 . 1 1 66 66 LYS H H 66 8.472 8.472 8.240 0.232 19707 5876 1 12 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.534 -0.123 19707 5877 1 12 . 1 1 67 67 PRO C C 67 173.211 173.211 176.910 -3.699 19707 5878 1 12 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.328 -2.763 19707 5879 1 12 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.727 -3.324 19707 5880 1 12 . 1 1 68 68 THR N N 68 111.983 111.983 114.599 -2.616 19707 5881 1 12 . 1 1 68 68 THR HA H 68 4.277 4.277 4.256 0.021 19707 5882 1 12 . 1 1 68 68 THR C C 68 171.720 171.720 175.810 -4.090 19707 5883 1 12 . 1 1 68 68 THR CA C 68 58.193 58.193 62.158 -3.965 19707 5884 1 12 . 1 1 68 68 THR CB C 68 67.723 67.723 69.379 -1.656 19707 5885 1 12 . 1 1 68 68 THR H H 68 8.091 8.091 8.426 -0.335 19707 5886 1 12 . 1 1 69 69 GLY N N 69 109.918 109.918 108.518 1.400 19707 5887 1 12 . 1 1 69 69 GLY C C 69 170.783 170.783 174.463 -3.680 19707 5888 1 12 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.740 -2.684 19707 5889 1 12 . 1 1 69 69 GLY H H 69 8.119 8.119 7.819 0.300 19707 5890 1 12 . 1 1 70 70 ASP N N 70 123.294 123.294 124.315 -1.021 19707 5891 1 12 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.808 -0.259 19707 5892 1 12 . 1 1 70 70 ASP C C 70 173.651 173.651 175.119 -1.468 19707 5893 1 12 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.685 -2.825 19707 5894 1 12 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.284 -1.551 19707 5895 1 12 . 1 1 70 70 ASP H H 70 8.444 8.444 8.803 -0.359 19707 5896 1 12 . 1 1 71 71 VAL N N 71 117.772 117.772 114.441 3.331 19707 5897 1 12 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.063 -0.356 19707 5898 1 12 . 1 1 71 71 VAL C C 71 172.992 172.992 174.505 -1.513 19707 5899 1 12 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.342 -1.966 19707 5900 1 12 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.687 -2.665 19707 5901 1 12 . 1 1 71 71 VAL H H 71 8.173 8.173 7.784 0.389 19707 5902 1 12 . 1 1 72 72 LEU N N 72 123.435 123.435 123.241 0.194 19707 5903 1 12 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.642 -0.006 19707 5904 1 12 . 1 1 72 72 LEU C C 72 173.189 173.189 176.038 -2.849 19707 5905 1 12 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.031 -2.824 19707 5906 1 12 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.686 -1.048 19707 5907 1 12 . 1 1 72 72 LEU H H 72 8.859 8.859 8.885 -0.026 19707 5908 1 12 . 1 1 73 73 GLN N N 73 119.520 119.520 123.224 -3.704 19707 5909 1 12 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.098 0.247 19707 5910 1 12 . 1 1 73 73 GLN C C 73 172.249 172.249 175.938 -3.689 19707 5911 1 12 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.682 -3.349 19707 5912 1 12 . 1 1 73 73 GLN CB C 73 29.770 29.770 30.220 -0.450 19707 5913 1 12 . 1 1 73 73 GLN H H 73 9.196 9.196 8.710 0.486 19707 5914 1 12 . 1 1 74 74 GLY N N 74 113.513 113.513 112.353 1.160 19707 5915 1 12 . 1 1 74 74 GLY C C 74 169.072 169.072 172.130 -3.058 19707 5916 1 12 . 1 1 74 74 GLY CA C 74 41.297 41.297 44.279 -2.982 19707 5917 1 12 . 1 1 74 74 GLY H H 74 9.373 9.373 9.064 0.309 19707 5918 1 12 . 1 1 75 75 ARG N N 75 122.479 122.479 122.506 -0.027 19707 5919 1 12 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.271 0.231 19707 5920 1 12 . 1 1 75 75 ARG C C 75 172.348 172.348 174.327 -1.979 19707 5921 1 12 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.961 -4.203 19707 5922 1 12 . 1 1 75 75 ARG CB C 75 31.818 31.818 33.635 -1.817 19707 5923 1 12 . 1 1 75 75 ARG H H 75 8.615 8.615 9.251 -0.636 19707 5924 1 12 . 1 1 76 76 ALA N N 76 122.346 122.346 129.051 -6.705 19707 5925 1 12 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.840 -0.304 19707 5926 1 12 . 1 1 76 76 ALA C C 76 172.704 172.704 174.703 -1.999 19707 5927 1 12 . 1 1 76 76 ALA CA C 76 49.027 49.027 50.971 -1.944 19707 5928 1 12 . 1 1 76 76 ALA CB C 76 20.025 20.025 23.163 -3.138 19707 5929 1 12 . 1 1 76 76 ALA H H 76 8.590 8.590 9.068 -0.478 19707 5930 1 12 . 1 1 77 77 THR N N 77 116.961 116.961 116.203 0.758 19707 5931 1 12 . 1 1 77 77 THR HA H 77 4.988 4.988 4.986 0.002 19707 5932 1 12 . 1 1 77 77 THR C C 77 172.800 172.800 174.745 -1.945 19707 5933 1 12 . 1 1 77 77 THR CA C 77 58.344 58.344 60.871 -2.527 19707 5934 1 12 . 1 1 77 77 THR CB C 77 67.712 67.712 70.672 -2.960 19707 5935 1 12 . 1 1 77 77 THR H H 77 8.491 8.491 8.282 0.209 19707 5936 1 12 . 1 1 78 78 GLY N N 78 111.103 111.103 112.123 -1.020 19707 5937 1 12 . 1 1 78 78 GLY C C 78 172.567 172.567 173.425 -0.858 19707 5938 1 12 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.983 -2.674 19707 5939 1 12 . 1 1 78 78 GLY H H 78 8.649 8.649 8.506 0.143 19707 5940 1 12 . 1 1 79 79 GLU N N 79 123.423 123.423 118.214 5.209 19707 5941 1 12 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.290 -0.294 19707 5942 1 12 . 1 1 79 79 GLU C C 79 175.466 175.466 177.851 -2.385 19707 5943 1 12 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.876 -2.417 19707 5944 1 12 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.968 -3.901 19707 5945 1 12 . 1 1 79 79 GLU H H 79 10.375 10.375 8.593 1.782 19707 5946 1 12 . 1 1 80 80 GLU N N 80 113.846 113.846 117.999 -4.153 19707 5947 1 12 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.410 -0.052 19707 5948 1 12 . 1 1 80 80 GLU C C 80 173.293 173.293 176.783 -3.490 19707 5949 1 12 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.980 -4.204 19707 5950 1 12 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.614 -4.883 19707 5951 1 12 . 1 1 80 80 GLU H H 80 7.679 7.679 8.591 -0.912 19707 5952 1 12 . 1 1 81 81 GLY N N 81 105.493 105.493 107.651 -2.158 19707 5953 1 12 . 1 1 81 81 GLY C C 81 170.427 170.427 173.778 -3.351 19707 5954 1 12 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.298 -2.686 19707 5955 1 12 . 1 1 81 81 GLY H H 81 7.476 7.476 7.629 -0.153 19707 5956 1 12 . 1 1 82 82 GLU N N 82 122.160 122.160 120.489 1.671 19707 5957 1 12 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.307 0.647 19707 5958 1 12 . 1 1 82 82 GLU C C 82 171.004 171.004 175.154 -4.150 19707 5959 1 12 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.704 -4.383 19707 5960 1 12 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.040 -4.974 19707 5961 1 12 . 1 1 82 82 GLU H H 82 9.585 9.585 8.185 1.400 19707 5962 1 12 . 1 1 83 83 THR N N 83 114.756 114.756 114.752 0.004 19707 5963 1 12 . 1 1 83 83 THR HA H 83 4.990 4.990 5.105 -0.115 19707 5964 1 12 . 1 1 83 83 THR C C 83 170.909 170.909 173.033 -2.124 19707 5965 1 12 . 1 1 83 83 THR CA C 83 57.957 57.957 61.825 -3.868 19707 5966 1 12 . 1 1 83 83 THR CB C 83 68.271 68.271 71.998 -3.727 19707 5967 1 12 . 1 1 83 83 THR H H 83 8.490 8.490 8.130 0.360 19707 5968 1 12 . 1 1 84 84 VAL N N 84 122.639 122.639 124.785 -2.146 19707 5969 1 12 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.934 -0.279 19707 5970 1 12 . 1 1 84 84 VAL C C 84 170.962 170.962 173.518 -2.556 19707 5971 1 12 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.681 -2.384 19707 5972 1 12 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.612 -3.388 19707 5973 1 12 . 1 1 84 84 VAL H H 84 9.001 9.001 9.065 -0.064 19707 5974 1 12 . 1 1 85 85 LEU N N 85 129.903 129.903 128.048 1.855 19707 5975 1 12 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.497 -0.105 19707 5976 1 12 . 1 1 85 85 LEU C C 85 172.346 172.346 174.356 -2.010 19707 5977 1 12 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.097 -2.300 19707 5978 1 12 . 1 1 85 85 LEU CB C 85 42.515 42.515 47.063 -4.548 19707 5979 1 12 . 1 1 85 85 LEU H H 85 8.610 8.610 9.023 -0.413 19707 5980 1 12 . 1 1 86 86 VAL N N 86 122.778 122.778 124.104 -1.326 19707 5981 1 12 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.929 0.112 19707 5982 1 12 . 1 1 86 86 VAL C C 86 172.570 172.570 174.601 -2.031 19707 5983 1 12 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.023 -3.823 19707 5984 1 12 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.307 -3.032 19707 5985 1 12 . 1 1 86 86 VAL H H 86 9.228 9.228 9.072 0.156 19707 5986 1 12 . 1 1 87 87 GLU N N 87 120.437 120.437 126.610 -6.173 19707 5987 1 12 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.542 0.189 19707 5988 1 12 . 1 1 87 87 GLU C C 87 172.267 172.267 174.915 -2.648 19707 5989 1 12 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.364 -3.015 19707 5990 1 12 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.819 -2.695 19707 5991 1 12 . 1 1 87 87 GLU H H 87 8.851 8.851 9.285 -0.434 19707 5992 1 12 . 1 1 88 88 GLU N N 88 118.525 118.525 120.172 -1.647 19707 5993 1 12 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.575 0.426 19707 5994 1 12 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.851 -2.934 19707 5995 1 12 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.111 -1.164 19707 5996 1 12 . 1 1 88 88 GLU H H 88 8.380 8.380 8.209 0.171 19707 5997 1 12 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.458 0.071 19707 5998 1 12 . 1 1 89 89 PRO C C 89 172.774 172.774 176.800 -4.026 19707 5999 1 12 . 1 1 89 89 PRO CA C 89 60.381 60.381 62.950 -2.569 19707 6000 1 12 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.108 -2.774 19707 6001 1 13 . 1 1 2 2 SER N N 2 115.963 115.963 116.030 -0.067 19707 6002 1 13 . 1 1 2 2 SER HA H 2 4.408 4.408 4.851 -0.443 19707 6003 1 13 . 1 1 2 2 SER C C 2 171.788 171.788 173.760 -1.972 19707 6004 1 13 . 1 1 2 2 SER CA C 2 55.870 55.870 57.894 -2.024 19707 6005 1 13 . 1 1 2 2 SER CB C 2 61.022 61.022 64.088 -3.066 19707 6006 1 13 . 1 1 2 2 SER H H 2 8.661 8.661 8.880 -0.219 19707 6007 1 13 . 1 1 3 3 GLU N N 3 122.941 122.941 121.145 1.796 19707 6008 1 13 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.622 -0.302 19707 6009 1 13 . 1 1 3 3 GLU C C 3 173.817 173.817 174.882 -1.065 19707 6010 1 13 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.277 -1.323 19707 6011 1 13 . 1 1 3 3 GLU CB C 3 26.837 26.837 31.154 -4.316 19707 6012 1 13 . 1 1 3 3 GLU H H 3 8.706 8.706 8.585 0.121 19707 6013 1 13 . 1 1 4 4 THR N N 4 116.182 116.182 114.283 1.899 19707 6014 1 13 . 1 1 4 4 THR HA H 4 4.233 4.233 4.518 -0.285 19707 6015 1 13 . 1 1 4 4 THR C C 4 171.719 171.719 174.694 -2.975 19707 6016 1 13 . 1 1 4 4 THR CA C 4 59.414 59.414 61.116 -1.702 19707 6017 1 13 . 1 1 4 4 THR CB C 4 67.009 67.009 70.025 -3.016 19707 6018 1 13 . 1 1 4 4 THR H H 4 8.165 8.165 8.247 -0.082 19707 6019 1 13 . 1 1 5 5 ARG N N 5 124.184 124.184 119.839 4.345 19707 6020 1 13 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.471 -0.111 19707 6021 1 13 . 1 1 5 5 ARG C C 5 173.520 173.520 176.551 -3.031 19707 6022 1 13 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.566 -2.223 19707 6023 1 13 . 1 1 5 5 ARG CB C 5 28.165 28.165 29.907 -1.742 19707 6024 1 13 . 1 1 5 5 ARG H H 5 8.354 8.354 8.686 -0.332 19707 6025 1 13 . 1 1 6 6 THR N N 6 116.652 116.652 114.025 2.627 19707 6026 1 13 . 1 1 6 6 THR HA H 6 4.263 4.263 4.036 0.227 19707 6027 1 13 . 1 1 6 6 THR C C 6 171.784 171.784 174.235 -2.451 19707 6028 1 13 . 1 1 6 6 THR CA C 6 59.218 59.218 62.173 -2.955 19707 6029 1 13 . 1 1 6 6 THR CB C 6 67.213 67.213 69.540 -2.327 19707 6030 1 13 . 1 1 6 6 THR H H 6 8.224 8.224 7.624 0.600 19707 6031 1 13 . 1 1 7 7 ILE N N 7 123.882 123.882 122.021 1.861 19707 6032 1 13 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.104 0.034 19707 6033 1 13 . 1 1 7 7 ILE C C 7 173.572 173.572 176.787 -3.215 19707 6034 1 13 . 1 1 7 7 ILE CA C 7 58.482 58.482 61.333 -2.851 19707 6035 1 13 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.062 -1.993 19707 6036 1 13 . 1 1 7 7 ILE H H 7 8.247 8.247 8.128 0.119 19707 6037 1 13 . 1 1 8 8 SER N N 8 120.287 120.287 120.923 -0.636 19707 6038 1 13 . 1 1 8 8 SER HA H 8 4.445 4.445 4.447 -0.002 19707 6039 1 13 . 1 1 8 8 SER C C 8 171.926 171.926 174.850 -2.924 19707 6040 1 13 . 1 1 8 8 SER CA C 8 55.522 55.522 58.486 -2.964 19707 6041 1 13 . 1 1 8 8 SER CB C 8 61.073 61.073 63.065 -1.992 19707 6042 1 13 . 1 1 8 8 SER H H 8 8.402 8.402 8.528 -0.126 19707 6043 1 13 . 1 1 9 9 SER N N 9 118.425 118.425 123.203 -4.778 19707 6044 1 13 . 1 1 9 9 SER HA H 9 4.525 4.525 4.369 0.156 19707 6045 1 13 . 1 1 9 9 SER C C 9 172.663 172.663 174.394 -1.731 19707 6046 1 13 . 1 1 9 9 SER CA C 9 55.897 55.897 59.165 -3.268 19707 6047 1 13 . 1 1 9 9 SER CB C 9 61.375 61.375 61.653 -0.278 19707 6048 1 13 . 1 1 9 9 SER H H 9 8.362 8.362 8.732 -0.370 19707 6049 1 13 . 1 1 10 10 THR N N 10 115.676 115.676 111.765 3.911 19707 6050 1 13 . 1 1 10 10 THR HA H 10 4.232 4.232 4.394 -0.162 19707 6051 1 13 . 1 1 10 10 THR C C 10 173.070 173.070 175.869 -2.799 19707 6052 1 13 . 1 1 10 10 THR CA C 10 60.318 60.318 62.586 -2.268 19707 6053 1 13 . 1 1 10 10 THR CB C 10 67.205 67.205 69.075 -1.870 19707 6054 1 13 . 1 1 10 10 THR H H 10 8.274 8.274 8.178 0.096 19707 6055 1 13 . 1 1 11 11 ALA N N 11 124.726 124.726 124.856 -0.130 19707 6056 1 13 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.280 -0.293 19707 6057 1 13 . 1 1 11 11 ALA C C 11 176.825 176.825 179.489 -2.664 19707 6058 1 13 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.766 -2.225 19707 6059 1 13 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.139 -2.250 19707 6060 1 13 . 1 1 11 11 ALA H H 11 8.347 8.347 8.208 0.139 19707 6061 1 13 . 1 1 12 12 GLN N N 12 117.915 117.915 117.136 0.779 19707 6062 1 13 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.205 -0.416 19707 6063 1 13 . 1 1 12 12 GLN C C 12 174.697 174.697 177.311 -2.614 19707 6064 1 13 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.434 -2.430 19707 6065 1 13 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.774 -2.549 19707 6066 1 13 . 1 1 12 12 GLN H H 12 8.194 8.194 8.010 0.184 19707 6067 1 13 . 1 1 13 13 GLU N N 13 118.510 118.510 119.393 -0.883 19707 6068 1 13 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.148 -0.045 19707 6069 1 13 . 1 1 13 13 GLU C C 13 176.192 176.192 179.177 -2.985 19707 6070 1 13 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.827 -2.512 19707 6071 1 13 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.802 -3.769 19707 6072 1 13 . 1 1 13 13 GLU H H 13 7.917 7.917 8.010 -0.093 19707 6073 1 13 . 1 1 14 14 ARG N N 14 118.193 118.193 119.799 -1.606 19707 6074 1 13 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.080 -0.112 19707 6075 1 13 . 1 1 14 14 ARG C C 14 176.764 176.764 178.462 -1.698 19707 6076 1 13 . 1 1 14 14 ARG CA C 14 57.283 57.283 58.955 -1.672 19707 6077 1 13 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.308 -2.071 19707 6078 1 13 . 1 1 14 14 ARG H H 14 7.907 7.907 8.240 -0.333 19707 6079 1 13 . 1 1 15 15 VAL N N 15 117.991 117.991 115.610 2.381 19707 6080 1 13 . 1 1 15 15 VAL HA H 15 3.903 3.903 4.163 -0.260 19707 6081 1 13 . 1 1 15 15 VAL C C 15 174.922 174.922 177.421 -2.499 19707 6082 1 13 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.591 -1.760 19707 6083 1 13 . 1 1 15 15 VAL CB C 15 28.723 28.723 30.922 -2.199 19707 6084 1 13 . 1 1 15 15 VAL H H 15 7.658 7.658 7.609 0.049 19707 6085 1 13 . 1 1 16 16 ASP N N 16 124.314 124.314 120.793 3.521 19707 6086 1 13 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.392 -0.076 19707 6087 1 13 . 1 1 16 16 ASP C C 16 176.462 176.462 177.898 -1.436 19707 6088 1 13 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.505 -2.179 19707 6089 1 13 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.297 -4.628 19707 6090 1 13 . 1 1 16 16 ASP H H 16 8.291 8.291 8.127 0.164 19707 6091 1 13 . 1 1 17 17 LEU N N 17 120.212 120.212 119.456 0.756 19707 6092 1 13 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.139 -0.085 19707 6093 1 13 . 1 1 17 17 LEU C C 17 177.171 177.171 179.079 -1.908 19707 6094 1 13 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.614 -2.634 19707 6095 1 13 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.207 -2.362 19707 6096 1 13 . 1 1 17 17 LEU H H 17 8.172 8.172 7.673 0.499 19707 6097 1 13 . 1 1 18 18 GLU N N 18 120.587 120.587 118.912 1.675 19707 6098 1 13 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.901 0.292 19707 6099 1 13 . 1 1 18 18 GLU C C 18 175.997 175.997 178.722 -2.725 19707 6100 1 13 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.511 -3.409 19707 6101 1 13 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.757 -2.685 19707 6102 1 13 . 1 1 18 18 GLU H H 18 7.876 7.876 7.789 0.087 19707 6103 1 13 . 1 1 19 19 ALA N N 19 121.800 121.800 122.857 -1.057 19707 6104 1 13 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.150 -0.359 19707 6105 1 13 . 1 1 19 19 ALA C C 19 175.708 175.708 179.825 -4.117 19707 6106 1 13 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.996 -2.144 19707 6107 1 13 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.388 -4.234 19707 6108 1 13 . 1 1 19 19 ALA H H 19 7.792 7.792 7.498 0.293 19707 6109 1 13 . 1 1 20 20 VAL N N 20 118.680 118.680 119.410 -0.730 19707 6110 1 13 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.713 -0.413 19707 6111 1 13 . 1 1 20 20 VAL C C 20 176.276 176.276 178.158 -1.882 19707 6112 1 13 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.283 -2.476 19707 6113 1 13 . 1 1 20 20 VAL CB C 20 29.551 29.551 30.962 -1.411 19707 6114 1 13 . 1 1 20 20 VAL H H 20 7.712 7.712 8.009 -0.297 19707 6115 1 13 . 1 1 21 21 ARG N N 21 121.935 121.935 121.006 0.929 19707 6116 1 13 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.074 -0.079 19707 6117 1 13 . 1 1 21 21 ARG C C 21 176.828 176.828 178.742 -1.914 19707 6118 1 13 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.651 -1.991 19707 6119 1 13 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.587 -2.297 19707 6120 1 13 . 1 1 21 21 ARG H H 21 8.444 8.444 8.417 0.027 19707 6121 1 13 . 1 1 22 22 LEU N N 22 119.327 119.327 119.504 -0.177 19707 6122 1 13 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.120 -0.125 19707 6123 1 13 . 1 1 22 22 LEU C C 22 175.664 175.664 178.618 -2.954 19707 6124 1 13 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.136 -3.268 19707 6125 1 13 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.597 -2.462 19707 6126 1 13 . 1 1 22 22 LEU H H 22 8.248 8.248 8.088 0.160 19707 6127 1 13 . 1 1 23 23 ALA N N 23 121.202 121.202 122.259 -1.057 19707 6128 1 13 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.961 -0.226 19707 6129 1 13 . 1 1 23 23 ALA C C 23 175.492 175.492 179.642 -4.150 19707 6130 1 13 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.326 -2.257 19707 6131 1 13 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.038 -3.971 19707 6132 1 13 . 1 1 23 23 ALA H H 23 8.392 8.392 8.576 -0.184 19707 6133 1 13 . 1 1 24 24 SER N N 24 112.377 112.377 115.111 -2.734 19707 6134 1 13 . 1 1 24 24 SER HA H 24 4.214 4.214 4.295 -0.081 19707 6135 1 13 . 1 1 24 24 SER C C 24 174.773 174.773 176.632 -1.859 19707 6136 1 13 . 1 1 24 24 SER CA C 24 59.258 59.258 62.552 -3.294 19707 6137 1 13 . 1 1 24 24 SER CB C 24 60.149 60.149 63.073 -2.924 19707 6138 1 13 . 1 1 24 24 SER H H 24 7.690 7.690 8.011 -0.321 19707 6139 1 13 . 1 1 25 25 ILE N N 25 123.886 123.886 122.598 1.288 19707 6140 1 13 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.023 -0.181 19707 6141 1 13 . 1 1 25 25 ILE C C 25 176.487 176.487 178.105 -1.618 19707 6142 1 13 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.247 -0.254 19707 6143 1 13 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.443 -0.511 19707 6144 1 13 . 1 1 25 25 ILE H H 25 7.837 7.837 8.208 -0.371 19707 6145 1 13 . 1 1 26 26 VAL N N 26 122.538 122.538 121.621 0.917 19707 6146 1 13 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.550 -0.162 19707 6147 1 13 . 1 1 26 26 VAL C C 26 174.624 174.624 177.468 -2.844 19707 6148 1 13 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.538 -2.623 19707 6149 1 13 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.468 -3.573 19707 6150 1 13 . 1 1 26 26 VAL H H 26 8.804 8.804 8.679 0.125 19707 6151 1 13 . 1 1 27 27 ASP N N 27 120.433 120.433 120.118 0.315 19707 6152 1 13 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.308 -0.144 19707 6153 1 13 . 1 1 27 27 ASP C C 27 174.966 174.966 178.422 -3.456 19707 6154 1 13 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.526 -2.197 19707 6155 1 13 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.674 -2.820 19707 6156 1 13 . 1 1 27 27 ASP H H 27 8.719 8.719 8.417 0.302 19707 6157 1 13 . 1 1 28 28 SER N N 28 112.397 112.397 115.930 -3.533 19707 6158 1 13 . 1 1 28 28 SER HA H 28 4.073 4.073 4.156 -0.083 19707 6159 1 13 . 1 1 28 28 SER C C 28 174.405 174.405 176.766 -2.361 19707 6160 1 13 . 1 1 28 28 SER CA C 28 59.115 59.115 62.065 -2.950 19707 6161 1 13 . 1 1 28 28 SER CB C 28 60.125 60.125 63.081 -2.956 19707 6162 1 13 . 1 1 28 28 SER H H 28 7.599 7.599 8.248 -0.649 19707 6163 1 13 . 1 1 29 29 ARG N N 29 123.945 123.945 122.398 1.547 19707 6164 1 13 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.943 0.084 19707 6165 1 13 . 1 1 29 29 ARG C C 29 175.902 175.902 178.178 -2.276 19707 6166 1 13 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.981 -3.707 19707 6167 1 13 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.066 -1.326 19707 6168 1 13 . 1 1 29 29 ARG H H 29 7.769 7.769 7.876 -0.107 19707 6169 1 13 . 1 1 30 30 LEU N N 30 121.580 121.580 120.277 1.303 19707 6170 1 13 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.987 -0.238 19707 6171 1 13 . 1 1 30 30 LEU C C 30 177.474 177.474 179.667 -2.193 19707 6172 1 13 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.773 -2.460 19707 6173 1 13 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.787 -2.758 19707 6174 1 13 . 1 1 30 30 LEU H H 30 8.665 8.665 8.296 0.369 19707 6175 1 13 . 1 1 31 31 ILE N N 31 119.330 119.330 117.894 1.436 19707 6176 1 13 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.730 -0.039 19707 6177 1 13 . 1 1 31 31 ILE C C 31 175.341 175.341 177.838 -2.497 19707 6178 1 13 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.033 -2.521 19707 6179 1 13 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.936 -2.369 19707 6180 1 13 . 1 1 31 31 ILE H H 31 8.226 8.226 8.418 -0.192 19707 6181 1 13 . 1 1 32 32 GLY N N 32 106.092 106.092 106.024 0.068 19707 6182 1 13 . 1 1 32 32 GLY C C 32 172.413 172.413 175.225 -2.812 19707 6183 1 13 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.843 -3.345 19707 6184 1 13 . 1 1 32 32 GLY H H 32 7.767 7.767 7.883 -0.116 19707 6185 1 13 . 1 1 33 33 THR N N 33 110.966 110.966 113.198 -2.232 19707 6186 1 13 . 1 1 33 33 THR HA H 33 4.455 4.455 4.370 0.085 19707 6187 1 13 . 1 1 33 33 THR C C 33 172.714 172.714 174.906 -2.192 19707 6188 1 13 . 1 1 33 33 THR CA C 33 60.032 60.032 62.824 -2.792 19707 6189 1 13 . 1 1 33 33 THR CB C 33 68.287 68.287 70.185 -1.898 19707 6190 1 13 . 1 1 33 33 THR H H 33 8.102 8.102 7.841 0.261 19707 6191 1 13 . 1 1 34 34 GLY N N 34 110.320 110.320 110.811 -0.491 19707 6192 1 13 . 1 1 34 34 GLY C C 34 170.505 170.505 173.737 -3.232 19707 6193 1 13 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.135 -2.552 19707 6194 1 13 . 1 1 34 34 GLY H H 34 8.072 8.072 8.126 -0.054 19707 6195 1 13 . 1 1 35 35 SER N N 35 112.944 112.944 114.842 -1.898 19707 6196 1 13 . 1 1 35 35 SER HA H 35 4.385 4.385 4.760 -0.375 19707 6197 1 13 . 1 1 35 35 SER C C 35 169.537 169.537 172.243 -2.706 19707 6198 1 13 . 1 1 35 35 SER CA C 35 54.794 54.794 57.985 -3.191 19707 6199 1 13 . 1 1 35 35 SER CB C 35 62.029 62.029 66.091 -4.062 19707 6200 1 13 . 1 1 35 35 SER H H 35 7.719 7.719 7.695 0.024 19707 6201 1 13 . 1 1 36 36 VAL N N 36 118.566 118.566 121.772 -3.206 19707 6202 1 13 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.289 -0.256 19707 6203 1 13 . 1 1 36 36 VAL C C 36 169.876 169.876 173.880 -4.004 19707 6204 1 13 . 1 1 36 36 VAL CA C 36 58.565 58.565 59.831 -1.266 19707 6205 1 13 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.948 -2.996 19707 6206 1 13 . 1 1 36 36 VAL H H 36 8.490 8.490 8.517 -0.027 19707 6207 1 13 . 1 1 37 37 ASP N N 37 121.640 121.640 125.432 -3.792 19707 6208 1 13 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.909 -0.107 19707 6209 1 13 . 1 1 37 37 ASP C C 37 172.806 172.806 176.123 -3.317 19707 6210 1 13 . 1 1 37 37 ASP CA C 37 49.043 49.043 53.054 -4.011 19707 6211 1 13 . 1 1 37 37 ASP CB C 37 40.206 40.206 44.428 -4.222 19707 6212 1 13 . 1 1 37 37 ASP H H 37 7.195 7.195 8.337 -1.142 19707 6213 1 13 . 1 1 38 38 GLU N N 38 120.018 120.018 120.928 -0.910 19707 6214 1 13 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.916 -0.259 19707 6215 1 13 . 1 1 38 38 GLU C C 38 174.753 174.753 177.027 -2.274 19707 6216 1 13 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.683 -3.191 19707 6217 1 13 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.752 -3.673 19707 6218 1 13 . 1 1 38 38 GLU H H 38 8.908 8.908 9.003 -0.095 19707 6219 1 13 . 1 1 39 39 ASP N N 39 118.668 118.668 116.401 2.267 19707 6220 1 13 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.443 -0.197 19707 6221 1 13 . 1 1 39 39 ASP C C 39 175.393 175.393 177.602 -2.209 19707 6222 1 13 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.234 -1.370 19707 6223 1 13 . 1 1 39 39 ASP CB C 39 36.970 36.970 39.888 -2.918 19707 6224 1 13 . 1 1 39 39 ASP H H 39 8.242 8.242 8.709 -0.467 19707 6225 1 13 . 1 1 40 40 PHE N N 40 119.851 119.851 120.784 -0.933 19707 6226 1 13 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.408 -0.204 19707 6227 1 13 . 1 1 40 40 PHE C C 40 174.929 174.929 176.944 -2.015 19707 6228 1 13 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.572 -2.401 19707 6229 1 13 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.296 -3.463 19707 6230 1 13 . 1 1 40 40 PHE H H 40 8.037 8.037 7.719 0.318 19707 6231 1 13 . 1 1 41 41 LEU N N 41 117.882 117.882 119.340 -1.458 19707 6232 1 13 . 1 1 41 41 LEU HA H 41 3.522 3.522 3.978 -0.456 19707 6233 1 13 . 1 1 41 41 LEU C C 41 175.938 175.938 178.917 -2.979 19707 6234 1 13 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.973 -2.113 19707 6235 1 13 . 1 1 41 41 LEU CB C 41 39.231 39.231 41.970 -2.739 19707 6236 1 13 . 1 1 41 41 LEU H H 41 7.816 7.816 8.152 -0.336 19707 6237 1 13 . 1 1 42 42 ARG N N 42 118.360 118.360 118.335 0.025 19707 6238 1 13 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.001 -0.261 19707 6239 1 13 . 1 1 42 42 ARG C C 42 175.435 175.435 177.330 -1.895 19707 6240 1 13 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.009 -2.038 19707 6241 1 13 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.559 -2.295 19707 6242 1 13 . 1 1 42 42 ARG H H 42 8.540 8.540 8.299 0.241 19707 6243 1 13 . 1 1 43 43 GLU N N 43 114.947 114.947 117.431 -2.484 19707 6244 1 13 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.243 -0.193 19707 6245 1 13 . 1 1 43 43 GLU C C 43 174.518 174.518 177.885 -3.367 19707 6246 1 13 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.514 -2.942 19707 6247 1 13 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.344 -3.303 19707 6248 1 13 . 1 1 43 43 GLU H H 43 7.223 7.223 7.647 -0.424 19707 6249 1 13 . 1 1 44 44 GLN N N 44 114.109 114.109 117.264 -3.155 19707 6250 1 13 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.312 -0.206 19707 6251 1 13 . 1 1 44 44 GLN C C 44 173.777 173.777 177.465 -3.688 19707 6252 1 13 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.467 -3.286 19707 6253 1 13 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.377 -3.507 19707 6254 1 13 . 1 1 44 44 GLN H H 44 7.372 7.372 8.052 -0.680 19707 6255 1 13 . 1 1 45 45 ILE N N 45 117.470 117.470 115.678 1.792 19707 6256 1 13 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.929 0.019 19707 6257 1 13 . 1 1 45 45 ILE C C 45 172.305 172.305 177.587 -5.282 19707 6258 1 13 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.413 -4.908 19707 6259 1 13 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.972 -2.272 19707 6260 1 13 . 1 1 45 45 ILE H H 45 7.235 7.235 7.533 -0.298 19707 6261 1 13 . 1 1 46 46 ARG N N 46 122.996 122.996 115.566 7.430 19707 6262 1 13 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.986 0.204 19707 6263 1 13 . 1 1 46 46 ARG C C 46 172.992 172.992 175.582 -2.590 19707 6264 1 13 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.097 -4.336 19707 6265 1 13 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.427 -0.475 19707 6266 1 13 . 1 1 46 46 ARG H H 46 8.336 8.336 8.687 -0.351 19707 6267 1 13 . 1 1 47 47 ASP N N 47 118.676 118.676 115.898 2.778 19707 6268 1 13 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.651 -0.203 19707 6269 1 13 . 1 1 47 47 ASP C C 47 172.520 172.520 175.046 -2.526 19707 6270 1 13 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.112 -2.222 19707 6271 1 13 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.846 -5.189 19707 6272 1 13 . 1 1 47 47 ASP H H 47 8.313 8.313 8.106 0.207 19707 6273 1 13 . 1 1 48 48 ALA N N 48 120.922 120.922 122.792 -1.870 19707 6274 1 13 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.325 0.044 19707 6275 1 13 . 1 1 48 48 ALA C C 48 174.295 174.295 177.318 -3.023 19707 6276 1 13 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.983 -2.346 19707 6277 1 13 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.860 -3.646 19707 6278 1 13 . 1 1 48 48 ALA H H 48 7.824 7.824 7.348 0.476 19707 6279 1 13 . 1 1 49 49 ARG N N 49 118.644 118.644 120.049 -1.405 19707 6280 1 13 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.016 0.326 19707 6281 1 13 . 1 1 49 49 ARG C C 49 172.504 172.504 176.550 -4.046 19707 6282 1 13 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.758 -3.849 19707 6283 1 13 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.485 -2.142 19707 6284 1 13 . 1 1 49 49 ARG H H 49 7.911 7.911 8.772 -0.861 19707 6285 1 13 . 1 1 50 50 TYR N N 50 119.470 119.470 114.654 4.816 19707 6286 1 13 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.021 0.270 19707 6287 1 13 . 1 1 50 50 TYR C C 50 170.470 170.470 174.384 -3.914 19707 6288 1 13 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.177 -1.909 19707 6289 1 13 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.094 -0.581 19707 6290 1 13 . 1 1 50 50 TYR H H 50 7.639 7.639 7.911 -0.272 19707 6291 1 13 . 1 1 51 51 ALA N N 51 127.418 127.418 125.913 1.505 19707 6292 1 13 . 1 1 51 51 ALA HA H 51 5.221 5.221 4.923 0.298 19707 6293 1 13 . 1 1 51 51 ALA C C 51 171.328 171.328 175.490 -4.162 19707 6294 1 13 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.473 -3.040 19707 6295 1 13 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.550 -1.238 19707 6296 1 13 . 1 1 51 51 ALA H H 51 8.222 8.222 8.817 -0.595 19707 6297 1 13 . 1 1 52 52 VAL N N 52 117.832 117.832 121.092 -3.260 19707 6298 1 13 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.216 -0.549 19707 6299 1 13 . 1 1 52 52 VAL C C 52 172.436 172.436 174.224 -1.788 19707 6300 1 13 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.736 -2.979 19707 6301 1 13 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.285 -4.182 19707 6302 1 13 . 1 1 52 52 VAL H H 52 8.753 8.753 9.092 -0.339 19707 6303 1 13 . 1 1 53 53 ILE N N 53 128.027 128.027 126.099 1.928 19707 6304 1 13 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.503 0.339 19707 6305 1 13 . 1 1 53 53 ILE C C 53 172.110 172.110 174.302 -2.192 19707 6306 1 13 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.292 -2.539 19707 6307 1 13 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.680 -3.521 19707 6308 1 13 . 1 1 53 53 ILE H H 53 9.261 9.261 9.115 0.146 19707 6309 1 13 . 1 1 54 54 ARG N N 54 127.885 127.885 127.595 0.290 19707 6310 1 13 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.695 0.058 19707 6311 1 13 . 1 1 54 54 ARG C C 54 172.285 172.285 174.422 -2.137 19707 6312 1 13 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.664 -1.404 19707 6313 1 13 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.358 -2.466 19707 6314 1 13 . 1 1 54 54 ARG H H 54 8.686 8.686 8.610 0.076 19707 6315 1 13 . 1 1 55 55 ILE N N 55 129.907 129.907 123.804 6.103 19707 6316 1 13 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.378 -0.225 19707 6317 1 13 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.996 -2.401 19707 6318 1 13 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.200 -1.587 19707 6319 1 13 . 1 1 55 55 ILE H H 55 9.292 9.292 8.285 1.007 19707 6320 1 13 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.435 -0.243 19707 6321 1 13 . 1 1 56 56 PRO C C 56 174.787 174.787 177.910 -3.123 19707 6322 1 13 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.753 -2.019 19707 6323 1 13 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.739 -2.826 19707 6324 1 13 . 1 1 57 57 GLY N N 57 111.828 111.828 110.845 0.983 19707 6325 1 13 . 1 1 57 57 GLY C C 57 171.039 171.039 173.632 -2.593 19707 6326 1 13 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.835 -2.018 19707 6327 1 13 . 1 1 57 57 GLY H H 57 8.708 8.708 8.732 -0.024 19707 6328 1 13 . 1 1 58 58 GLN N N 58 118.457 118.457 119.940 -1.483 19707 6329 1 13 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.820 0.080 19707 6330 1 13 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.074 -2.801 19707 6331 1 13 . 1 1 58 58 GLN CB C 58 27.154 27.154 30.205 -3.051 19707 6332 1 13 . 1 1 58 58 GLN H H 58 7.909 7.909 7.574 0.335 19707 6333 1 13 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.470 -0.034 19707 6334 1 13 . 1 1 59 59 PRO C C 59 174.607 174.607 177.259 -2.652 19707 6335 1 13 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.922 -2.867 19707 6336 1 13 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.090 -2.913 19707 6337 1 13 . 1 1 60 60 VAL N N 60 122.695 122.695 120.569 2.126 19707 6338 1 13 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.125 -0.170 19707 6339 1 13 . 1 1 60 60 VAL C C 60 172.403 172.403 175.625 -3.222 19707 6340 1 13 . 1 1 60 60 VAL CA C 60 60.895 60.895 63.342 -2.447 19707 6341 1 13 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.545 -2.904 19707 6342 1 13 . 1 1 60 60 VAL H H 60 8.364 8.364 8.304 0.060 19707 6343 1 13 . 1 1 61 61 VAL N N 61 126.097 126.097 128.100 -2.003 19707 6344 1 13 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.438 -0.138 19707 6345 1 13 . 1 1 61 61 VAL C C 61 170.891 170.891 174.219 -3.328 19707 6346 1 13 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.492 -2.678 19707 6347 1 13 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.712 -3.514 19707 6348 1 13 . 1 1 61 61 VAL H H 61 8.023 8.023 8.388 -0.365 19707 6349 1 13 . 1 1 62 62 GLU N N 62 126.097 126.097 125.172 0.925 19707 6350 1 13 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.133 0.026 19707 6351 1 13 . 1 1 62 62 GLU C C 62 172.252 172.252 175.098 -2.846 19707 6352 1 13 . 1 1 62 62 GLU CA C 62 51.540 51.540 54.916 -3.376 19707 6353 1 13 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.822 -2.522 19707 6354 1 13 . 1 1 62 62 GLU H H 62 8.591 8.591 8.310 0.281 19707 6355 1 13 . 1 1 63 63 VAL N N 63 120.374 120.374 123.772 -3.398 19707 6356 1 13 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.298 0.095 19707 6357 1 13 . 1 1 63 63 VAL C C 63 171.040 171.040 176.611 -5.571 19707 6358 1 13 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.367 -3.534 19707 6359 1 13 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.750 -0.173 19707 6360 1 13 . 1 1 63 63 VAL H H 63 8.732 8.732 8.872 -0.140 19707 6361 1 13 . 1 1 64 64 GLY N N 64 109.935 109.935 113.786 -3.851 19707 6362 1 13 . 1 1 64 64 GLY C C 64 171.656 171.656 174.138 -2.482 19707 6363 1 13 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.162 -4.985 19707 6364 1 13 . 1 1 64 64 GLY H H 64 8.259 8.259 8.544 -0.285 19707 6365 1 13 . 1 1 65 65 THR N N 65 115.478 115.478 116.442 -0.964 19707 6366 1 13 . 1 1 65 65 THR HA H 65 4.342 4.342 4.318 0.024 19707 6367 1 13 . 1 1 65 65 THR C C 65 170.663 170.663 172.607 -1.944 19707 6368 1 13 . 1 1 65 65 THR CA C 65 58.357 58.357 60.635 -2.278 19707 6369 1 13 . 1 1 65 65 THR CB C 65 67.923 67.923 71.876 -3.953 19707 6370 1 13 . 1 1 65 65 THR H H 65 8.123 8.123 7.662 0.461 19707 6371 1 13 . 1 1 66 66 LYS N N 66 130.775 130.775 124.837 5.938 19707 6372 1 13 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.190 -1.260 19707 6373 1 13 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.689 -2.499 19707 6374 1 13 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.670 -2.980 19707 6375 1 13 . 1 1 66 66 LYS H H 66 8.472 8.472 8.169 0.303 19707 6376 1 13 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.608 -0.197 19707 6377 1 13 . 1 1 67 67 PRO C C 67 173.211 173.211 176.870 -3.659 19707 6378 1 13 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.298 -2.732 19707 6379 1 13 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.591 -3.188 19707 6380 1 13 . 1 1 68 68 THR N N 68 111.983 111.983 114.511 -2.528 19707 6381 1 13 . 1 1 68 68 THR HA H 68 4.277 4.277 4.249 0.028 19707 6382 1 13 . 1 1 68 68 THR C C 68 171.720 171.720 175.559 -3.839 19707 6383 1 13 . 1 1 68 68 THR CA C 68 58.193 58.193 63.114 -4.921 19707 6384 1 13 . 1 1 68 68 THR CB C 68 67.723 67.723 69.218 -1.495 19707 6385 1 13 . 1 1 68 68 THR H H 68 8.091 8.091 8.305 -0.214 19707 6386 1 13 . 1 1 69 69 GLY N N 69 109.918 109.918 108.864 1.054 19707 6387 1 13 . 1 1 69 69 GLY C C 69 170.783 170.783 174.406 -3.623 19707 6388 1 13 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.712 -2.656 19707 6389 1 13 . 1 1 69 69 GLY H H 69 8.119 8.119 8.016 0.103 19707 6390 1 13 . 1 1 70 70 ASP N N 70 123.294 123.294 124.853 -1.559 19707 6391 1 13 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.814 -0.265 19707 6392 1 13 . 1 1 70 70 ASP C C 70 173.651 173.651 175.185 -1.534 19707 6393 1 13 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.816 -2.954 19707 6394 1 13 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.000 -1.267 19707 6395 1 13 . 1 1 70 70 ASP H H 70 8.444 8.444 8.768 -0.324 19707 6396 1 13 . 1 1 71 71 VAL N N 71 117.772 117.772 113.100 4.672 19707 6397 1 13 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.084 -0.377 19707 6398 1 13 . 1 1 71 71 VAL C C 71 172.992 172.992 174.278 -1.286 19707 6399 1 13 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.229 -1.853 19707 6400 1 13 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.623 -2.601 19707 6401 1 13 . 1 1 71 71 VAL H H 71 8.173 8.173 7.698 0.475 19707 6402 1 13 . 1 1 72 72 LEU N N 72 123.435 123.435 123.059 0.376 19707 6403 1 13 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.569 0.067 19707 6404 1 13 . 1 1 72 72 LEU C C 72 173.189 173.189 175.992 -2.803 19707 6405 1 13 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.358 -3.151 19707 6406 1 13 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.339 -1.701 19707 6407 1 13 . 1 1 72 72 LEU H H 72 8.859 8.859 8.870 -0.011 19707 6408 1 13 . 1 1 73 73 GLN N N 73 119.520 119.520 121.830 -2.310 19707 6409 1 13 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.139 0.206 19707 6410 1 13 . 1 1 73 73 GLN C C 73 172.249 172.249 175.752 -3.503 19707 6411 1 13 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.511 -3.178 19707 6412 1 13 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.279 -1.510 19707 6413 1 13 . 1 1 73 73 GLN H H 73 9.196 9.196 8.323 0.873 19707 6414 1 13 . 1 1 74 74 GLY N N 74 113.513 113.513 111.846 1.667 19707 6415 1 13 . 1 1 74 74 GLY C C 74 169.072 169.072 172.018 -2.946 19707 6416 1 13 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.930 -2.633 19707 6417 1 13 . 1 1 74 74 GLY H H 74 9.373 9.373 9.131 0.242 19707 6418 1 13 . 1 1 75 75 ARG N N 75 122.479 122.479 124.202 -1.723 19707 6419 1 13 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.342 0.160 19707 6420 1 13 . 1 1 75 75 ARG C C 75 172.348 172.348 174.011 -1.663 19707 6421 1 13 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.718 -3.961 19707 6422 1 13 . 1 1 75 75 ARG CB C 75 31.818 31.818 33.741 -1.923 19707 6423 1 13 . 1 1 75 75 ARG H H 75 8.615 8.615 8.408 0.207 19707 6424 1 13 . 1 1 76 76 ALA N N 76 122.346 122.346 128.544 -6.198 19707 6425 1 13 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.780 -0.244 19707 6426 1 13 . 1 1 76 76 ALA C C 76 172.704 172.704 175.030 -2.326 19707 6427 1 13 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.197 -2.170 19707 6428 1 13 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.808 -2.783 19707 6429 1 13 . 1 1 76 76 ALA H H 76 8.590 8.590 9.190 -0.600 19707 6430 1 13 . 1 1 77 77 THR N N 77 116.961 116.961 115.800 1.161 19707 6431 1 13 . 1 1 77 77 THR HA H 77 4.988 4.988 5.129 -0.141 19707 6432 1 13 . 1 1 77 77 THR C C 77 172.800 172.800 175.019 -2.219 19707 6433 1 13 . 1 1 77 77 THR CA C 77 58.344 58.344 61.370 -3.026 19707 6434 1 13 . 1 1 77 77 THR CB C 77 67.712 67.712 70.762 -3.050 19707 6435 1 13 . 1 1 77 77 THR H H 77 8.491 8.491 8.287 0.204 19707 6436 1 13 . 1 1 78 78 GLY N N 78 111.103 111.103 111.965 -0.862 19707 6437 1 13 . 1 1 78 78 GLY C C 78 172.567 172.567 174.896 -2.329 19707 6438 1 13 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.703 -2.394 19707 6439 1 13 . 1 1 78 78 GLY H H 78 8.649 8.649 8.738 -0.089 19707 6440 1 13 . 1 1 79 79 GLU N N 79 123.423 123.423 119.489 3.934 19707 6441 1 13 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.321 -0.325 19707 6442 1 13 . 1 1 79 79 GLU C C 79 175.466 175.466 177.420 -1.954 19707 6443 1 13 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.987 -2.528 19707 6444 1 13 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.602 -3.535 19707 6445 1 13 . 1 1 79 79 GLU H H 79 10.375 10.375 8.775 1.600 19707 6446 1 13 . 1 1 80 80 GLU N N 80 113.846 113.846 117.323 -3.477 19707 6447 1 13 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.422 -0.064 19707 6448 1 13 . 1 1 80 80 GLU C C 80 173.293 173.293 176.991 -3.698 19707 6449 1 13 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.923 -4.147 19707 6450 1 13 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.480 -4.749 19707 6451 1 13 . 1 1 80 80 GLU H H 80 7.679 7.679 8.413 -0.734 19707 6452 1 13 . 1 1 81 81 GLY N N 81 105.493 105.493 107.882 -2.389 19707 6453 1 13 . 1 1 81 81 GLY C C 81 170.427 170.427 173.671 -3.244 19707 6454 1 13 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.293 -2.681 19707 6455 1 13 . 1 1 81 81 GLY H H 81 7.476 7.476 7.585 -0.109 19707 6456 1 13 . 1 1 82 82 GLU N N 82 122.160 122.160 120.065 2.095 19707 6457 1 13 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.348 0.606 19707 6458 1 13 . 1 1 82 82 GLU C C 82 171.004 171.004 174.806 -3.802 19707 6459 1 13 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.360 -4.039 19707 6460 1 13 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.210 -5.144 19707 6461 1 13 . 1 1 82 82 GLU H H 82 9.585 9.585 8.095 1.490 19707 6462 1 13 . 1 1 83 83 THR N N 83 114.756 114.756 115.524 -0.768 19707 6463 1 13 . 1 1 83 83 THR HA H 83 4.990 4.990 5.140 -0.150 19707 6464 1 13 . 1 1 83 83 THR C C 83 170.909 170.909 173.463 -2.554 19707 6465 1 13 . 1 1 83 83 THR CA C 83 57.957 57.957 62.084 -4.128 19707 6466 1 13 . 1 1 83 83 THR CB C 83 68.271 68.271 71.735 -3.464 19707 6467 1 13 . 1 1 83 83 THR H H 83 8.490 8.490 8.328 0.162 19707 6468 1 13 . 1 1 84 84 VAL N N 84 122.639 122.639 125.425 -2.786 19707 6469 1 13 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.601 0.054 19707 6470 1 13 . 1 1 84 84 VAL C C 84 170.962 170.962 173.551 -2.589 19707 6471 1 13 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.910 -2.613 19707 6472 1 13 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.146 -2.922 19707 6473 1 13 . 1 1 84 84 VAL H H 84 9.001 9.001 9.020 -0.019 19707 6474 1 13 . 1 1 85 85 LEU N N 85 129.903 129.903 127.666 2.237 19707 6475 1 13 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.518 -0.126 19707 6476 1 13 . 1 1 85 85 LEU C C 85 172.346 172.346 174.481 -2.135 19707 6477 1 13 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.149 -2.352 19707 6478 1 13 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.864 -4.349 19707 6479 1 13 . 1 1 85 85 LEU H H 85 8.610 8.610 8.955 -0.345 19707 6480 1 13 . 1 1 86 86 VAL N N 86 122.778 122.778 123.106 -0.328 19707 6481 1 13 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.896 0.145 19707 6482 1 13 . 1 1 86 86 VAL C C 86 172.570 172.570 174.564 -1.994 19707 6483 1 13 . 1 1 86 86 VAL CA C 86 57.200 57.200 60.536 -3.336 19707 6484 1 13 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.003 -2.728 19707 6485 1 13 . 1 1 86 86 VAL H H 86 9.228 9.228 9.074 0.154 19707 6486 1 13 . 1 1 87 87 GLU N N 87 120.437 120.437 125.572 -5.135 19707 6487 1 13 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.516 0.215 19707 6488 1 13 . 1 1 87 87 GLU C C 87 172.267 172.267 175.122 -2.855 19707 6489 1 13 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.600 -3.251 19707 6490 1 13 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.694 -2.570 19707 6491 1 13 . 1 1 87 87 GLU H H 87 8.851 8.851 9.327 -0.476 19707 6492 1 13 . 1 1 88 88 GLU N N 88 118.525 118.525 122.722 -4.197 19707 6493 1 13 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.787 0.214 19707 6494 1 13 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.027 -3.110 19707 6495 1 13 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.870 -2.923 19707 6496 1 13 . 1 1 88 88 GLU H H 88 8.380 8.380 8.644 -0.264 19707 6497 1 13 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.392 0.137 19707 6498 1 13 . 1 1 89 89 PRO C C 89 172.774 172.774 176.747 -3.973 19707 6499 1 13 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.170 -2.789 19707 6500 1 13 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.069 -2.735 19707 6501 1 14 . 1 1 2 2 SER N N 2 115.963 115.963 115.474 0.489 19707 6502 1 14 . 1 1 2 2 SER HA H 2 4.408 4.408 4.425 -0.017 19707 6503 1 14 . 1 1 2 2 SER C C 2 171.788 171.788 175.201 -3.413 19707 6504 1 14 . 1 1 2 2 SER CA C 2 55.870 55.870 58.230 -2.360 19707 6505 1 14 . 1 1 2 2 SER CB C 2 61.022 61.022 63.650 -2.628 19707 6506 1 14 . 1 1 2 2 SER H H 2 8.661 8.661 8.332 0.329 19707 6507 1 14 . 1 1 3 3 GLU N N 3 122.941 122.941 122.672 0.269 19707 6508 1 14 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.339 -0.019 19707 6509 1 14 . 1 1 3 3 GLU C C 3 173.817 173.817 174.977 -1.160 19707 6510 1 14 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.798 -2.844 19707 6511 1 14 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.249 -3.412 19707 6512 1 14 . 1 1 3 3 GLU H H 3 8.706 8.706 7.832 0.874 19707 6513 1 14 . 1 1 4 4 THR N N 4 116.182 116.182 117.673 -1.491 19707 6514 1 14 . 1 1 4 4 THR HA H 4 4.233 4.233 4.448 -0.215 19707 6515 1 14 . 1 1 4 4 THR C C 4 171.719 171.719 173.327 -1.608 19707 6516 1 14 . 1 1 4 4 THR CA C 4 59.414 59.414 61.770 -2.356 19707 6517 1 14 . 1 1 4 4 THR CB C 4 67.009 67.009 70.143 -3.134 19707 6518 1 14 . 1 1 4 4 THR H H 4 8.165 8.165 8.121 0.044 19707 6519 1 14 . 1 1 5 5 ARG N N 5 124.184 124.184 123.147 1.037 19707 6520 1 14 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.568 -0.208 19707 6521 1 14 . 1 1 5 5 ARG C C 5 173.520 173.520 176.118 -2.598 19707 6522 1 14 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.989 -2.646 19707 6523 1 14 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.879 -2.714 19707 6524 1 14 . 1 1 5 5 ARG H H 5 8.354 8.354 8.640 -0.286 19707 6525 1 14 . 1 1 6 6 THR N N 6 116.652 116.652 120.913 -4.261 19707 6526 1 14 . 1 1 6 6 THR HA H 6 4.263 4.263 4.338 -0.075 19707 6527 1 14 . 1 1 6 6 THR C C 6 171.784 171.784 174.078 -2.294 19707 6528 1 14 . 1 1 6 6 THR CA C 6 59.218 59.218 63.248 -4.030 19707 6529 1 14 . 1 1 6 6 THR CB C 6 67.213 67.213 69.420 -2.207 19707 6530 1 14 . 1 1 6 6 THR H H 6 8.224 8.224 8.674 -0.450 19707 6531 1 14 . 1 1 7 7 ILE N N 7 123.882 123.882 123.383 0.499 19707 6532 1 14 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.418 -0.280 19707 6533 1 14 . 1 1 7 7 ILE C C 7 173.572 173.572 175.565 -1.993 19707 6534 1 14 . 1 1 7 7 ILE CA C 7 58.482 58.482 61.112 -2.630 19707 6535 1 14 . 1 1 7 7 ILE CB C 7 36.069 36.069 40.023 -3.954 19707 6536 1 14 . 1 1 7 7 ILE H H 7 8.247 8.247 8.186 0.061 19707 6537 1 14 . 1 1 8 8 SER N N 8 120.287 120.287 121.622 -1.335 19707 6538 1 14 . 1 1 8 8 SER HA H 8 4.445 4.445 4.797 -0.352 19707 6539 1 14 . 1 1 8 8 SER C C 8 171.926 171.926 174.396 -2.470 19707 6540 1 14 . 1 1 8 8 SER CA C 8 55.522 55.522 57.137 -1.615 19707 6541 1 14 . 1 1 8 8 SER CB C 8 61.073 61.073 65.232 -4.159 19707 6542 1 14 . 1 1 8 8 SER H H 8 8.402 8.402 8.637 -0.235 19707 6543 1 14 . 1 1 9 9 SER N N 9 118.425 118.425 121.729 -3.304 19707 6544 1 14 . 1 1 9 9 SER HA H 9 4.525 4.525 4.420 0.105 19707 6545 1 14 . 1 1 9 9 SER C C 9 172.663 172.663 174.214 -1.551 19707 6546 1 14 . 1 1 9 9 SER CA C 9 55.897 55.897 59.098 -3.201 19707 6547 1 14 . 1 1 9 9 SER CB C 9 61.375 61.375 61.776 -0.401 19707 6548 1 14 . 1 1 9 9 SER H H 9 8.362 8.362 9.016 -0.654 19707 6549 1 14 . 1 1 10 10 THR N N 10 115.676 115.676 113.912 1.764 19707 6550 1 14 . 1 1 10 10 THR HA H 10 4.232 4.232 4.386 -0.154 19707 6551 1 14 . 1 1 10 10 THR C C 10 173.070 173.070 175.836 -2.766 19707 6552 1 14 . 1 1 10 10 THR CA C 10 60.318 60.318 63.045 -2.727 19707 6553 1 14 . 1 1 10 10 THR CB C 10 67.205 67.205 68.910 -1.705 19707 6554 1 14 . 1 1 10 10 THR H H 10 8.274 8.274 8.199 0.075 19707 6555 1 14 . 1 1 11 11 ALA N N 11 124.726 124.726 124.810 -0.084 19707 6556 1 14 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.269 -0.282 19707 6557 1 14 . 1 1 11 11 ALA C C 11 176.825 176.825 179.434 -2.609 19707 6558 1 14 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.802 -2.261 19707 6559 1 14 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.146 -2.257 19707 6560 1 14 . 1 1 11 11 ALA H H 11 8.347 8.347 8.176 0.171 19707 6561 1 14 . 1 1 12 12 GLN N N 12 117.915 117.915 117.449 0.466 19707 6562 1 14 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.154 -0.365 19707 6563 1 14 . 1 1 12 12 GLN C C 12 174.697 174.697 177.812 -3.115 19707 6564 1 14 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.726 -2.722 19707 6565 1 14 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.703 -2.478 19707 6566 1 14 . 1 1 12 12 GLN H H 12 8.194 8.194 8.068 0.126 19707 6567 1 14 . 1 1 13 13 GLU N N 13 118.510 118.510 120.123 -1.613 19707 6568 1 14 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.113 -0.010 19707 6569 1 14 . 1 1 13 13 GLU C C 13 176.192 176.192 179.131 -2.939 19707 6570 1 14 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.842 -2.527 19707 6571 1 14 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.615 -3.582 19707 6572 1 14 . 1 1 13 13 GLU H H 13 7.917 7.917 8.127 -0.210 19707 6573 1 14 . 1 1 14 14 ARG N N 14 118.193 118.193 119.390 -1.197 19707 6574 1 14 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.046 -0.078 19707 6575 1 14 . 1 1 14 14 ARG C C 14 176.764 176.764 178.506 -1.742 19707 6576 1 14 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.116 -1.833 19707 6577 1 14 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.622 -2.385 19707 6578 1 14 . 1 1 14 14 ARG H H 14 7.907 7.907 8.024 -0.117 19707 6579 1 14 . 1 1 15 15 VAL N N 15 117.991 117.991 114.464 3.527 19707 6580 1 14 . 1 1 15 15 VAL HA H 15 3.903 3.903 4.136 -0.233 19707 6581 1 14 . 1 1 15 15 VAL C C 15 174.922 174.922 177.147 -2.225 19707 6582 1 14 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.134 -1.303 19707 6583 1 14 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.526 -2.803 19707 6584 1 14 . 1 1 15 15 VAL H H 15 7.658 7.658 7.518 0.140 19707 6585 1 14 . 1 1 16 16 ASP N N 16 124.314 124.314 120.920 3.394 19707 6586 1 14 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.424 -0.108 19707 6587 1 14 . 1 1 16 16 ASP C C 16 176.462 176.462 178.138 -1.676 19707 6588 1 14 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.344 -2.018 19707 6589 1 14 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.454 -4.785 19707 6590 1 14 . 1 1 16 16 ASP H H 16 8.291 8.291 7.943 0.348 19707 6591 1 14 . 1 1 17 17 LEU N N 17 120.212 120.212 119.245 0.967 19707 6592 1 14 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.123 -0.069 19707 6593 1 14 . 1 1 17 17 LEU C C 17 177.171 177.171 179.047 -1.876 19707 6594 1 14 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.772 -2.792 19707 6595 1 14 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.307 -2.462 19707 6596 1 14 . 1 1 17 17 LEU H H 17 8.172 8.172 7.489 0.683 19707 6597 1 14 . 1 1 18 18 GLU N N 18 120.587 120.587 119.503 1.084 19707 6598 1 14 . 1 1 18 18 GLU HA H 18 4.193 4.193 4.034 0.159 19707 6599 1 14 . 1 1 18 18 GLU C C 18 175.997 175.997 178.713 -2.716 19707 6600 1 14 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.353 -3.251 19707 6601 1 14 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.919 -2.847 19707 6602 1 14 . 1 1 18 18 GLU H H 18 7.876 7.876 7.812 0.064 19707 6603 1 14 . 1 1 19 19 ALA N N 19 121.800 121.800 122.948 -1.148 19707 6604 1 14 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.100 -0.309 19707 6605 1 14 . 1 1 19 19 ALA C C 19 175.708 175.708 179.634 -3.926 19707 6606 1 14 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.919 -2.067 19707 6607 1 14 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.482 -4.328 19707 6608 1 14 . 1 1 19 19 ALA H H 19 7.792 7.792 7.538 0.254 19707 6609 1 14 . 1 1 20 20 VAL N N 20 118.680 118.680 119.579 -0.899 19707 6610 1 14 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.642 -0.342 19707 6611 1 14 . 1 1 20 20 VAL C C 20 176.276 176.276 177.946 -1.670 19707 6612 1 14 . 1 1 20 20 VAL CA C 20 63.807 63.807 67.223 -3.416 19707 6613 1 14 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.443 -1.892 19707 6614 1 14 . 1 1 20 20 VAL H H 20 7.712 7.712 8.342 -0.630 19707 6615 1 14 . 1 1 21 21 ARG N N 21 121.935 121.935 120.679 1.256 19707 6616 1 14 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.073 -0.078 19707 6617 1 14 . 1 1 21 21 ARG C C 21 176.828 176.828 178.602 -1.774 19707 6618 1 14 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.503 -1.843 19707 6619 1 14 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.553 -2.263 19707 6620 1 14 . 1 1 21 21 ARG H H 21 8.444 8.444 8.316 0.128 19707 6621 1 14 . 1 1 22 22 LEU N N 22 119.327 119.327 119.481 -0.154 19707 6622 1 14 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.053 -0.058 19707 6623 1 14 . 1 1 22 22 LEU C C 22 175.664 175.664 178.289 -2.625 19707 6624 1 14 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.368 -3.500 19707 6625 1 14 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.709 -2.574 19707 6626 1 14 . 1 1 22 22 LEU H H 22 8.248 8.248 8.163 0.085 19707 6627 1 14 . 1 1 23 23 ALA N N 23 121.202 121.202 122.434 -1.232 19707 6628 1 14 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.907 -0.172 19707 6629 1 14 . 1 1 23 23 ALA C C 23 175.492 175.492 179.449 -3.957 19707 6630 1 14 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.324 -2.255 19707 6631 1 14 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.944 -3.877 19707 6632 1 14 . 1 1 23 23 ALA H H 23 8.392 8.392 8.611 -0.219 19707 6633 1 14 . 1 1 24 24 SER N N 24 112.377 112.377 115.025 -2.648 19707 6634 1 14 . 1 1 24 24 SER HA H 24 4.214 4.214 4.262 -0.048 19707 6635 1 14 . 1 1 24 24 SER C C 24 174.773 174.773 176.352 -1.579 19707 6636 1 14 . 1 1 24 24 SER CA C 24 59.258 59.258 62.394 -3.136 19707 6637 1 14 . 1 1 24 24 SER CB C 24 60.149 60.149 63.061 -2.912 19707 6638 1 14 . 1 1 24 24 SER H H 24 7.690 7.690 8.153 -0.463 19707 6639 1 14 . 1 1 25 25 ILE N N 25 123.886 123.886 122.160 1.726 19707 6640 1 14 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.157 -0.315 19707 6641 1 14 . 1 1 25 25 ILE C C 25 176.487 176.487 178.243 -1.756 19707 6642 1 14 . 1 1 25 25 ILE CA C 25 61.993 61.993 61.956 0.037 19707 6643 1 14 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.366 -0.434 19707 6644 1 14 . 1 1 25 25 ILE H H 25 7.837 7.837 7.976 -0.139 19707 6645 1 14 . 1 1 26 26 VAL N N 26 122.538 122.538 122.405 0.133 19707 6646 1 14 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.668 -0.280 19707 6647 1 14 . 1 1 26 26 VAL C C 26 174.624 174.624 178.254 -3.630 19707 6648 1 14 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.190 -2.275 19707 6649 1 14 . 1 1 26 26 VAL CB C 26 27.895 27.895 30.709 -2.814 19707 6650 1 14 . 1 1 26 26 VAL H H 26 8.804 8.804 8.745 0.059 19707 6651 1 14 . 1 1 27 27 ASP N N 27 120.433 120.433 120.556 -0.123 19707 6652 1 14 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.345 -0.181 19707 6653 1 14 . 1 1 27 27 ASP C C 27 174.966 174.966 179.036 -4.070 19707 6654 1 14 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.843 -2.514 19707 6655 1 14 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.201 -2.347 19707 6656 1 14 . 1 1 27 27 ASP H H 27 8.719 8.719 8.603 0.116 19707 6657 1 14 . 1 1 28 28 SER N N 28 112.397 112.397 114.338 -1.941 19707 6658 1 14 . 1 1 28 28 SER HA H 28 4.073 4.073 4.168 -0.095 19707 6659 1 14 . 1 1 28 28 SER C C 28 174.405 174.405 176.821 -2.416 19707 6660 1 14 . 1 1 28 28 SER CA C 28 59.115 59.115 61.101 -1.986 19707 6661 1 14 . 1 1 28 28 SER CB C 28 60.125 60.125 63.412 -3.287 19707 6662 1 14 . 1 1 28 28 SER H H 28 7.599 7.599 8.474 -0.875 19707 6663 1 14 . 1 1 29 29 ARG N N 29 123.945 123.945 122.399 1.546 19707 6664 1 14 . 1 1 29 29 ARG HA H 29 4.027 4.027 4.098 -0.071 19707 6665 1 14 . 1 1 29 29 ARG C C 29 175.902 175.902 178.064 -2.162 19707 6666 1 14 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.919 -3.645 19707 6667 1 14 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.292 -1.552 19707 6668 1 14 . 1 1 29 29 ARG H H 29 7.769 7.769 7.341 0.428 19707 6669 1 14 . 1 1 30 30 LEU N N 30 121.580 121.580 120.901 0.679 19707 6670 1 14 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.972 -0.223 19707 6671 1 14 . 1 1 30 30 LEU C C 30 177.474 177.474 179.598 -2.124 19707 6672 1 14 . 1 1 30 30 LEU CA C 30 55.313 55.313 58.000 -2.687 19707 6673 1 14 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.839 -2.810 19707 6674 1 14 . 1 1 30 30 LEU H H 30 8.665 8.665 8.305 0.360 19707 6675 1 14 . 1 1 31 31 ILE N N 31 119.330 119.330 117.702 1.628 19707 6676 1 14 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.793 -0.102 19707 6677 1 14 . 1 1 31 31 ILE C C 31 175.341 175.341 177.874 -2.533 19707 6678 1 14 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.139 -2.627 19707 6679 1 14 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.751 -2.184 19707 6680 1 14 . 1 1 31 31 ILE H H 31 8.226 8.226 8.541 -0.315 19707 6681 1 14 . 1 1 32 32 GLY N N 32 106.092 106.092 105.773 0.319 19707 6682 1 14 . 1 1 32 32 GLY C C 32 172.413 172.413 174.888 -2.475 19707 6683 1 14 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.580 -3.083 19707 6684 1 14 . 1 1 32 32 GLY H H 32 7.767 7.767 7.627 0.140 19707 6685 1 14 . 1 1 33 33 THR N N 33 110.966 110.966 112.595 -1.629 19707 6686 1 14 . 1 1 33 33 THR HA H 33 4.455 4.455 4.349 0.106 19707 6687 1 14 . 1 1 33 33 THR C C 33 172.714 172.714 174.682 -1.968 19707 6688 1 14 . 1 1 33 33 THR CA C 33 60.032 60.032 62.381 -2.349 19707 6689 1 14 . 1 1 33 33 THR CB C 33 68.287 68.287 69.772 -1.485 19707 6690 1 14 . 1 1 33 33 THR H H 33 8.102 8.102 7.901 0.201 19707 6691 1 14 . 1 1 34 34 GLY N N 34 110.320 110.320 110.822 -0.502 19707 6692 1 14 . 1 1 34 34 GLY C C 34 170.505 170.505 173.444 -2.939 19707 6693 1 14 . 1 1 34 34 GLY CA C 34 42.583 42.583 44.970 -2.387 19707 6694 1 14 . 1 1 34 34 GLY H H 34 8.072 8.072 8.189 -0.117 19707 6695 1 14 . 1 1 35 35 SER N N 35 112.944 112.944 113.437 -0.493 19707 6696 1 14 . 1 1 35 35 SER HA H 35 4.385 4.385 4.593 -0.208 19707 6697 1 14 . 1 1 35 35 SER C C 35 169.537 169.537 172.164 -2.627 19707 6698 1 14 . 1 1 35 35 SER CA C 35 54.794 54.794 58.072 -3.279 19707 6699 1 14 . 1 1 35 35 SER CB C 35 62.029 62.029 64.455 -2.426 19707 6700 1 14 . 1 1 35 35 SER H H 35 7.719 7.719 7.446 0.273 19707 6701 1 14 . 1 1 36 36 VAL N N 36 118.566 118.566 122.651 -4.085 19707 6702 1 14 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.303 -0.270 19707 6703 1 14 . 1 1 36 36 VAL C C 36 169.876 169.876 173.824 -3.948 19707 6704 1 14 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.802 -2.237 19707 6705 1 14 . 1 1 36 36 VAL CB C 36 30.952 30.952 34.013 -3.061 19707 6706 1 14 . 1 1 36 36 VAL H H 36 8.490 8.490 8.486 0.004 19707 6707 1 14 . 1 1 37 37 ASP N N 37 121.640 121.640 126.673 -5.033 19707 6708 1 14 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.933 -0.131 19707 6709 1 14 . 1 1 37 37 ASP C C 37 172.806 172.806 175.993 -3.187 19707 6710 1 14 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.839 -3.796 19707 6711 1 14 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.637 -3.431 19707 6712 1 14 . 1 1 37 37 ASP H H 37 7.195 7.195 8.166 -0.971 19707 6713 1 14 . 1 1 38 38 GLU N N 38 120.018 120.018 120.828 -0.810 19707 6714 1 14 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.957 -0.300 19707 6715 1 14 . 1 1 38 38 GLU C C 38 174.753 174.753 178.282 -3.529 19707 6716 1 14 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.051 -2.559 19707 6717 1 14 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.984 -3.905 19707 6718 1 14 . 1 1 38 38 GLU H H 38 8.908 8.908 8.714 0.194 19707 6719 1 14 . 1 1 39 39 ASP N N 39 118.668 118.668 117.610 1.058 19707 6720 1 14 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.480 -0.234 19707 6721 1 14 . 1 1 39 39 ASP C C 39 175.393 175.393 177.906 -2.513 19707 6722 1 14 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.379 -1.515 19707 6723 1 14 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.529 -3.559 19707 6724 1 14 . 1 1 39 39 ASP H H 39 8.242 8.242 8.635 -0.393 19707 6725 1 14 . 1 1 40 40 PHE N N 40 119.851 119.851 118.614 1.237 19707 6726 1 14 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.402 -0.198 19707 6727 1 14 . 1 1 40 40 PHE C C 40 174.929 174.929 176.545 -1.616 19707 6728 1 14 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.505 -2.333 19707 6729 1 14 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.965 -3.132 19707 6730 1 14 . 1 1 40 40 PHE H H 40 8.037 8.037 7.794 0.243 19707 6731 1 14 . 1 1 41 41 LEU N N 41 117.882 117.882 118.805 -0.923 19707 6732 1 14 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.232 -0.710 19707 6733 1 14 . 1 1 41 41 LEU C C 41 175.938 175.938 178.894 -2.956 19707 6734 1 14 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.802 -1.942 19707 6735 1 14 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.416 -3.185 19707 6736 1 14 . 1 1 41 41 LEU H H 41 7.816 7.816 7.816 -0.000 19707 6737 1 14 . 1 1 42 42 ARG N N 42 118.360 118.360 118.576 -0.216 19707 6738 1 14 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.018 -0.278 19707 6739 1 14 . 1 1 42 42 ARG C C 42 175.435 175.435 177.318 -1.883 19707 6740 1 14 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.002 -2.031 19707 6741 1 14 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.759 -2.495 19707 6742 1 14 . 1 1 42 42 ARG H H 42 8.540 8.540 8.131 0.409 19707 6743 1 14 . 1 1 43 43 GLU N N 43 114.947 114.947 117.694 -2.747 19707 6744 1 14 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.197 -0.147 19707 6745 1 14 . 1 1 43 43 GLU C C 43 174.518 174.518 177.688 -3.170 19707 6746 1 14 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.701 -3.130 19707 6747 1 14 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.329 -3.288 19707 6748 1 14 . 1 1 43 43 GLU H H 43 7.223 7.223 8.321 -1.098 19707 6749 1 14 . 1 1 44 44 GLN N N 44 114.109 114.109 117.794 -3.685 19707 6750 1 14 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.256 -0.150 19707 6751 1 14 . 1 1 44 44 GLN C C 44 173.777 173.777 178.052 -4.275 19707 6752 1 14 . 1 1 44 44 GLN CA C 44 52.181 52.181 56.466 -4.285 19707 6753 1 14 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.379 -3.509 19707 6754 1 14 . 1 1 44 44 GLN H H 44 7.372 7.372 7.935 -0.563 19707 6755 1 14 . 1 1 45 45 ILE N N 45 117.470 117.470 115.706 1.764 19707 6756 1 14 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.670 0.278 19707 6757 1 14 . 1 1 45 45 ILE C C 45 172.305 172.305 176.641 -4.336 19707 6758 1 14 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.889 -5.384 19707 6759 1 14 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.458 -1.758 19707 6760 1 14 . 1 1 45 45 ILE H H 45 7.235 7.235 7.444 -0.209 19707 6761 1 14 . 1 1 46 46 ARG N N 46 122.996 122.996 115.636 7.360 19707 6762 1 14 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.853 0.337 19707 6763 1 14 . 1 1 46 46 ARG C C 46 172.992 172.992 175.308 -2.316 19707 6764 1 14 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.040 -4.279 19707 6765 1 14 . 1 1 46 46 ARG CB C 46 27.952 27.952 27.968 -0.016 19707 6766 1 14 . 1 1 46 46 ARG H H 46 8.336 8.336 8.433 -0.097 19707 6767 1 14 . 1 1 47 47 ASP N N 47 118.676 118.676 113.858 4.818 19707 6768 1 14 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.521 -0.073 19707 6769 1 14 . 1 1 47 47 ASP C C 47 172.520 172.520 174.932 -2.412 19707 6770 1 14 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.068 -2.178 19707 6771 1 14 . 1 1 47 47 ASP CB C 47 37.657 37.657 41.381 -3.724 19707 6772 1 14 . 1 1 47 47 ASP H H 47 8.313 8.313 8.042 0.271 19707 6773 1 14 . 1 1 48 48 ALA N N 48 120.922 120.922 122.907 -1.985 19707 6774 1 14 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.250 0.119 19707 6775 1 14 . 1 1 48 48 ALA C C 48 174.295 174.295 177.882 -3.587 19707 6776 1 14 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.279 -2.642 19707 6777 1 14 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.527 -3.313 19707 6778 1 14 . 1 1 48 48 ALA H H 48 7.824 7.824 7.802 0.022 19707 6779 1 14 . 1 1 49 49 ARG N N 49 118.644 118.644 123.432 -4.788 19707 6780 1 14 . 1 1 49 49 ARG HA H 49 4.342 4.342 3.889 0.453 19707 6781 1 14 . 1 1 49 49 ARG C C 49 172.504 172.504 176.443 -3.939 19707 6782 1 14 . 1 1 49 49 ARG CA C 49 53.909 53.909 58.110 -4.201 19707 6783 1 14 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.409 -2.066 19707 6784 1 14 . 1 1 49 49 ARG H H 49 7.911 7.911 8.947 -1.036 19707 6785 1 14 . 1 1 50 50 TYR N N 50 119.470 119.470 114.175 5.295 19707 6786 1 14 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.020 0.271 19707 6787 1 14 . 1 1 50 50 TYR C C 50 170.470 170.470 174.240 -3.770 19707 6788 1 14 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.279 -2.011 19707 6789 1 14 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.139 -0.626 19707 6790 1 14 . 1 1 50 50 TYR H H 50 7.639 7.639 8.006 -0.367 19707 6791 1 14 . 1 1 51 51 ALA N N 51 127.418 127.418 125.642 1.776 19707 6792 1 14 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.160 0.061 19707 6793 1 14 . 1 1 51 51 ALA C C 51 171.328 171.328 175.443 -4.115 19707 6794 1 14 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.431 -2.998 19707 6795 1 14 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.479 -1.167 19707 6796 1 14 . 1 1 51 51 ALA H H 51 8.222 8.222 8.755 -0.533 19707 6797 1 14 . 1 1 52 52 VAL N N 52 117.832 117.832 121.293 -3.461 19707 6798 1 14 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.087 -0.420 19707 6799 1 14 . 1 1 52 52 VAL C C 52 172.436 172.436 174.359 -1.923 19707 6800 1 14 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.247 -3.490 19707 6801 1 14 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.599 -4.496 19707 6802 1 14 . 1 1 52 52 VAL H H 52 8.753 8.753 9.067 -0.314 19707 6803 1 14 . 1 1 53 53 ILE N N 53 128.027 128.027 125.760 2.267 19707 6804 1 14 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.532 0.310 19707 6805 1 14 . 1 1 53 53 ILE C C 53 172.110 172.110 174.471 -2.361 19707 6806 1 14 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.607 -2.854 19707 6807 1 14 . 1 1 53 53 ILE CB C 53 37.159 37.159 39.744 -2.585 19707 6808 1 14 . 1 1 53 53 ILE H H 53 9.261 9.261 9.023 0.238 19707 6809 1 14 . 1 1 54 54 ARG N N 54 127.885 127.885 127.890 -0.005 19707 6810 1 14 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.659 0.094 19707 6811 1 14 . 1 1 54 54 ARG C C 54 172.285 172.285 174.386 -2.101 19707 6812 1 14 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.437 -1.177 19707 6813 1 14 . 1 1 54 54 ARG CB C 54 27.892 27.892 29.640 -1.748 19707 6814 1 14 . 1 1 54 54 ARG H H 54 8.686 8.686 8.674 0.012 19707 6815 1 14 . 1 1 55 55 ILE N N 55 129.907 129.907 123.296 6.611 19707 6816 1 14 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.235 -0.082 19707 6817 1 14 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.800 -3.205 19707 6818 1 14 . 1 1 55 55 ILE CB C 55 37.613 37.613 38.337 -0.724 19707 6819 1 14 . 1 1 55 55 ILE H H 55 9.292 9.292 7.954 1.338 19707 6820 1 14 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.301 -0.109 19707 6821 1 14 . 1 1 56 56 PRO C C 56 174.787 174.787 177.681 -2.894 19707 6822 1 14 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.081 -2.347 19707 6823 1 14 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.886 -2.973 19707 6824 1 14 . 1 1 57 57 GLY N N 57 111.828 111.828 111.047 0.781 19707 6825 1 14 . 1 1 57 57 GLY C C 57 171.039 171.039 173.572 -2.533 19707 6826 1 14 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.993 -2.176 19707 6827 1 14 . 1 1 57 57 GLY H H 57 8.708 8.708 8.912 -0.204 19707 6828 1 14 . 1 1 58 58 GLN N N 58 118.457 118.457 119.732 -1.275 19707 6829 1 14 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.843 0.057 19707 6830 1 14 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.044 -2.772 19707 6831 1 14 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.951 -2.797 19707 6832 1 14 . 1 1 58 58 GLN H H 58 7.909 7.909 7.556 0.353 19707 6833 1 14 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.488 -0.052 19707 6834 1 14 . 1 1 59 59 PRO C C 59 174.607 174.607 176.329 -1.722 19707 6835 1 14 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.816 -2.761 19707 6836 1 14 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.217 -3.040 19707 6837 1 14 . 1 1 60 60 VAL N N 60 122.695 122.695 120.969 1.726 19707 6838 1 14 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.101 -0.146 19707 6839 1 14 . 1 1 60 60 VAL C C 60 172.403 172.403 176.012 -3.609 19707 6840 1 14 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.974 -2.079 19707 6841 1 14 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.184 -2.542 19707 6842 1 14 . 1 1 60 60 VAL H H 60 8.364 8.364 8.381 -0.017 19707 6843 1 14 . 1 1 61 61 VAL N N 61 126.097 126.097 127.981 -1.884 19707 6844 1 14 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.379 -0.079 19707 6845 1 14 . 1 1 61 61 VAL C C 61 170.891 170.891 174.543 -3.652 19707 6846 1 14 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.498 -2.684 19707 6847 1 14 . 1 1 61 61 VAL CB C 61 31.198 31.198 33.514 -2.316 19707 6848 1 14 . 1 1 61 61 VAL H H 61 8.023 8.023 8.430 -0.407 19707 6849 1 14 . 1 1 62 62 GLU N N 62 126.097 126.097 126.070 0.027 19707 6850 1 14 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.975 0.184 19707 6851 1 14 . 1 1 62 62 GLU C C 62 172.252 172.252 175.460 -3.208 19707 6852 1 14 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.240 -3.700 19707 6853 1 14 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.218 -1.918 19707 6854 1 14 . 1 1 62 62 GLU H H 62 8.591 8.591 8.514 0.077 19707 6855 1 14 . 1 1 63 63 VAL N N 63 120.374 120.374 123.871 -3.497 19707 6856 1 14 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.379 0.014 19707 6857 1 14 . 1 1 63 63 VAL C C 63 171.040 171.040 176.867 -5.827 19707 6858 1 14 . 1 1 63 63 VAL CA C 63 57.833 57.833 62.168 -4.335 19707 6859 1 14 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.378 0.199 19707 6860 1 14 . 1 1 63 63 VAL H H 63 8.732 8.732 8.910 -0.178 19707 6861 1 14 . 1 1 64 64 GLY N N 64 109.935 109.935 115.278 -5.343 19707 6862 1 14 . 1 1 64 64 GLY C C 64 171.656 171.656 173.955 -2.299 19707 6863 1 14 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.222 -5.045 19707 6864 1 14 . 1 1 64 64 GLY H H 64 8.259 8.259 8.503 -0.244 19707 6865 1 14 . 1 1 65 65 THR N N 65 115.478 115.478 116.087 -0.609 19707 6866 1 14 . 1 1 65 65 THR HA H 65 4.342 4.342 4.372 -0.030 19707 6867 1 14 . 1 1 65 65 THR C C 65 170.663 170.663 172.143 -1.480 19707 6868 1 14 . 1 1 65 65 THR CA C 65 58.357 58.357 60.477 -2.120 19707 6869 1 14 . 1 1 65 65 THR CB C 65 67.923 67.923 71.963 -4.040 19707 6870 1 14 . 1 1 65 65 THR H H 65 8.123 8.123 7.589 0.534 19707 6871 1 14 . 1 1 66 66 LYS N N 66 130.775 130.775 123.835 6.940 19707 6872 1 14 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.099 -1.169 19707 6873 1 14 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.099 -1.909 19707 6874 1 14 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.877 -3.187 19707 6875 1 14 . 1 1 66 66 LYS H H 66 8.472 8.472 8.254 0.218 19707 6876 1 14 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.606 -0.195 19707 6877 1 14 . 1 1 67 67 PRO C C 67 173.211 173.211 176.847 -3.636 19707 6878 1 14 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.331 -2.765 19707 6879 1 14 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.613 -3.210 19707 6880 1 14 . 1 1 68 68 THR N N 68 111.983 111.983 114.196 -2.213 19707 6881 1 14 . 1 1 68 68 THR HA H 68 4.277 4.277 4.252 0.025 19707 6882 1 14 . 1 1 68 68 THR C C 68 171.720 171.720 175.543 -3.823 19707 6883 1 14 . 1 1 68 68 THR CA C 68 58.193 58.193 63.174 -4.981 19707 6884 1 14 . 1 1 68 68 THR CB C 68 67.723 67.723 69.213 -1.490 19707 6885 1 14 . 1 1 68 68 THR H H 68 8.091 8.091 8.296 -0.205 19707 6886 1 14 . 1 1 69 69 GLY N N 69 109.918 109.918 108.827 1.091 19707 6887 1 14 . 1 1 69 69 GLY C C 69 170.783 170.783 174.351 -3.568 19707 6888 1 14 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.715 -2.659 19707 6889 1 14 . 1 1 69 69 GLY H H 69 8.119 8.119 8.014 0.105 19707 6890 1 14 . 1 1 70 70 ASP N N 70 123.294 123.294 124.218 -0.924 19707 6891 1 14 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.811 -0.262 19707 6892 1 14 . 1 1 70 70 ASP C C 70 173.651 173.651 175.022 -1.371 19707 6893 1 14 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.694 -2.833 19707 6894 1 14 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.239 -1.506 19707 6895 1 14 . 1 1 70 70 ASP H H 70 8.444 8.444 8.772 -0.328 19707 6896 1 14 . 1 1 71 71 VAL N N 71 117.772 117.772 114.171 3.601 19707 6897 1 14 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.018 -0.311 19707 6898 1 14 . 1 1 71 71 VAL C C 71 172.992 172.992 174.475 -1.483 19707 6899 1 14 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.649 -2.273 19707 6900 1 14 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.710 -2.688 19707 6901 1 14 . 1 1 71 71 VAL H H 71 8.173 8.173 7.666 0.507 19707 6902 1 14 . 1 1 72 72 LEU N N 72 123.435 123.435 123.283 0.152 19707 6903 1 14 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.584 0.052 19707 6904 1 14 . 1 1 72 72 LEU C C 72 173.189 173.189 176.166 -2.977 19707 6905 1 14 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.312 -3.105 19707 6906 1 14 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.347 -1.709 19707 6907 1 14 . 1 1 72 72 LEU H H 72 8.859 8.859 8.921 -0.062 19707 6908 1 14 . 1 1 73 73 GLN N N 73 119.520 119.520 121.971 -2.451 19707 6909 1 14 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.100 0.245 19707 6910 1 14 . 1 1 73 73 GLN C C 73 172.249 172.249 175.805 -3.556 19707 6911 1 14 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.514 -3.181 19707 6912 1 14 . 1 1 73 73 GLN CB C 73 29.770 29.770 30.796 -1.026 19707 6913 1 14 . 1 1 73 73 GLN H H 73 9.196 9.196 8.383 0.813 19707 6914 1 14 . 1 1 74 74 GLY N N 74 113.513 113.513 111.921 1.592 19707 6915 1 14 . 1 1 74 74 GLY C C 74 169.072 169.072 172.152 -3.080 19707 6916 1 14 . 1 1 74 74 GLY CA C 74 41.297 41.297 44.091 -2.794 19707 6917 1 14 . 1 1 74 74 GLY H H 74 9.373 9.373 9.101 0.272 19707 6918 1 14 . 1 1 75 75 ARG N N 75 122.479 122.479 121.575 0.904 19707 6919 1 14 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.456 0.046 19707 6920 1 14 . 1 1 75 75 ARG C C 75 172.348 172.348 174.123 -1.775 19707 6921 1 14 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.560 -3.802 19707 6922 1 14 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.563 -2.745 19707 6923 1 14 . 1 1 75 75 ARG H H 75 8.615 8.615 8.334 0.281 19707 6924 1 14 . 1 1 76 76 ALA N N 76 122.346 122.346 123.626 -1.280 19707 6925 1 14 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.676 -0.140 19707 6926 1 14 . 1 1 76 76 ALA C C 76 172.704 172.704 174.669 -1.965 19707 6927 1 14 . 1 1 76 76 ALA CA C 76 49.027 49.027 52.100 -3.073 19707 6928 1 14 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.443 -2.418 19707 6929 1 14 . 1 1 76 76 ALA H H 76 8.590 8.590 8.498 0.092 19707 6930 1 14 . 1 1 77 77 THR N N 77 116.961 116.961 115.920 1.041 19707 6931 1 14 . 1 1 77 77 THR HA H 77 4.988 4.988 4.917 0.071 19707 6932 1 14 . 1 1 77 77 THR C C 77 172.800 172.800 174.787 -1.987 19707 6933 1 14 . 1 1 77 77 THR CA C 77 58.344 58.344 61.578 -3.234 19707 6934 1 14 . 1 1 77 77 THR CB C 77 67.712 67.712 70.481 -2.769 19707 6935 1 14 . 1 1 77 77 THR H H 77 8.491 8.491 8.286 0.205 19707 6936 1 14 . 1 1 78 78 GLY N N 78 111.103 111.103 112.773 -1.670 19707 6937 1 14 . 1 1 78 78 GLY C C 78 172.567 172.567 175.079 -2.512 19707 6938 1 14 . 1 1 78 78 GLY CA C 78 41.309 41.309 44.196 -2.887 19707 6939 1 14 . 1 1 78 78 GLY H H 78 8.649 8.649 9.035 -0.386 19707 6940 1 14 . 1 1 79 79 GLU N N 79 123.423 123.423 121.172 2.251 19707 6941 1 14 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.189 -0.193 19707 6942 1 14 . 1 1 79 79 GLU C C 79 175.466 175.466 177.333 -1.867 19707 6943 1 14 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.244 -2.785 19707 6944 1 14 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.753 -3.686 19707 6945 1 14 . 1 1 79 79 GLU H H 79 10.375 10.375 9.072 1.303 19707 6946 1 14 . 1 1 80 80 GLU N N 80 113.846 113.846 117.193 -3.347 19707 6947 1 14 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.434 -0.076 19707 6948 1 14 . 1 1 80 80 GLU C C 80 173.293 173.293 176.976 -3.683 19707 6949 1 14 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.736 -3.960 19707 6950 1 14 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.459 -4.728 19707 6951 1 14 . 1 1 80 80 GLU H H 80 7.679 7.679 7.844 -0.165 19707 6952 1 14 . 1 1 81 81 GLY N N 81 105.493 105.493 109.170 -3.677 19707 6953 1 14 . 1 1 81 81 GLY C C 81 170.427 170.427 174.205 -3.778 19707 6954 1 14 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.267 -2.655 19707 6955 1 14 . 1 1 81 81 GLY H H 81 7.476 7.476 8.065 -0.589 19707 6956 1 14 . 1 1 82 82 GLU N N 82 122.160 122.160 119.714 2.446 19707 6957 1 14 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.405 0.549 19707 6958 1 14 . 1 1 82 82 GLU C C 82 171.004 171.004 175.385 -4.381 19707 6959 1 14 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.011 -3.689 19707 6960 1 14 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.986 -4.920 19707 6961 1 14 . 1 1 82 82 GLU H H 82 9.585 9.585 7.846 1.739 19707 6962 1 14 . 1 1 83 83 THR N N 83 114.756 114.756 114.719 0.037 19707 6963 1 14 . 1 1 83 83 THR HA H 83 4.990 4.990 4.919 0.071 19707 6964 1 14 . 1 1 83 83 THR C C 83 170.909 170.909 173.072 -2.163 19707 6965 1 14 . 1 1 83 83 THR CA C 83 57.957 57.957 61.611 -3.655 19707 6966 1 14 . 1 1 83 83 THR CB C 83 68.271 68.271 70.910 -2.639 19707 6967 1 14 . 1 1 83 83 THR H H 83 8.490 8.490 8.097 0.393 19707 6968 1 14 . 1 1 84 84 VAL N N 84 122.639 122.639 126.809 -4.170 19707 6969 1 14 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.737 -0.082 19707 6970 1 14 . 1 1 84 84 VAL C C 84 170.962 170.962 174.074 -3.112 19707 6971 1 14 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.676 -3.379 19707 6972 1 14 . 1 1 84 84 VAL CB C 84 32.224 32.224 33.545 -1.321 19707 6973 1 14 . 1 1 84 84 VAL H H 84 9.001 9.001 8.547 0.454 19707 6974 1 14 . 1 1 85 85 LEU N N 85 129.903 129.903 126.560 3.343 19707 6975 1 14 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.415 -0.023 19707 6976 1 14 . 1 1 85 85 LEU C C 85 172.346 172.346 174.739 -2.393 19707 6977 1 14 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.333 -2.536 19707 6978 1 14 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.721 -4.206 19707 6979 1 14 . 1 1 85 85 LEU H H 85 8.610 8.610 8.691 -0.081 19707 6980 1 14 . 1 1 86 86 VAL N N 86 122.778 122.778 123.699 -0.921 19707 6981 1 14 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.961 0.080 19707 6982 1 14 . 1 1 86 86 VAL C C 86 172.570 172.570 174.517 -1.947 19707 6983 1 14 . 1 1 86 86 VAL CA C 86 57.200 57.200 60.877 -3.677 19707 6984 1 14 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.303 -3.028 19707 6985 1 14 . 1 1 86 86 VAL H H 86 9.228 9.228 9.057 0.171 19707 6986 1 14 . 1 1 87 87 GLU N N 87 120.437 120.437 125.652 -5.215 19707 6987 1 14 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.568 0.163 19707 6988 1 14 . 1 1 87 87 GLU C C 87 172.267 172.267 174.951 -2.684 19707 6989 1 14 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.540 -3.191 19707 6990 1 14 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.849 -2.725 19707 6991 1 14 . 1 1 87 87 GLU H H 87 8.851 8.851 9.329 -0.478 19707 6992 1 14 . 1 1 88 88 GLU N N 88 118.525 118.525 122.573 -4.048 19707 6993 1 14 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.769 0.232 19707 6994 1 14 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.872 -2.955 19707 6995 1 14 . 1 1 88 88 GLU CB C 88 29.947 29.947 33.580 -3.633 19707 6996 1 14 . 1 1 88 88 GLU H H 88 8.380 8.380 8.740 -0.360 19707 6997 1 14 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.437 0.092 19707 6998 1 14 . 1 1 89 89 PRO C C 89 172.774 172.774 176.834 -4.060 19707 6999 1 14 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.078 -2.697 19707 7000 1 14 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.227 -2.893 19707 7001 1 15 . 1 1 2 2 SER N N 2 115.963 115.963 114.328 1.635 19707 7002 1 15 . 1 1 2 2 SER HA H 2 4.408 4.408 4.107 0.301 19707 7003 1 15 . 1 1 2 2 SER C C 2 171.788 171.788 174.452 -2.664 19707 7004 1 15 . 1 1 2 2 SER CA C 2 55.870 55.870 58.426 -2.556 19707 7005 1 15 . 1 1 2 2 SER CB C 2 61.022 61.022 63.118 -2.096 19707 7006 1 15 . 1 1 2 2 SER H H 2 8.661 8.661 8.478 0.183 19707 7007 1 15 . 1 1 3 3 GLU N N 3 122.941 122.941 121.328 1.613 19707 7008 1 15 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.432 -0.112 19707 7009 1 15 . 1 1 3 3 GLU C C 3 173.817 173.817 176.198 -2.381 19707 7010 1 15 . 1 1 3 3 GLU CA C 3 53.954 53.954 55.579 -1.625 19707 7011 1 15 . 1 1 3 3 GLU CB C 3 26.837 26.837 28.883 -2.046 19707 7012 1 15 . 1 1 3 3 GLU H H 3 8.706 8.706 8.492 0.214 19707 7013 1 15 . 1 1 4 4 THR N N 4 116.182 116.182 118.883 -2.701 19707 7014 1 15 . 1 1 4 4 THR HA H 4 4.233 4.233 4.181 0.052 19707 7015 1 15 . 1 1 4 4 THR C C 4 171.719 171.719 174.392 -2.673 19707 7016 1 15 . 1 1 4 4 THR CA C 4 59.414 59.414 63.326 -3.912 19707 7017 1 15 . 1 1 4 4 THR CB C 4 67.009 67.009 69.413 -2.404 19707 7018 1 15 . 1 1 4 4 THR H H 4 8.165 8.165 7.591 0.574 19707 7019 1 15 . 1 1 5 5 ARG N N 5 124.184 124.184 125.054 -0.870 19707 7020 1 15 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.796 -0.436 19707 7021 1 15 . 1 1 5 5 ARG C C 5 173.520 173.520 174.264 -0.744 19707 7022 1 15 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.369 -2.026 19707 7023 1 15 . 1 1 5 5 ARG CB C 5 28.165 28.165 31.861 -3.696 19707 7024 1 15 . 1 1 5 5 ARG H H 5 8.354 8.354 8.449 -0.095 19707 7025 1 15 . 1 1 6 6 THR N N 6 116.652 116.652 114.686 1.966 19707 7026 1 15 . 1 1 6 6 THR HA H 6 4.263 4.263 4.557 -0.294 19707 7027 1 15 . 1 1 6 6 THR C C 6 171.784 171.784 174.297 -2.513 19707 7028 1 15 . 1 1 6 6 THR CA C 6 59.218 59.218 61.209 -1.991 19707 7029 1 15 . 1 1 6 6 THR CB C 6 67.213 67.213 69.803 -2.590 19707 7030 1 15 . 1 1 6 6 THR H H 6 8.224 8.224 7.978 0.246 19707 7031 1 15 . 1 1 7 7 ILE N N 7 123.882 123.882 123.727 0.155 19707 7032 1 15 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.203 -0.065 19707 7033 1 15 . 1 1 7 7 ILE C C 7 173.572 173.572 175.804 -2.232 19707 7034 1 15 . 1 1 7 7 ILE CA C 7 58.482 58.482 61.161 -2.679 19707 7035 1 15 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.465 -2.397 19707 7036 1 15 . 1 1 7 7 ILE H H 7 8.247 8.247 8.368 -0.121 19707 7037 1 15 . 1 1 8 8 SER N N 8 120.287 120.287 123.721 -3.434 19707 7038 1 15 . 1 1 8 8 SER HA H 8 4.445 4.445 4.371 0.074 19707 7039 1 15 . 1 1 8 8 SER C C 8 171.926 171.926 175.188 -3.262 19707 7040 1 15 . 1 1 8 8 SER CA C 8 55.522 55.522 58.758 -3.236 19707 7041 1 15 . 1 1 8 8 SER CB C 8 61.073 61.073 63.686 -2.613 19707 7042 1 15 . 1 1 8 8 SER H H 8 8.402 8.402 8.652 -0.250 19707 7043 1 15 . 1 1 9 9 SER N N 9 118.425 118.425 123.558 -5.133 19707 7044 1 15 . 1 1 9 9 SER HA H 9 4.525 4.525 4.423 0.102 19707 7045 1 15 . 1 1 9 9 SER C C 9 172.663 172.663 174.029 -1.366 19707 7046 1 15 . 1 1 9 9 SER CA C 9 55.897 55.897 59.075 -3.178 19707 7047 1 15 . 1 1 9 9 SER CB C 9 61.375 61.375 61.772 -0.397 19707 7048 1 15 . 1 1 9 9 SER H H 9 8.362 8.362 8.767 -0.405 19707 7049 1 15 . 1 1 10 10 THR N N 10 115.676 115.676 115.200 0.476 19707 7050 1 15 . 1 1 10 10 THR HA H 10 4.232 4.232 4.436 -0.204 19707 7051 1 15 . 1 1 10 10 THR C C 10 173.070 173.070 175.362 -2.292 19707 7052 1 15 . 1 1 10 10 THR CA C 10 60.318 60.318 62.684 -2.366 19707 7053 1 15 . 1 1 10 10 THR CB C 10 67.205 67.205 68.984 -1.779 19707 7054 1 15 . 1 1 10 10 THR H H 10 8.274 8.274 8.131 0.143 19707 7055 1 15 . 1 1 11 11 ALA N N 11 124.726 124.726 124.810 -0.084 19707 7056 1 15 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.122 -0.135 19707 7057 1 15 . 1 1 11 11 ALA C C 11 176.825 176.825 179.414 -2.589 19707 7058 1 15 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.269 -2.728 19707 7059 1 15 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.355 -2.466 19707 7060 1 15 . 1 1 11 11 ALA H H 11 8.347 8.347 8.282 0.065 19707 7061 1 15 . 1 1 12 12 GLN N N 12 117.915 117.915 118.408 -0.493 19707 7062 1 15 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.035 -0.246 19707 7063 1 15 . 1 1 12 12 GLN C C 12 174.697 174.697 178.145 -3.448 19707 7064 1 15 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.257 -3.253 19707 7065 1 15 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.384 -2.159 19707 7066 1 15 . 1 1 12 12 GLN H H 12 8.194 8.194 8.201 -0.007 19707 7067 1 15 . 1 1 13 13 GLU N N 13 118.510 118.510 120.256 -1.746 19707 7068 1 15 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.044 0.059 19707 7069 1 15 . 1 1 13 13 GLU C C 13 176.192 176.192 178.816 -2.624 19707 7070 1 15 . 1 1 13 13 GLU CA C 13 56.315 56.315 59.148 -2.833 19707 7071 1 15 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.454 -3.421 19707 7072 1 15 . 1 1 13 13 GLU H H 13 7.917 7.917 8.010 -0.093 19707 7073 1 15 . 1 1 14 14 ARG N N 14 118.193 118.193 119.150 -0.957 19707 7074 1 15 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.039 -0.071 19707 7075 1 15 . 1 1 14 14 ARG C C 14 176.764 176.764 178.735 -1.971 19707 7076 1 15 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.009 -1.726 19707 7077 1 15 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.570 -2.333 19707 7078 1 15 . 1 1 14 14 ARG H H 14 7.907 7.907 8.046 -0.139 19707 7079 1 15 . 1 1 15 15 VAL N N 15 117.991 117.991 118.879 -0.888 19707 7080 1 15 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.838 0.065 19707 7081 1 15 . 1 1 15 15 VAL C C 15 174.922 174.922 178.195 -3.273 19707 7082 1 15 . 1 1 15 15 VAL CA C 15 62.831 62.831 66.462 -3.631 19707 7083 1 15 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.423 -2.700 19707 7084 1 15 . 1 1 15 15 VAL H H 15 7.658 7.658 7.865 -0.207 19707 7085 1 15 . 1 1 16 16 ASP N N 16 124.314 124.314 120.523 3.791 19707 7086 1 15 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.532 -0.216 19707 7087 1 15 . 1 1 16 16 ASP C C 16 176.462 176.462 178.189 -1.727 19707 7088 1 15 . 1 1 16 16 ASP CA C 16 55.326 55.326 56.953 -1.627 19707 7089 1 15 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.061 -4.392 19707 7090 1 15 . 1 1 16 16 ASP H H 16 8.291 8.291 7.750 0.541 19707 7091 1 15 . 1 1 17 17 LEU N N 17 120.212 120.212 119.703 0.509 19707 7092 1 15 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.013 0.041 19707 7093 1 15 . 1 1 17 17 LEU C C 17 177.171 177.171 178.577 -1.406 19707 7094 1 15 . 1 1 17 17 LEU CA C 17 54.980 54.980 58.568 -3.588 19707 7095 1 15 . 1 1 17 17 LEU CB C 17 38.845 38.845 42.106 -3.261 19707 7096 1 15 . 1 1 17 17 LEU H H 17 8.172 8.172 7.678 0.494 19707 7097 1 15 . 1 1 18 18 GLU N N 18 120.587 120.587 119.170 1.417 19707 7098 1 15 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.920 0.273 19707 7099 1 15 . 1 1 18 18 GLU C C 18 175.997 175.997 178.393 -2.396 19707 7100 1 15 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.486 -3.384 19707 7101 1 15 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.857 -2.785 19707 7102 1 15 . 1 1 18 18 GLU H H 18 7.876 7.876 8.262 -0.386 19707 7103 1 15 . 1 1 19 19 ALA N N 19 121.800 121.800 122.880 -1.080 19707 7104 1 15 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.144 -0.353 19707 7105 1 15 . 1 1 19 19 ALA C C 19 175.708 175.708 179.751 -4.043 19707 7106 1 15 . 1 1 19 19 ALA CA C 19 52.852 52.852 55.027 -2.175 19707 7107 1 15 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.253 -4.099 19707 7108 1 15 . 1 1 19 19 ALA H H 19 7.792 7.792 7.532 0.260 19707 7109 1 15 . 1 1 20 20 VAL N N 20 118.680 118.680 119.236 -0.556 19707 7110 1 15 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.731 -0.431 19707 7111 1 15 . 1 1 20 20 VAL C C 20 176.276 176.276 178.216 -1.940 19707 7112 1 15 . 1 1 20 20 VAL CA C 20 63.807 63.807 65.923 -2.116 19707 7113 1 15 . 1 1 20 20 VAL CB C 20 29.551 29.551 30.929 -1.378 19707 7114 1 15 . 1 1 20 20 VAL H H 20 7.712 7.712 7.560 0.152 19707 7115 1 15 . 1 1 21 21 ARG N N 21 121.935 121.935 121.150 0.785 19707 7116 1 15 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.090 -0.095 19707 7117 1 15 . 1 1 21 21 ARG C C 21 176.828 176.828 178.745 -1.917 19707 7118 1 15 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.531 -1.871 19707 7119 1 15 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.554 -2.264 19707 7120 1 15 . 1 1 21 21 ARG H H 21 8.444 8.444 8.324 0.120 19707 7121 1 15 . 1 1 22 22 LEU N N 22 119.327 119.327 119.488 -0.161 19707 7122 1 15 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.118 -0.123 19707 7123 1 15 . 1 1 22 22 LEU C C 22 175.664 175.664 178.589 -2.925 19707 7124 1 15 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.114 -3.246 19707 7125 1 15 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.552 -2.417 19707 7126 1 15 . 1 1 22 22 LEU H H 22 8.248 8.248 8.212 0.036 19707 7127 1 15 . 1 1 23 23 ALA N N 23 121.202 121.202 122.096 -0.894 19707 7128 1 15 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.937 -0.202 19707 7129 1 15 . 1 1 23 23 ALA C C 23 175.492 175.492 179.453 -3.961 19707 7130 1 15 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.213 -2.144 19707 7131 1 15 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.004 -3.937 19707 7132 1 15 . 1 1 23 23 ALA H H 23 8.392 8.392 8.593 -0.201 19707 7133 1 15 . 1 1 24 24 SER N N 24 112.377 112.377 114.965 -2.588 19707 7134 1 15 . 1 1 24 24 SER HA H 24 4.214 4.214 4.264 -0.050 19707 7135 1 15 . 1 1 24 24 SER C C 24 174.773 174.773 176.321 -1.548 19707 7136 1 15 . 1 1 24 24 SER CA C 24 59.258 59.258 62.640 -3.382 19707 7137 1 15 . 1 1 24 24 SER CB C 24 60.149 60.149 63.102 -2.953 19707 7138 1 15 . 1 1 24 24 SER H H 24 7.690 7.690 7.948 -0.258 19707 7139 1 15 . 1 1 25 25 ILE N N 25 123.886 123.886 122.603 1.283 19707 7140 1 15 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.064 -0.222 19707 7141 1 15 . 1 1 25 25 ILE C C 25 176.487 176.487 178.053 -1.566 19707 7142 1 15 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.408 -0.415 19707 7143 1 15 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.283 -0.351 19707 7144 1 15 . 1 1 25 25 ILE H H 25 7.837 7.837 8.249 -0.412 19707 7145 1 15 . 1 1 26 26 VAL N N 26 122.538 122.538 121.565 0.973 19707 7146 1 15 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.676 -0.288 19707 7147 1 15 . 1 1 26 26 VAL C C 26 174.624 174.624 178.004 -3.380 19707 7148 1 15 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.281 -2.366 19707 7149 1 15 . 1 1 26 26 VAL CB C 26 27.895 27.895 30.734 -2.839 19707 7150 1 15 . 1 1 26 26 VAL H H 26 8.804 8.804 8.728 0.076 19707 7151 1 15 . 1 1 27 27 ASP N N 27 120.433 120.433 120.380 0.053 19707 7152 1 15 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.333 -0.169 19707 7153 1 15 . 1 1 27 27 ASP C C 27 174.966 174.966 178.554 -3.588 19707 7154 1 15 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.431 -2.102 19707 7155 1 15 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.766 -2.912 19707 7156 1 15 . 1 1 27 27 ASP H H 27 8.719 8.719 8.497 0.222 19707 7157 1 15 . 1 1 28 28 SER N N 28 112.397 112.397 115.824 -3.427 19707 7158 1 15 . 1 1 28 28 SER HA H 28 4.073 4.073 4.178 -0.105 19707 7159 1 15 . 1 1 28 28 SER C C 28 174.405 174.405 176.720 -2.315 19707 7160 1 15 . 1 1 28 28 SER CA C 28 59.115 59.115 61.958 -2.843 19707 7161 1 15 . 1 1 28 28 SER CB C 28 60.125 60.125 63.092 -2.967 19707 7162 1 15 . 1 1 28 28 SER H H 28 7.599 7.599 8.027 -0.428 19707 7163 1 15 . 1 1 29 29 ARG N N 29 123.945 123.945 122.402 1.543 19707 7164 1 15 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.912 0.115 19707 7165 1 15 . 1 1 29 29 ARG C C 29 175.902 175.902 178.195 -2.293 19707 7166 1 15 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.822 -3.548 19707 7167 1 15 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.053 -1.313 19707 7168 1 15 . 1 1 29 29 ARG H H 29 7.769 7.769 7.829 -0.060 19707 7169 1 15 . 1 1 30 30 LEU N N 30 121.580 121.580 120.377 1.203 19707 7170 1 15 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.990 -0.241 19707 7171 1 15 . 1 1 30 30 LEU C C 30 177.474 177.474 179.665 -2.191 19707 7172 1 15 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.785 -2.472 19707 7173 1 15 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.787 -2.758 19707 7174 1 15 . 1 1 30 30 LEU H H 30 8.665 8.665 8.319 0.346 19707 7175 1 15 . 1 1 31 31 ILE N N 31 119.330 119.330 118.342 0.988 19707 7176 1 15 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.816 -0.125 19707 7177 1 15 . 1 1 31 31 ILE C C 31 175.341 175.341 177.742 -2.401 19707 7178 1 15 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.004 -2.491 19707 7179 1 15 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.854 -2.287 19707 7180 1 15 . 1 1 31 31 ILE H H 31 8.226 8.226 8.335 -0.109 19707 7181 1 15 . 1 1 32 32 GLY N N 32 106.092 106.092 106.143 -0.051 19707 7182 1 15 . 1 1 32 32 GLY C C 32 172.413 172.413 175.197 -2.784 19707 7183 1 15 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.697 -3.200 19707 7184 1 15 . 1 1 32 32 GLY H H 32 7.767 7.767 7.799 -0.032 19707 7185 1 15 . 1 1 33 33 THR N N 33 110.966 110.966 113.019 -2.053 19707 7186 1 15 . 1 1 33 33 THR HA H 33 4.455 4.455 4.373 0.082 19707 7187 1 15 . 1 1 33 33 THR C C 33 172.714 172.714 174.941 -2.227 19707 7188 1 15 . 1 1 33 33 THR CA C 33 60.032 60.032 62.792 -2.760 19707 7189 1 15 . 1 1 33 33 THR CB C 33 68.287 68.287 70.084 -1.797 19707 7190 1 15 . 1 1 33 33 THR H H 33 8.102 8.102 7.867 0.235 19707 7191 1 15 . 1 1 34 34 GLY N N 34 110.320 110.320 110.643 -0.323 19707 7192 1 15 . 1 1 34 34 GLY C C 34 170.505 170.505 173.608 -3.103 19707 7193 1 15 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.234 -2.651 19707 7194 1 15 . 1 1 34 34 GLY H H 34 8.072 8.072 8.265 -0.193 19707 7195 1 15 . 1 1 35 35 SER N N 35 112.944 112.944 114.252 -1.308 19707 7196 1 15 . 1 1 35 35 SER HA H 35 4.385 4.385 4.715 -0.330 19707 7197 1 15 . 1 1 35 35 SER C C 35 169.537 169.537 172.365 -2.828 19707 7198 1 15 . 1 1 35 35 SER CA C 35 54.794 54.794 58.030 -3.236 19707 7199 1 15 . 1 1 35 35 SER CB C 35 62.029 62.029 66.238 -4.209 19707 7200 1 15 . 1 1 35 35 SER H H 35 7.719 7.719 7.514 0.205 19707 7201 1 15 . 1 1 36 36 VAL N N 36 118.566 118.566 121.682 -3.116 19707 7202 1 15 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.236 -0.203 19707 7203 1 15 . 1 1 36 36 VAL C C 36 169.876 169.876 173.971 -4.095 19707 7204 1 15 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.337 -1.772 19707 7205 1 15 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.386 -2.434 19707 7206 1 15 . 1 1 36 36 VAL H H 36 8.490 8.490 8.886 -0.396 19707 7207 1 15 . 1 1 37 37 ASP N N 37 121.640 121.640 127.357 -5.717 19707 7208 1 15 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.798 0.004 19707 7209 1 15 . 1 1 37 37 ASP C C 37 172.806 172.806 175.671 -2.865 19707 7210 1 15 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.854 -3.811 19707 7211 1 15 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.282 -3.076 19707 7212 1 15 . 1 1 37 37 ASP H H 37 7.195 7.195 8.431 -1.236 19707 7213 1 15 . 1 1 38 38 GLU N N 38 120.018 120.018 121.245 -1.227 19707 7214 1 15 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.972 -0.315 19707 7215 1 15 . 1 1 38 38 GLU C C 38 174.753 174.753 177.996 -3.243 19707 7216 1 15 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.437 -2.945 19707 7217 1 15 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.820 -3.741 19707 7218 1 15 . 1 1 38 38 GLU H H 38 8.908 8.908 8.916 -0.008 19707 7219 1 15 . 1 1 39 39 ASP N N 39 118.668 118.668 117.489 1.179 19707 7220 1 15 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.478 -0.232 19707 7221 1 15 . 1 1 39 39 ASP C C 39 175.393 175.393 177.050 -1.657 19707 7222 1 15 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.172 -1.308 19707 7223 1 15 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.539 -3.569 19707 7224 1 15 . 1 1 39 39 ASP H H 39 8.242 8.242 8.652 -0.410 19707 7225 1 15 . 1 1 40 40 PHE N N 40 119.851 119.851 117.536 2.315 19707 7226 1 15 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.441 -0.237 19707 7227 1 15 . 1 1 40 40 PHE C C 40 174.929 174.929 175.729 -0.800 19707 7228 1 15 . 1 1 40 40 PHE CA C 40 58.171 58.171 59.725 -1.554 19707 7229 1 15 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.261 -3.428 19707 7230 1 15 . 1 1 40 40 PHE H H 40 8.037 8.037 7.665 0.372 19707 7231 1 15 . 1 1 41 41 LEU N N 41 117.882 117.882 117.279 0.603 19707 7232 1 15 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.198 -0.676 19707 7233 1 15 . 1 1 41 41 LEU C C 41 175.938 175.938 178.903 -2.965 19707 7234 1 15 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.386 -1.526 19707 7235 1 15 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.773 -3.542 19707 7236 1 15 . 1 1 41 41 LEU H H 41 7.816 7.816 7.627 0.189 19707 7237 1 15 . 1 1 42 42 ARG N N 42 118.360 118.360 118.916 -0.556 19707 7238 1 15 . 1 1 42 42 ARG HA H 42 3.740 3.740 3.989 -0.249 19707 7239 1 15 . 1 1 42 42 ARG C C 42 175.435 175.435 177.102 -1.667 19707 7240 1 15 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.108 -2.137 19707 7241 1 15 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.893 -2.629 19707 7242 1 15 . 1 1 42 42 ARG H H 42 8.540 8.540 8.244 0.296 19707 7243 1 15 . 1 1 43 43 GLU N N 43 114.947 114.947 116.965 -2.018 19707 7244 1 15 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.218 -0.168 19707 7245 1 15 . 1 1 43 43 GLU C C 43 174.518 174.518 177.488 -2.970 19707 7246 1 15 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.817 -3.246 19707 7247 1 15 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.051 -3.010 19707 7248 1 15 . 1 1 43 43 GLU H H 43 7.223 7.223 8.184 -0.961 19707 7249 1 15 . 1 1 44 44 GLN N N 44 114.109 114.109 117.316 -3.207 19707 7250 1 15 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.299 -0.193 19707 7251 1 15 . 1 1 44 44 GLN C C 44 173.777 173.777 177.737 -3.960 19707 7252 1 15 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.905 -3.724 19707 7253 1 15 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.363 -3.493 19707 7254 1 15 . 1 1 44 44 GLN H H 44 7.372 7.372 7.958 -0.586 19707 7255 1 15 . 1 1 45 45 ILE N N 45 117.470 117.470 115.026 2.444 19707 7256 1 15 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.749 0.199 19707 7257 1 15 . 1 1 45 45 ILE C C 45 172.305 172.305 177.373 -5.068 19707 7258 1 15 . 1 1 45 45 ILE CA C 45 58.505 58.505 64.040 -5.535 19707 7259 1 15 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.940 -2.240 19707 7260 1 15 . 1 1 45 45 ILE H H 45 7.235 7.235 7.402 -0.167 19707 7261 1 15 . 1 1 46 46 ARG N N 46 122.996 122.996 115.144 7.852 19707 7262 1 15 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.019 0.171 19707 7263 1 15 . 1 1 46 46 ARG C C 46 172.992 172.992 175.810 -2.818 19707 7264 1 15 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.367 -4.606 19707 7265 1 15 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.024 -0.072 19707 7266 1 15 . 1 1 46 46 ARG H H 46 8.336 8.336 8.680 -0.344 19707 7267 1 15 . 1 1 47 47 ASP N N 47 118.676 118.676 116.948 1.728 19707 7268 1 15 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.644 -0.196 19707 7269 1 15 . 1 1 47 47 ASP C C 47 172.520 172.520 174.886 -2.366 19707 7270 1 15 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.305 -2.415 19707 7271 1 15 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.644 -4.987 19707 7272 1 15 . 1 1 47 47 ASP H H 47 8.313 8.313 8.142 0.171 19707 7273 1 15 . 1 1 48 48 ALA N N 48 120.922 120.922 123.219 -2.297 19707 7274 1 15 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.450 -0.081 19707 7275 1 15 . 1 1 48 48 ALA C C 48 174.295 174.295 177.320 -3.025 19707 7276 1 15 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.051 -2.414 19707 7277 1 15 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.536 -3.322 19707 7278 1 15 . 1 1 48 48 ALA H H 48 7.824 7.824 7.240 0.584 19707 7279 1 15 . 1 1 49 49 ARG N N 49 118.644 118.644 121.452 -2.808 19707 7280 1 15 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.090 0.252 19707 7281 1 15 . 1 1 49 49 ARG C C 49 172.504 172.504 176.103 -3.599 19707 7282 1 15 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.877 -3.968 19707 7283 1 15 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.746 -2.403 19707 7284 1 15 . 1 1 49 49 ARG H H 49 7.911 7.911 8.490 -0.579 19707 7285 1 15 . 1 1 50 50 TYR N N 50 119.470 119.470 114.758 4.712 19707 7286 1 15 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.042 0.249 19707 7287 1 15 . 1 1 50 50 TYR C C 50 170.470 170.470 173.874 -3.404 19707 7288 1 15 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.203 -1.935 19707 7289 1 15 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.507 -0.994 19707 7290 1 15 . 1 1 50 50 TYR H H 50 7.639 7.639 7.885 -0.246 19707 7291 1 15 . 1 1 51 51 ALA N N 51 127.418 127.418 126.094 1.324 19707 7292 1 15 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.286 -0.065 19707 7293 1 15 . 1 1 51 51 ALA C C 51 171.328 171.328 175.828 -4.500 19707 7294 1 15 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.336 -2.903 19707 7295 1 15 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.363 -1.051 19707 7296 1 15 . 1 1 51 51 ALA H H 51 8.222 8.222 8.815 -0.593 19707 7297 1 15 . 1 1 52 52 VAL N N 52 117.832 117.832 122.971 -5.139 19707 7298 1 15 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.266 -0.599 19707 7299 1 15 . 1 1 52 52 VAL C C 52 172.436 172.436 174.637 -2.201 19707 7300 1 15 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.292 -2.535 19707 7301 1 15 . 1 1 52 52 VAL CB C 52 32.103 32.103 35.908 -3.805 19707 7302 1 15 . 1 1 52 52 VAL H H 52 8.753 8.753 8.959 -0.206 19707 7303 1 15 . 1 1 53 53 ILE N N 53 128.027 128.027 124.938 3.089 19707 7304 1 15 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.600 0.242 19707 7305 1 15 . 1 1 53 53 ILE C C 53 172.110 172.110 175.160 -3.050 19707 7306 1 15 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.265 -2.512 19707 7307 1 15 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.344 -3.185 19707 7308 1 15 . 1 1 53 53 ILE H H 53 9.261 9.261 8.882 0.379 19707 7309 1 15 . 1 1 54 54 ARG N N 54 127.885 127.885 124.184 3.701 19707 7310 1 15 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.583 0.170 19707 7311 1 15 . 1 1 54 54 ARG C C 54 172.285 172.285 176.545 -4.260 19707 7312 1 15 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.742 -1.482 19707 7313 1 15 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.750 -2.858 19707 7314 1 15 . 1 1 54 54 ARG H H 54 8.686 8.686 8.677 0.009 19707 7315 1 15 . 1 1 55 55 ILE N N 55 129.907 129.907 123.191 6.716 19707 7316 1 15 . 1 1 55 55 ILE HA H 55 4.153 4.153 3.929 0.224 19707 7317 1 15 . 1 1 55 55 ILE CA C 55 55.595 55.595 61.455 -5.860 19707 7318 1 15 . 1 1 55 55 ILE CB C 55 37.613 37.613 37.403 0.210 19707 7319 1 15 . 1 1 55 55 ILE H H 55 9.292 9.292 7.644 1.648 19707 7320 1 15 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.381 -0.189 19707 7321 1 15 . 1 1 56 56 PRO C C 56 174.787 174.787 177.653 -2.866 19707 7322 1 15 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.919 -2.185 19707 7323 1 15 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.860 -2.947 19707 7324 1 15 . 1 1 57 57 GLY N N 57 111.828 111.828 110.390 1.438 19707 7325 1 15 . 1 1 57 57 GLY C C 57 171.039 171.039 173.838 -2.799 19707 7326 1 15 . 1 1 57 57 GLY CA C 57 42.817 42.817 45.023 -2.206 19707 7327 1 15 . 1 1 57 57 GLY H H 57 8.708 8.708 8.656 0.052 19707 7328 1 15 . 1 1 58 58 GLN N N 58 118.457 118.457 120.106 -1.649 19707 7329 1 15 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.829 0.071 19707 7330 1 15 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.004 -2.732 19707 7331 1 15 . 1 1 58 58 GLN CB C 58 27.154 27.154 30.159 -3.005 19707 7332 1 15 . 1 1 58 58 GLN H H 58 7.909 7.909 7.547 0.362 19707 7333 1 15 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.426 0.010 19707 7334 1 15 . 1 1 59 59 PRO C C 59 174.607 174.607 176.104 -1.497 19707 7335 1 15 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.873 -2.818 19707 7336 1 15 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.219 -3.042 19707 7337 1 15 . 1 1 60 60 VAL N N 60 122.695 122.695 119.276 3.419 19707 7338 1 15 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.131 -0.176 19707 7339 1 15 . 1 1 60 60 VAL C C 60 172.403 172.403 176.268 -3.865 19707 7340 1 15 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.215 -1.320 19707 7341 1 15 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.620 -2.978 19707 7342 1 15 . 1 1 60 60 VAL H H 60 8.364 8.364 8.211 0.153 19707 7343 1 15 . 1 1 61 61 VAL N N 61 126.097 126.097 127.144 -1.047 19707 7344 1 15 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.319 -0.019 19707 7345 1 15 . 1 1 61 61 VAL C C 61 170.891 170.891 174.530 -3.639 19707 7346 1 15 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.391 -2.577 19707 7347 1 15 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.138 -2.940 19707 7348 1 15 . 1 1 61 61 VAL H H 61 8.023 8.023 8.232 -0.209 19707 7349 1 15 . 1 1 62 62 GLU N N 62 126.097 126.097 126.295 -0.198 19707 7350 1 15 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.937 0.222 19707 7351 1 15 . 1 1 62 62 GLU C C 62 172.252 172.252 175.537 -3.285 19707 7352 1 15 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.090 -3.550 19707 7353 1 15 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.304 -2.004 19707 7354 1 15 . 1 1 62 62 GLU H H 62 8.591 8.591 8.604 -0.013 19707 7355 1 15 . 1 1 63 63 VAL N N 63 120.374 120.374 124.107 -3.733 19707 7356 1 15 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.237 0.156 19707 7357 1 15 . 1 1 63 63 VAL C C 63 171.040 171.040 176.602 -5.562 19707 7358 1 15 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.278 -3.445 19707 7359 1 15 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.687 -0.110 19707 7360 1 15 . 1 1 63 63 VAL H H 63 8.732 8.732 8.684 0.048 19707 7361 1 15 . 1 1 64 64 GLY N N 64 109.935 109.935 114.337 -4.402 19707 7362 1 15 . 1 1 64 64 GLY C C 64 171.656 171.656 173.683 -2.027 19707 7363 1 15 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.202 -5.025 19707 7364 1 15 . 1 1 64 64 GLY H H 64 8.259 8.259 8.294 -0.035 19707 7365 1 15 . 1 1 65 65 THR N N 65 115.478 115.478 115.266 0.212 19707 7366 1 15 . 1 1 65 65 THR HA H 65 4.342 4.342 4.347 -0.005 19707 7367 1 15 . 1 1 65 65 THR C C 65 170.663 170.663 172.973 -2.310 19707 7368 1 15 . 1 1 65 65 THR CA C 65 58.357 58.357 60.445 -2.088 19707 7369 1 15 . 1 1 65 65 THR CB C 65 67.923 67.923 70.854 -2.931 19707 7370 1 15 . 1 1 65 65 THR H H 65 8.123 8.123 8.030 0.093 19707 7371 1 15 . 1 1 66 66 LYS N N 66 130.775 130.775 124.537 6.238 19707 7372 1 15 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.066 -1.136 19707 7373 1 15 . 1 1 66 66 LYS CA C 66 52.190 52.190 55.202 -3.012 19707 7374 1 15 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.807 -3.117 19707 7375 1 15 . 1 1 66 66 LYS H H 66 8.472 8.472 8.205 0.267 19707 7376 1 15 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.487 -0.076 19707 7377 1 15 . 1 1 67 67 PRO C C 67 173.211 173.211 176.371 -3.160 19707 7378 1 15 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.938 -3.372 19707 7379 1 15 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.387 -2.984 19707 7380 1 15 . 1 1 68 68 THR N N 68 111.983 111.983 110.516 1.467 19707 7381 1 15 . 1 1 68 68 THR HA H 68 4.277 4.277 4.426 -0.149 19707 7382 1 15 . 1 1 68 68 THR C C 68 171.720 171.720 174.987 -3.267 19707 7383 1 15 . 1 1 68 68 THR CA C 68 58.193 58.193 62.221 -4.029 19707 7384 1 15 . 1 1 68 68 THR CB C 68 67.723 67.723 69.367 -1.644 19707 7385 1 15 . 1 1 68 68 THR H H 68 8.091 8.091 8.046 0.045 19707 7386 1 15 . 1 1 69 69 GLY N N 69 109.918 109.918 109.482 0.436 19707 7387 1 15 . 1 1 69 69 GLY C C 69 170.783 170.783 173.192 -2.409 19707 7388 1 15 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.833 -2.777 19707 7389 1 15 . 1 1 69 69 GLY H H 69 8.119 8.119 7.923 0.196 19707 7390 1 15 . 1 1 70 70 ASP N N 70 123.294 123.294 121.086 2.208 19707 7391 1 15 . 1 1 70 70 ASP HA H 70 4.549 4.549 5.030 -0.481 19707 7392 1 15 . 1 1 70 70 ASP C C 70 173.651 173.651 174.634 -0.983 19707 7393 1 15 . 1 1 70 70 ASP CA C 70 51.861 51.861 53.773 -1.913 19707 7394 1 15 . 1 1 70 70 ASP CB C 70 37.733 37.733 41.791 -4.058 19707 7395 1 15 . 1 1 70 70 ASP H H 70 8.444 8.444 8.365 0.079 19707 7396 1 15 . 1 1 71 71 VAL N N 71 117.772 117.772 116.417 1.355 19707 7397 1 15 . 1 1 71 71 VAL HA H 71 4.707 4.707 4.921 -0.214 19707 7398 1 15 . 1 1 71 71 VAL C C 71 172.992 172.992 174.797 -1.805 19707 7399 1 15 . 1 1 71 71 VAL CA C 71 57.376 57.376 60.254 -2.878 19707 7400 1 15 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.090 -2.068 19707 7401 1 15 . 1 1 71 71 VAL H H 71 8.173 8.173 7.947 0.226 19707 7402 1 15 . 1 1 72 72 LEU N N 72 123.435 123.435 124.254 -0.819 19707 7403 1 15 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.407 0.229 19707 7404 1 15 . 1 1 72 72 LEU C C 72 173.189 173.189 176.218 -3.029 19707 7405 1 15 . 1 1 72 72 LEU CA C 72 51.207 51.207 55.199 -3.992 19707 7406 1 15 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.479 -0.841 19707 7407 1 15 . 1 1 72 72 LEU H H 72 8.859 8.859 8.888 -0.029 19707 7408 1 15 . 1 1 73 73 GLN N N 73 119.520 119.520 120.490 -0.970 19707 7409 1 15 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.223 0.122 19707 7410 1 15 . 1 1 73 73 GLN C C 73 172.249 172.249 175.460 -3.211 19707 7411 1 15 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.566 -3.233 19707 7412 1 15 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.958 -2.188 19707 7413 1 15 . 1 1 73 73 GLN H H 73 9.196 9.196 8.164 1.032 19707 7414 1 15 . 1 1 74 74 GLY N N 74 113.513 113.513 111.935 1.578 19707 7415 1 15 . 1 1 74 74 GLY C C 74 169.072 169.072 172.060 -2.988 19707 7416 1 15 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.989 -2.692 19707 7417 1 15 . 1 1 74 74 GLY H H 74 9.373 9.373 9.026 0.347 19707 7418 1 15 . 1 1 75 75 ARG N N 75 122.479 122.479 123.293 -0.814 19707 7419 1 15 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.468 0.034 19707 7420 1 15 . 1 1 75 75 ARG C C 75 172.348 172.348 173.954 -1.606 19707 7421 1 15 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.430 -3.672 19707 7422 1 15 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.616 -2.798 19707 7423 1 15 . 1 1 75 75 ARG H H 75 8.615 8.615 8.963 -0.348 19707 7424 1 15 . 1 1 76 76 ALA N N 76 122.346 122.346 126.658 -4.312 19707 7425 1 15 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.756 -0.220 19707 7426 1 15 . 1 1 76 76 ALA C C 76 172.704 172.704 174.434 -1.730 19707 7427 1 15 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.755 -2.728 19707 7428 1 15 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.926 -2.901 19707 7429 1 15 . 1 1 76 76 ALA H H 76 8.590 8.590 8.984 -0.394 19707 7430 1 15 . 1 1 77 77 THR N N 77 116.961 116.961 117.284 -0.323 19707 7431 1 15 . 1 1 77 77 THR HA H 77 4.988 4.988 5.373 -0.385 19707 7432 1 15 . 1 1 77 77 THR C C 77 172.800 172.800 174.879 -2.079 19707 7433 1 15 . 1 1 77 77 THR CA C 77 58.344 58.344 61.098 -2.754 19707 7434 1 15 . 1 1 77 77 THR CB C 77 67.712 67.712 70.174 -2.462 19707 7435 1 15 . 1 1 77 77 THR H H 77 8.491 8.491 8.242 0.249 19707 7436 1 15 . 1 1 78 78 GLY N N 78 111.103 111.103 113.493 -2.390 19707 7437 1 15 . 1 1 78 78 GLY C C 78 172.567 172.567 173.627 -1.060 19707 7438 1 15 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.742 -2.433 19707 7439 1 15 . 1 1 78 78 GLY H H 78 8.649 8.649 8.499 0.150 19707 7440 1 15 . 1 1 79 79 GLU N N 79 123.423 123.423 118.437 4.986 19707 7441 1 15 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.397 -0.401 19707 7442 1 15 . 1 1 79 79 GLU C C 79 175.466 175.466 177.760 -2.294 19707 7443 1 15 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.568 -2.109 19707 7444 1 15 . 1 1 79 79 GLU CB C 79 26.067 26.067 30.278 -4.211 19707 7445 1 15 . 1 1 79 79 GLU H H 79 10.375 10.375 8.524 1.851 19707 7446 1 15 . 1 1 80 80 GLU N N 80 113.846 113.846 118.525 -4.679 19707 7447 1 15 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.414 -0.056 19707 7448 1 15 . 1 1 80 80 GLU C C 80 173.293 173.293 177.101 -3.808 19707 7449 1 15 . 1 1 80 80 GLU CA C 80 51.776 51.776 56.315 -4.539 19707 7450 1 15 . 1 1 80 80 GLU CB C 80 24.731 24.731 30.139 -5.408 19707 7451 1 15 . 1 1 80 80 GLU H H 80 7.679 7.679 8.700 -1.021 19707 7452 1 15 . 1 1 81 81 GLY N N 81 105.493 105.493 108.350 -2.857 19707 7453 1 15 . 1 1 81 81 GLY C C 81 170.427 170.427 174.212 -3.785 19707 7454 1 15 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.103 -2.491 19707 7455 1 15 . 1 1 81 81 GLY H H 81 7.476 7.476 7.988 -0.512 19707 7456 1 15 . 1 1 82 82 GLU N N 82 122.160 122.160 118.763 3.397 19707 7457 1 15 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.374 0.580 19707 7458 1 15 . 1 1 82 82 GLU C C 82 171.004 171.004 175.085 -4.081 19707 7459 1 15 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.849 -4.528 19707 7460 1 15 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.669 -4.603 19707 7461 1 15 . 1 1 82 82 GLU H H 82 9.585 9.585 8.221 1.364 19707 7462 1 15 . 1 1 83 83 THR N N 83 114.756 114.756 116.234 -1.478 19707 7463 1 15 . 1 1 83 83 THR HA H 83 4.990 4.990 5.329 -0.339 19707 7464 1 15 . 1 1 83 83 THR C C 83 170.909 170.909 173.411 -2.502 19707 7465 1 15 . 1 1 83 83 THR CA C 83 57.957 57.957 61.425 -3.468 19707 7466 1 15 . 1 1 83 83 THR CB C 83 68.271 68.271 71.293 -3.022 19707 7467 1 15 . 1 1 83 83 THR H H 83 8.490 8.490 8.350 0.140 19707 7468 1 15 . 1 1 84 84 VAL N N 84 122.639 122.639 124.797 -2.158 19707 7469 1 15 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.627 0.028 19707 7470 1 15 . 1 1 84 84 VAL C C 84 170.962 170.962 173.313 -2.351 19707 7471 1 15 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.859 -2.562 19707 7472 1 15 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.735 -3.511 19707 7473 1 15 . 1 1 84 84 VAL H H 84 9.001 9.001 9.100 -0.099 19707 7474 1 15 . 1 1 85 85 LEU N N 85 129.903 129.903 126.671 3.232 19707 7475 1 15 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.484 -0.092 19707 7476 1 15 . 1 1 85 85 LEU C C 85 172.346 172.346 174.562 -2.216 19707 7477 1 15 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.069 -2.272 19707 7478 1 15 . 1 1 85 85 LEU CB C 85 42.515 42.515 47.023 -4.508 19707 7479 1 15 . 1 1 85 85 LEU H H 85 8.610 8.610 9.086 -0.476 19707 7480 1 15 . 1 1 86 86 VAL N N 86 122.778 122.778 124.615 -1.837 19707 7481 1 15 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.899 0.142 19707 7482 1 15 . 1 1 86 86 VAL C C 86 172.570 172.570 174.720 -2.150 19707 7483 1 15 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.122 -3.922 19707 7484 1 15 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.128 -2.853 19707 7485 1 15 . 1 1 86 86 VAL H H 86 9.228 9.228 9.141 0.087 19707 7486 1 15 . 1 1 87 87 GLU N N 87 120.437 120.437 126.045 -5.608 19707 7487 1 15 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.559 0.172 19707 7488 1 15 . 1 1 87 87 GLU C C 87 172.267 172.267 174.938 -2.671 19707 7489 1 15 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.514 -3.165 19707 7490 1 15 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.678 -2.554 19707 7491 1 15 . 1 1 87 87 GLU H H 87 8.851 8.851 9.319 -0.468 19707 7492 1 15 . 1 1 88 88 GLU N N 88 118.525 118.525 121.030 -2.505 19707 7493 1 15 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.593 0.408 19707 7494 1 15 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.055 -3.138 19707 7495 1 15 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.668 -1.721 19707 7496 1 15 . 1 1 88 88 GLU H H 88 8.380 8.380 8.361 0.019 19707 7497 1 15 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.456 0.073 19707 7498 1 15 . 1 1 89 89 PRO C C 89 172.774 172.774 176.922 -4.148 19707 7499 1 15 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.209 -2.828 19707 7500 1 15 . 1 1 89 89 PRO CB C 89 29.334 29.334 31.932 -2.598 19707 7501 1 16 . 1 1 2 2 SER N N 2 115.963 115.963 115.976 -0.013 19707 7502 1 16 . 1 1 2 2 SER HA H 2 4.408 4.408 4.458 -0.050 19707 7503 1 16 . 1 1 2 2 SER C C 2 171.788 171.788 175.013 -3.225 19707 7504 1 16 . 1 1 2 2 SER CA C 2 55.870 55.870 58.618 -2.748 19707 7505 1 16 . 1 1 2 2 SER CB C 2 61.022 61.022 63.603 -2.582 19707 7506 1 16 . 1 1 2 2 SER H H 2 8.661 8.661 8.657 0.004 19707 7507 1 16 . 1 1 3 3 GLU N N 3 122.941 122.941 122.314 0.627 19707 7508 1 16 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.440 -0.120 19707 7509 1 16 . 1 1 3 3 GLU C C 3 173.817 173.817 175.824 -2.007 19707 7510 1 16 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.538 -2.584 19707 7511 1 16 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.541 -3.704 19707 7512 1 16 . 1 1 3 3 GLU H H 3 8.706 8.706 8.118 0.588 19707 7513 1 16 . 1 1 4 4 THR N N 4 116.182 116.182 113.812 2.370 19707 7514 1 16 . 1 1 4 4 THR HA H 4 4.233 4.233 4.607 -0.374 19707 7515 1 16 . 1 1 4 4 THR C C 4 171.719 171.719 173.843 -2.124 19707 7516 1 16 . 1 1 4 4 THR CA C 4 59.414 59.414 61.215 -1.801 19707 7517 1 16 . 1 1 4 4 THR CB C 4 67.009 67.009 69.737 -2.728 19707 7518 1 16 . 1 1 4 4 THR H H 4 8.165 8.165 8.056 0.109 19707 7519 1 16 . 1 1 5 5 ARG N N 5 124.184 124.184 122.243 1.941 19707 7520 1 16 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.805 -0.445 19707 7521 1 16 . 1 1 5 5 ARG C C 5 173.520 173.520 175.742 -2.222 19707 7522 1 16 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.208 -1.865 19707 7523 1 16 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.227 -2.062 19707 7524 1 16 . 1 1 5 5 ARG H H 5 8.354 8.354 8.367 -0.013 19707 7525 1 16 . 1 1 6 6 THR N N 6 116.652 116.652 114.948 1.704 19707 7526 1 16 . 1 1 6 6 THR HA H 6 4.263 4.263 4.436 -0.173 19707 7527 1 16 . 1 1 6 6 THR C C 6 171.784 171.784 173.011 -1.227 19707 7528 1 16 . 1 1 6 6 THR CA C 6 59.218 59.218 62.745 -3.527 19707 7529 1 16 . 1 1 6 6 THR CB C 6 67.213 67.213 69.238 -2.025 19707 7530 1 16 . 1 1 6 6 THR H H 6 8.224 8.224 8.333 -0.109 19707 7531 1 16 . 1 1 7 7 ILE N N 7 123.882 123.882 126.952 -3.070 19707 7532 1 16 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.380 -0.242 19707 7533 1 16 . 1 1 7 7 ILE C C 7 173.572 173.572 176.822 -3.250 19707 7534 1 16 . 1 1 7 7 ILE CA C 7 58.482 58.482 61.157 -2.675 19707 7535 1 16 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.541 -2.472 19707 7536 1 16 . 1 1 7 7 ILE H H 7 8.247 8.247 8.486 -0.239 19707 7537 1 16 . 1 1 8 8 SER N N 8 120.287 120.287 122.545 -2.258 19707 7538 1 16 . 1 1 8 8 SER HA H 8 4.445 4.445 4.606 -0.161 19707 7539 1 16 . 1 1 8 8 SER C C 8 171.926 171.926 174.535 -2.609 19707 7540 1 16 . 1 1 8 8 SER CA C 8 55.522 55.522 58.109 -2.587 19707 7541 1 16 . 1 1 8 8 SER CB C 8 61.073 61.073 62.129 -1.056 19707 7542 1 16 . 1 1 8 8 SER H H 8 8.402 8.402 8.735 -0.333 19707 7543 1 16 . 1 1 9 9 SER N N 9 118.425 118.425 117.863 0.562 19707 7544 1 16 . 1 1 9 9 SER HA H 9 4.525 4.525 4.246 0.279 19707 7545 1 16 . 1 1 9 9 SER C C 9 172.663 172.663 174.732 -2.069 19707 7546 1 16 . 1 1 9 9 SER CA C 9 55.897 55.897 60.024 -4.127 19707 7547 1 16 . 1 1 9 9 SER CB C 9 61.375 61.375 62.272 -0.897 19707 7548 1 16 . 1 1 9 9 SER H H 9 8.362 8.362 8.334 0.028 19707 7549 1 16 . 1 1 10 10 THR N N 10 115.676 115.676 111.738 3.938 19707 7550 1 16 . 1 1 10 10 THR HA H 10 4.232 4.232 4.448 -0.216 19707 7551 1 16 . 1 1 10 10 THR C C 10 173.070 173.070 175.777 -2.707 19707 7552 1 16 . 1 1 10 10 THR CA C 10 60.318 60.318 62.627 -2.309 19707 7553 1 16 . 1 1 10 10 THR CB C 10 67.205 67.205 69.389 -2.184 19707 7554 1 16 . 1 1 10 10 THR H H 10 8.274 8.274 7.890 0.384 19707 7555 1 16 . 1 1 11 11 ALA N N 11 124.726 124.726 124.317 0.409 19707 7556 1 16 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.119 -0.132 19707 7557 1 16 . 1 1 11 11 ALA C C 11 176.825 176.825 179.598 -2.773 19707 7558 1 16 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.088 -2.547 19707 7559 1 16 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.210 -2.321 19707 7560 1 16 . 1 1 11 11 ALA H H 11 8.347 8.347 8.185 0.162 19707 7561 1 16 . 1 1 12 12 GLN N N 12 117.915 117.915 118.186 -0.271 19707 7562 1 16 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.058 -0.269 19707 7563 1 16 . 1 1 12 12 GLN C C 12 174.697 174.697 178.192 -3.495 19707 7564 1 16 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.334 -3.330 19707 7565 1 16 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.580 -2.355 19707 7566 1 16 . 1 1 12 12 GLN H H 12 8.194 8.194 8.441 -0.247 19707 7567 1 16 . 1 1 13 13 GLU N N 13 118.510 118.510 119.885 -1.375 19707 7568 1 16 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.078 0.025 19707 7569 1 16 . 1 1 13 13 GLU C C 13 176.192 176.192 179.382 -3.190 19707 7570 1 16 . 1 1 13 13 GLU CA C 13 56.315 56.315 59.039 -2.724 19707 7571 1 16 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.498 -3.465 19707 7572 1 16 . 1 1 13 13 GLU H H 13 7.917 7.917 7.735 0.182 19707 7573 1 16 . 1 1 14 14 ARG N N 14 118.193 118.193 119.822 -1.629 19707 7574 1 16 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.074 -0.106 19707 7575 1 16 . 1 1 14 14 ARG C C 14 176.764 176.764 178.489 -1.725 19707 7576 1 16 . 1 1 14 14 ARG CA C 14 57.283 57.283 58.995 -1.712 19707 7577 1 16 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.391 -2.154 19707 7578 1 16 . 1 1 14 14 ARG H H 14 7.907 7.907 8.265 -0.358 19707 7579 1 16 . 1 1 15 15 VAL N N 15 117.991 117.991 118.940 -0.949 19707 7580 1 16 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.809 0.094 19707 7581 1 16 . 1 1 15 15 VAL C C 15 174.922 174.922 177.835 -2.913 19707 7582 1 16 . 1 1 15 15 VAL CA C 15 62.831 62.831 65.775 -2.943 19707 7583 1 16 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.530 -2.807 19707 7584 1 16 . 1 1 15 15 VAL H H 15 7.658 7.658 7.629 0.029 19707 7585 1 16 . 1 1 16 16 ASP N N 16 124.314 124.314 120.925 3.389 19707 7586 1 16 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.506 -0.190 19707 7587 1 16 . 1 1 16 16 ASP C C 16 176.462 176.462 177.977 -1.515 19707 7588 1 16 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.106 -1.780 19707 7589 1 16 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.083 -4.413 19707 7590 1 16 . 1 1 16 16 ASP H H 16 8.291 8.291 7.844 0.447 19707 7591 1 16 . 1 1 17 17 LEU N N 17 120.212 120.212 119.539 0.673 19707 7592 1 16 . 1 1 17 17 LEU HA H 17 4.054 4.054 3.983 0.071 19707 7593 1 16 . 1 1 17 17 LEU C C 17 177.171 177.171 178.704 -1.533 19707 7594 1 16 . 1 1 17 17 LEU CA C 17 54.980 54.980 58.809 -3.829 19707 7595 1 16 . 1 1 17 17 LEU CB C 17 38.845 38.845 42.031 -3.186 19707 7596 1 16 . 1 1 17 17 LEU H H 17 8.172 8.172 7.643 0.529 19707 7597 1 16 . 1 1 18 18 GLU N N 18 120.587 120.587 119.219 1.368 19707 7598 1 16 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.925 0.268 19707 7599 1 16 . 1 1 18 18 GLU C C 18 175.997 175.997 178.437 -2.440 19707 7600 1 16 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.496 -3.394 19707 7601 1 16 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.879 -2.807 19707 7602 1 16 . 1 1 18 18 GLU H H 18 7.876 7.876 8.081 -0.205 19707 7603 1 16 . 1 1 19 19 ALA N N 19 121.800 121.800 123.147 -1.347 19707 7604 1 16 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.090 -0.299 19707 7605 1 16 . 1 1 19 19 ALA C C 19 175.708 175.708 179.618 -3.910 19707 7606 1 16 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.983 -2.131 19707 7607 1 16 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.500 -4.346 19707 7608 1 16 . 1 1 19 19 ALA H H 19 7.792 7.792 7.372 0.420 19707 7609 1 16 . 1 1 20 20 VAL N N 20 118.680 118.680 119.390 -0.710 19707 7610 1 16 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.671 -0.371 19707 7611 1 16 . 1 1 20 20 VAL C C 20 176.276 176.276 178.060 -1.784 19707 7612 1 16 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.508 -2.701 19707 7613 1 16 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.022 -1.471 19707 7614 1 16 . 1 1 20 20 VAL H H 20 7.712 7.712 8.217 -0.505 19707 7615 1 16 . 1 1 21 21 ARG N N 21 121.935 121.935 120.267 1.668 19707 7616 1 16 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.067 -0.072 19707 7617 1 16 . 1 1 21 21 ARG C C 21 176.828 176.828 178.848 -2.020 19707 7618 1 16 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.442 -1.782 19707 7619 1 16 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.535 -2.245 19707 7620 1 16 . 1 1 21 21 ARG H H 21 8.444 8.444 8.224 0.220 19707 7621 1 16 . 1 1 22 22 LEU N N 22 119.327 119.327 119.623 -0.296 19707 7622 1 16 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.086 -0.091 19707 7623 1 16 . 1 1 22 22 LEU C C 22 175.664 175.664 178.491 -2.827 19707 7624 1 16 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.195 -3.327 19707 7625 1 16 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.579 -2.444 19707 7626 1 16 . 1 1 22 22 LEU H H 22 8.248 8.248 8.194 0.054 19707 7627 1 16 . 1 1 23 23 ALA N N 23 121.202 121.202 122.075 -0.873 19707 7628 1 16 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.922 -0.187 19707 7629 1 16 . 1 1 23 23 ALA C C 23 175.492 175.492 179.636 -4.144 19707 7630 1 16 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.320 -2.251 19707 7631 1 16 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.892 -3.825 19707 7632 1 16 . 1 1 23 23 ALA H H 23 8.392 8.392 8.230 0.162 19707 7633 1 16 . 1 1 24 24 SER N N 24 112.377 112.377 114.813 -2.436 19707 7634 1 16 . 1 1 24 24 SER HA H 24 4.214 4.214 4.242 -0.028 19707 7635 1 16 . 1 1 24 24 SER C C 24 174.773 174.773 176.416 -1.643 19707 7636 1 16 . 1 1 24 24 SER CA C 24 59.258 59.258 61.579 -2.321 19707 7637 1 16 . 1 1 24 24 SER CB C 24 60.149 60.149 63.358 -3.209 19707 7638 1 16 . 1 1 24 24 SER H H 24 7.690 7.690 7.739 -0.049 19707 7639 1 16 . 1 1 25 25 ILE N N 25 123.886 123.886 122.770 1.116 19707 7640 1 16 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.003 -0.161 19707 7641 1 16 . 1 1 25 25 ILE C C 25 176.487 176.487 178.229 -1.742 19707 7642 1 16 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.553 -0.560 19707 7643 1 16 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.394 -0.462 19707 7644 1 16 . 1 1 25 25 ILE H H 25 7.837 7.837 8.072 -0.235 19707 7645 1 16 . 1 1 26 26 VAL N N 26 122.538 122.538 120.908 1.630 19707 7646 1 16 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.687 -0.299 19707 7647 1 16 . 1 1 26 26 VAL C C 26 174.624 174.624 177.726 -3.102 19707 7648 1 16 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.396 -2.481 19707 7649 1 16 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.334 -3.439 19707 7650 1 16 . 1 1 26 26 VAL H H 26 8.804 8.804 8.636 0.168 19707 7651 1 16 . 1 1 27 27 ASP N N 27 120.433 120.433 120.306 0.127 19707 7652 1 16 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.308 -0.144 19707 7653 1 16 . 1 1 27 27 ASP C C 27 174.966 174.966 178.438 -3.472 19707 7654 1 16 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.476 -2.147 19707 7655 1 16 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.726 -2.872 19707 7656 1 16 . 1 1 27 27 ASP H H 27 8.719 8.719 8.547 0.172 19707 7657 1 16 . 1 1 28 28 SER N N 28 112.397 112.397 115.656 -3.259 19707 7658 1 16 . 1 1 28 28 SER HA H 28 4.073 4.073 4.174 -0.101 19707 7659 1 16 . 1 1 28 28 SER C C 28 174.405 174.405 176.723 -2.318 19707 7660 1 16 . 1 1 28 28 SER CA C 28 59.115 59.115 61.979 -2.864 19707 7661 1 16 . 1 1 28 28 SER CB C 28 60.125 60.125 63.095 -2.970 19707 7662 1 16 . 1 1 28 28 SER H H 28 7.599 7.599 8.229 -0.630 19707 7663 1 16 . 1 1 29 29 ARG N N 29 123.945 123.945 122.348 1.597 19707 7664 1 16 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.952 0.075 19707 7665 1 16 . 1 1 29 29 ARG C C 29 175.902 175.902 178.070 -2.168 19707 7666 1 16 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.872 -3.598 19707 7667 1 16 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.044 -1.304 19707 7668 1 16 . 1 1 29 29 ARG H H 29 7.769 7.769 7.659 0.110 19707 7669 1 16 . 1 1 30 30 LEU N N 30 121.580 121.580 120.477 1.103 19707 7670 1 16 . 1 1 30 30 LEU HA H 30 3.749 3.749 4.038 -0.289 19707 7671 1 16 . 1 1 30 30 LEU C C 30 177.474 177.474 179.657 -2.183 19707 7672 1 16 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.833 -2.519 19707 7673 1 16 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.806 -2.777 19707 7674 1 16 . 1 1 30 30 LEU H H 30 8.665 8.665 8.297 0.368 19707 7675 1 16 . 1 1 31 31 ILE N N 31 119.330 119.330 117.364 1.966 19707 7676 1 16 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.757 -0.066 19707 7677 1 16 . 1 1 31 31 ILE C C 31 175.341 175.341 177.833 -2.492 19707 7678 1 16 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.087 -2.575 19707 7679 1 16 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.904 -2.337 19707 7680 1 16 . 1 1 31 31 ILE H H 31 8.226 8.226 8.390 -0.164 19707 7681 1 16 . 1 1 32 32 GLY N N 32 106.092 106.092 106.130 -0.038 19707 7682 1 16 . 1 1 32 32 GLY C C 32 172.413 172.413 175.037 -2.624 19707 7683 1 16 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.746 -3.249 19707 7684 1 16 . 1 1 32 32 GLY H H 32 7.767 7.767 7.749 0.018 19707 7685 1 16 . 1 1 33 33 THR N N 33 110.966 110.966 112.655 -1.689 19707 7686 1 16 . 1 1 33 33 THR HA H 33 4.455 4.455 4.348 0.107 19707 7687 1 16 . 1 1 33 33 THR C C 33 172.714 172.714 174.821 -2.107 19707 7688 1 16 . 1 1 33 33 THR CA C 33 60.032 60.032 62.634 -2.602 19707 7689 1 16 . 1 1 33 33 THR CB C 33 68.287 68.287 70.041 -1.754 19707 7690 1 16 . 1 1 33 33 THR H H 33 8.102 8.102 7.827 0.275 19707 7691 1 16 . 1 1 34 34 GLY N N 34 110.320 110.320 109.748 0.572 19707 7692 1 16 . 1 1 34 34 GLY C C 34 170.505 170.505 173.864 -3.359 19707 7693 1 16 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.100 -2.517 19707 7694 1 16 . 1 1 34 34 GLY H H 34 8.072 8.072 8.021 0.051 19707 7695 1 16 . 1 1 35 35 SER N N 35 112.944 112.944 115.484 -2.540 19707 7696 1 16 . 1 1 35 35 SER HA H 35 4.385 4.385 4.913 -0.528 19707 7697 1 16 . 1 1 35 35 SER C C 35 169.537 169.537 172.540 -3.003 19707 7698 1 16 . 1 1 35 35 SER CA C 35 54.794 54.794 57.812 -3.018 19707 7699 1 16 . 1 1 35 35 SER CB C 35 62.029 62.029 66.258 -4.229 19707 7700 1 16 . 1 1 35 35 SER H H 35 7.719 7.719 7.667 0.052 19707 7701 1 16 . 1 1 36 36 VAL N N 36 118.566 118.566 123.289 -4.723 19707 7702 1 16 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.238 -0.205 19707 7703 1 16 . 1 1 36 36 VAL C C 36 169.876 169.876 173.846 -3.970 19707 7704 1 16 . 1 1 36 36 VAL CA C 36 58.565 58.565 59.855 -1.290 19707 7705 1 16 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.735 -2.783 19707 7706 1 16 . 1 1 36 36 VAL H H 36 8.490 8.490 8.242 0.248 19707 7707 1 16 . 1 1 37 37 ASP N N 37 121.640 121.640 127.509 -5.869 19707 7708 1 16 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.839 -0.037 19707 7709 1 16 . 1 1 37 37 ASP C C 37 172.806 172.806 175.451 -2.645 19707 7710 1 16 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.859 -3.816 19707 7711 1 16 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.355 -3.149 19707 7712 1 16 . 1 1 37 37 ASP H H 37 7.195 7.195 8.118 -0.923 19707 7713 1 16 . 1 1 38 38 GLU N N 38 120.018 120.018 120.958 -0.940 19707 7714 1 16 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.970 -0.313 19707 7715 1 16 . 1 1 38 38 GLU C C 38 174.753 174.753 178.250 -3.497 19707 7716 1 16 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.052 -2.560 19707 7717 1 16 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.988 -3.909 19707 7718 1 16 . 1 1 38 38 GLU H H 38 8.908 8.908 8.716 0.192 19707 7719 1 16 . 1 1 39 39 ASP N N 39 118.668 118.668 117.595 1.073 19707 7720 1 16 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.473 -0.227 19707 7721 1 16 . 1 1 39 39 ASP C C 39 175.393 175.393 177.779 -2.386 19707 7722 1 16 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.362 -1.498 19707 7723 1 16 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.517 -3.547 19707 7724 1 16 . 1 1 39 39 ASP H H 39 8.242 8.242 8.644 -0.402 19707 7725 1 16 . 1 1 40 40 PHE N N 40 119.851 119.851 119.233 0.618 19707 7726 1 16 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.423 -0.219 19707 7727 1 16 . 1 1 40 40 PHE C C 40 174.929 174.929 176.111 -1.182 19707 7728 1 16 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.572 -2.401 19707 7729 1 16 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.911 -3.078 19707 7730 1 16 . 1 1 40 40 PHE H H 40 8.037 8.037 7.757 0.280 19707 7731 1 16 . 1 1 41 41 LEU N N 41 117.882 117.882 117.752 0.130 19707 7732 1 16 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.140 -0.618 19707 7733 1 16 . 1 1 41 41 LEU C C 41 175.938 175.938 178.850 -2.912 19707 7734 1 16 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.498 -1.639 19707 7735 1 16 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.401 -3.170 19707 7736 1 16 . 1 1 41 41 LEU H H 41 7.816 7.816 7.808 0.008 19707 7737 1 16 . 1 1 42 42 ARG N N 42 118.360 118.360 119.188 -0.828 19707 7738 1 16 . 1 1 42 42 ARG HA H 42 3.740 3.740 3.990 -0.250 19707 7739 1 16 . 1 1 42 42 ARG C C 42 175.435 175.435 176.964 -1.529 19707 7740 1 16 . 1 1 42 42 ARG CA C 42 56.971 56.971 58.950 -1.979 19707 7741 1 16 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.941 -2.676 19707 7742 1 16 . 1 1 42 42 ARG H H 42 8.540 8.540 8.173 0.367 19707 7743 1 16 . 1 1 43 43 GLU N N 43 114.947 114.947 116.006 -1.059 19707 7744 1 16 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.266 -0.216 19707 7745 1 16 . 1 1 43 43 GLU C C 43 174.518 174.518 177.038 -2.520 19707 7746 1 16 . 1 1 43 43 GLU CA C 43 54.571 54.571 56.617 -2.046 19707 7747 1 16 . 1 1 43 43 GLU CB C 43 26.041 26.041 28.966 -2.925 19707 7748 1 16 . 1 1 43 43 GLU H H 43 7.223 7.223 8.165 -0.942 19707 7749 1 16 . 1 1 44 44 GLN N N 44 114.109 114.109 116.772 -2.663 19707 7750 1 16 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.422 -0.316 19707 7751 1 16 . 1 1 44 44 GLN C C 44 173.777 173.777 177.530 -3.753 19707 7752 1 16 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.445 -3.264 19707 7753 1 16 . 1 1 44 44 GLN CB C 44 25.870 25.870 30.283 -4.413 19707 7754 1 16 . 1 1 44 44 GLN H H 44 7.372 7.372 8.085 -0.713 19707 7755 1 16 . 1 1 45 45 ILE N N 45 117.470 117.470 118.936 -1.466 19707 7756 1 16 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.572 0.376 19707 7757 1 16 . 1 1 45 45 ILE C C 45 172.305 172.305 176.623 -4.318 19707 7758 1 16 . 1 1 45 45 ILE CA C 45 58.505 58.505 65.320 -6.815 19707 7759 1 16 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.590 -1.890 19707 7760 1 16 . 1 1 45 45 ILE H H 45 7.235 7.235 7.319 -0.084 19707 7761 1 16 . 1 1 46 46 ARG N N 46 122.996 122.996 114.463 8.533 19707 7762 1 16 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.002 0.188 19707 7763 1 16 . 1 1 46 46 ARG C C 46 172.992 172.992 175.067 -2.075 19707 7764 1 16 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.104 -4.343 19707 7765 1 16 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.806 -0.854 19707 7766 1 16 . 1 1 46 46 ARG H H 46 8.336 8.336 8.331 0.005 19707 7767 1 16 . 1 1 47 47 ASP N N 47 118.676 118.676 117.232 1.444 19707 7768 1 16 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.641 -0.193 19707 7769 1 16 . 1 1 47 47 ASP C C 47 172.520 172.520 174.496 -1.976 19707 7770 1 16 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.405 -2.515 19707 7771 1 16 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.501 -4.844 19707 7772 1 16 . 1 1 47 47 ASP H H 47 8.313 8.313 7.765 0.548 19707 7773 1 16 . 1 1 48 48 ALA N N 48 120.922 120.922 123.726 -2.804 19707 7774 1 16 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.176 0.193 19707 7775 1 16 . 1 1 48 48 ALA C C 48 174.295 174.295 177.564 -3.269 19707 7776 1 16 . 1 1 48 48 ALA CA C 48 49.637 49.637 53.140 -3.503 19707 7777 1 16 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.104 -2.890 19707 7778 1 16 . 1 1 48 48 ALA H H 48 7.824 7.824 7.724 0.100 19707 7779 1 16 . 1 1 49 49 ARG N N 49 118.644 118.644 124.104 -5.460 19707 7780 1 16 . 1 1 49 49 ARG HA H 49 4.342 4.342 3.948 0.394 19707 7781 1 16 . 1 1 49 49 ARG C C 49 172.504 172.504 176.135 -3.631 19707 7782 1 16 . 1 1 49 49 ARG CA C 49 53.909 53.909 58.312 -4.403 19707 7783 1 16 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.809 -2.466 19707 7784 1 16 . 1 1 49 49 ARG H H 49 7.911 7.911 8.384 -0.473 19707 7785 1 16 . 1 1 50 50 TYR N N 50 119.470 119.470 115.189 4.281 19707 7786 1 16 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.060 0.231 19707 7787 1 16 . 1 1 50 50 TYR C C 50 170.470 170.470 174.272 -3.802 19707 7788 1 16 . 1 1 50 50 TYR CA C 50 53.268 53.268 54.775 -1.507 19707 7789 1 16 . 1 1 50 50 TYR CB C 50 39.513 39.513 39.595 -0.082 19707 7790 1 16 . 1 1 50 50 TYR H H 50 7.639 7.639 8.101 -0.462 19707 7791 1 16 . 1 1 51 51 ALA N N 51 127.418 127.418 126.676 0.742 19707 7792 1 16 . 1 1 51 51 ALA HA H 51 5.221 5.221 4.779 0.442 19707 7793 1 16 . 1 1 51 51 ALA C C 51 171.328 171.328 175.672 -4.344 19707 7794 1 16 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.947 -3.514 19707 7795 1 16 . 1 1 51 51 ALA CB C 51 20.312 20.312 20.853 -0.541 19707 7796 1 16 . 1 1 51 51 ALA H H 51 8.222 8.222 8.809 -0.587 19707 7797 1 16 . 1 1 52 52 VAL N N 52 117.832 117.832 121.203 -3.371 19707 7798 1 16 . 1 1 52 52 VAL HA H 52 4.667 4.667 4.999 -0.332 19707 7799 1 16 . 1 1 52 52 VAL C C 52 172.436 172.436 174.236 -1.800 19707 7800 1 16 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.166 -3.409 19707 7801 1 16 . 1 1 52 52 VAL CB C 52 32.103 32.103 35.941 -3.838 19707 7802 1 16 . 1 1 52 52 VAL H H 52 8.753 8.753 8.800 -0.047 19707 7803 1 16 . 1 1 53 53 ILE N N 53 128.027 128.027 126.529 1.498 19707 7804 1 16 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.631 0.211 19707 7805 1 16 . 1 1 53 53 ILE C C 53 172.110 172.110 174.321 -2.211 19707 7806 1 16 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.472 -2.719 19707 7807 1 16 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.132 -3.973 19707 7808 1 16 . 1 1 53 53 ILE H H 53 9.261 9.261 9.049 0.212 19707 7809 1 16 . 1 1 54 54 ARG N N 54 127.885 127.885 127.378 0.507 19707 7810 1 16 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.600 0.153 19707 7811 1 16 . 1 1 54 54 ARG C C 54 172.285 172.285 174.001 -1.716 19707 7812 1 16 . 1 1 54 54 ARG CA C 54 52.260 52.260 54.271 -2.011 19707 7813 1 16 . 1 1 54 54 ARG CB C 54 27.892 27.892 31.282 -3.390 19707 7814 1 16 . 1 1 54 54 ARG H H 54 8.686 8.686 8.617 0.069 19707 7815 1 16 . 1 1 55 55 ILE N N 55 129.907 129.907 124.303 5.604 19707 7816 1 16 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.294 -0.141 19707 7817 1 16 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.512 -2.917 19707 7818 1 16 . 1 1 55 55 ILE CB C 55 37.613 37.613 38.719 -1.107 19707 7819 1 16 . 1 1 55 55 ILE H H 55 9.292 9.292 8.263 1.029 19707 7820 1 16 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.295 -0.103 19707 7821 1 16 . 1 1 56 56 PRO C C 56 174.787 174.787 177.707 -2.920 19707 7822 1 16 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.189 -2.455 19707 7823 1 16 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.826 -2.913 19707 7824 1 16 . 1 1 57 57 GLY N N 57 111.828 111.828 111.696 0.132 19707 7825 1 16 . 1 1 57 57 GLY C C 57 171.039 171.039 173.544 -2.505 19707 7826 1 16 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.921 -2.104 19707 7827 1 16 . 1 1 57 57 GLY H H 57 8.708 8.708 8.876 -0.168 19707 7828 1 16 . 1 1 58 58 GLN N N 58 118.457 118.457 119.809 -1.352 19707 7829 1 16 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.809 0.091 19707 7830 1 16 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.144 -2.872 19707 7831 1 16 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.483 -2.329 19707 7832 1 16 . 1 1 58 58 GLN H H 58 7.909 7.909 7.597 0.312 19707 7833 1 16 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.404 0.032 19707 7834 1 16 . 1 1 59 59 PRO C C 59 174.607 174.607 176.375 -1.768 19707 7835 1 16 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.896 -2.841 19707 7836 1 16 . 1 1 59 59 PRO CB C 59 29.177 29.177 31.989 -2.812 19707 7837 1 16 . 1 1 60 60 VAL N N 60 122.695 122.695 124.237 -1.542 19707 7838 1 16 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.098 -0.143 19707 7839 1 16 . 1 1 60 60 VAL C C 60 172.403 172.403 175.681 -3.278 19707 7840 1 16 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.866 -1.971 19707 7841 1 16 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.112 -2.470 19707 7842 1 16 . 1 1 60 60 VAL H H 60 8.364 8.364 8.354 0.010 19707 7843 1 16 . 1 1 61 61 VAL N N 61 126.097 126.097 128.261 -2.164 19707 7844 1 16 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.498 -0.198 19707 7845 1 16 . 1 1 61 61 VAL C C 61 170.891 170.891 174.040 -3.149 19707 7846 1 16 . 1 1 61 61 VAL CA C 61 58.814 58.814 60.171 -1.357 19707 7847 1 16 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.873 -3.675 19707 7848 1 16 . 1 1 61 61 VAL H H 61 8.023 8.023 8.518 -0.495 19707 7849 1 16 . 1 1 62 62 GLU N N 62 126.097 126.097 127.714 -1.617 19707 7850 1 16 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.942 0.217 19707 7851 1 16 . 1 1 62 62 GLU C C 62 172.252 172.252 175.289 -3.037 19707 7852 1 16 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.065 -3.525 19707 7853 1 16 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.007 -1.707 19707 7854 1 16 . 1 1 62 62 GLU H H 62 8.591 8.591 8.545 0.046 19707 7855 1 16 . 1 1 63 63 VAL N N 63 120.374 120.374 123.342 -2.968 19707 7856 1 16 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.176 0.217 19707 7857 1 16 . 1 1 63 63 VAL C C 63 171.040 171.040 177.062 -6.022 19707 7858 1 16 . 1 1 63 63 VAL CA C 63 57.833 57.833 62.292 -4.459 19707 7859 1 16 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.314 0.263 19707 7860 1 16 . 1 1 63 63 VAL H H 63 8.732 8.732 8.841 -0.109 19707 7861 1 16 . 1 1 64 64 GLY N N 64 109.935 109.935 114.841 -4.906 19707 7862 1 16 . 1 1 64 64 GLY C C 64 171.656 171.656 174.117 -2.461 19707 7863 1 16 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.295 -5.118 19707 7864 1 16 . 1 1 64 64 GLY H H 64 8.259 8.259 8.577 -0.318 19707 7865 1 16 . 1 1 65 65 THR N N 65 115.478 115.478 115.726 -0.248 19707 7866 1 16 . 1 1 65 65 THR HA H 65 4.342 4.342 4.335 0.007 19707 7867 1 16 . 1 1 65 65 THR C C 65 170.663 170.663 172.545 -1.882 19707 7868 1 16 . 1 1 65 65 THR CA C 65 58.357 58.357 60.793 -2.436 19707 7869 1 16 . 1 1 65 65 THR CB C 65 67.923 67.923 71.541 -3.618 19707 7870 1 16 . 1 1 65 65 THR H H 65 8.123 8.123 7.479 0.644 19707 7871 1 16 . 1 1 66 66 LYS N N 66 130.775 130.775 122.939 7.836 19707 7872 1 16 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.242 -1.312 19707 7873 1 16 . 1 1 66 66 LYS CA C 66 52.190 52.190 53.923 -1.733 19707 7874 1 16 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.301 -2.611 19707 7875 1 16 . 1 1 66 66 LYS H H 66 8.472 8.472 8.157 0.315 19707 7876 1 16 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.550 -0.139 19707 7877 1 16 . 1 1 67 67 PRO C C 67 173.211 173.211 176.915 -3.704 19707 7878 1 16 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.352 -2.787 19707 7879 1 16 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.765 -3.362 19707 7880 1 16 . 1 1 68 68 THR N N 68 111.983 111.983 114.223 -2.240 19707 7881 1 16 . 1 1 68 68 THR HA H 68 4.277 4.277 4.250 0.027 19707 7882 1 16 . 1 1 68 68 THR C C 68 171.720 171.720 175.538 -3.818 19707 7883 1 16 . 1 1 68 68 THR CA C 68 58.193 58.193 63.189 -4.996 19707 7884 1 16 . 1 1 68 68 THR CB C 68 67.723 67.723 69.229 -1.506 19707 7885 1 16 . 1 1 68 68 THR H H 68 8.091 8.091 8.307 -0.216 19707 7886 1 16 . 1 1 69 69 GLY N N 69 109.918 109.918 108.977 0.941 19707 7887 1 16 . 1 1 69 69 GLY C C 69 170.783 170.783 174.374 -3.591 19707 7888 1 16 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.710 -2.654 19707 7889 1 16 . 1 1 69 69 GLY H H 69 8.119 8.119 8.009 0.110 19707 7890 1 16 . 1 1 70 70 ASP N N 70 123.294 123.294 125.273 -1.979 19707 7891 1 16 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.828 -0.279 19707 7892 1 16 . 1 1 70 70 ASP C C 70 173.651 173.651 175.193 -1.542 19707 7893 1 16 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.752 -2.891 19707 7894 1 16 . 1 1 70 70 ASP CB C 70 37.733 37.733 38.999 -1.266 19707 7895 1 16 . 1 1 70 70 ASP H H 70 8.444 8.444 8.784 -0.340 19707 7896 1 16 . 1 1 71 71 VAL N N 71 117.772 117.772 113.640 4.132 19707 7897 1 16 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.055 -0.348 19707 7898 1 16 . 1 1 71 71 VAL C C 71 172.992 172.992 174.545 -1.553 19707 7899 1 16 . 1 1 71 71 VAL CA C 71 57.376 57.376 58.865 -1.489 19707 7900 1 16 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.551 -2.529 19707 7901 1 16 . 1 1 71 71 VAL H H 71 8.173 8.173 7.826 0.347 19707 7902 1 16 . 1 1 72 72 LEU N N 72 123.435 123.435 123.060 0.375 19707 7903 1 16 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.717 -0.081 19707 7904 1 16 . 1 1 72 72 LEU C C 72 173.189 173.189 176.093 -2.904 19707 7905 1 16 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.000 -2.793 19707 7906 1 16 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.391 -0.753 19707 7907 1 16 . 1 1 72 72 LEU H H 72 8.859 8.859 8.962 -0.103 19707 7908 1 16 . 1 1 73 73 GLN N N 73 119.520 119.520 123.701 -4.181 19707 7909 1 16 . 1 1 73 73 GLN HA H 73 5.345 5.345 4.995 0.350 19707 7910 1 16 . 1 1 73 73 GLN C C 73 172.249 172.249 176.207 -3.958 19707 7911 1 16 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.785 -3.453 19707 7912 1 16 . 1 1 73 73 GLN CB C 73 29.770 29.770 29.511 0.259 19707 7913 1 16 . 1 1 73 73 GLN H H 73 9.196 9.196 8.376 0.820 19707 7914 1 16 . 1 1 74 74 GLY N N 74 113.513 113.513 112.601 0.912 19707 7915 1 16 . 1 1 74 74 GLY C C 74 169.072 169.072 172.230 -3.158 19707 7916 1 16 . 1 1 74 74 GLY CA C 74 41.297 41.297 44.416 -3.119 19707 7917 1 16 . 1 1 74 74 GLY H H 74 9.373 9.373 9.005 0.368 19707 7918 1 16 . 1 1 75 75 ARG N N 75 122.479 122.479 121.954 0.525 19707 7919 1 16 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.353 0.149 19707 7920 1 16 . 1 1 75 75 ARG C C 75 172.348 172.348 173.882 -1.534 19707 7921 1 16 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.456 -3.698 19707 7922 1 16 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.718 -2.900 19707 7923 1 16 . 1 1 75 75 ARG H H 75 8.615 8.615 8.557 0.058 19707 7924 1 16 . 1 1 76 76 ALA N N 76 122.346 122.346 123.503 -1.157 19707 7925 1 16 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.711 -0.175 19707 7926 1 16 . 1 1 76 76 ALA C C 76 172.704 172.704 174.541 -1.837 19707 7927 1 16 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.961 -2.934 19707 7928 1 16 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.423 -2.398 19707 7929 1 16 . 1 1 76 76 ALA H H 76 8.590 8.590 8.612 -0.022 19707 7930 1 16 . 1 1 77 77 THR N N 77 116.961 116.961 115.595 1.366 19707 7931 1 16 . 1 1 77 77 THR HA H 77 4.988 4.988 5.065 -0.077 19707 7932 1 16 . 1 1 77 77 THR C C 77 172.800 172.800 174.976 -2.176 19707 7933 1 16 . 1 1 77 77 THR CA C 77 58.344 58.344 61.242 -2.898 19707 7934 1 16 . 1 1 77 77 THR CB C 77 67.712 67.712 70.905 -3.193 19707 7935 1 16 . 1 1 77 77 THR H H 77 8.491 8.491 8.289 0.202 19707 7936 1 16 . 1 1 78 78 GLY N N 78 111.103 111.103 111.442 -0.339 19707 7937 1 16 . 1 1 78 78 GLY C C 78 172.567 172.567 173.603 -1.036 19707 7938 1 16 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.561 -2.252 19707 7939 1 16 . 1 1 78 78 GLY H H 78 8.649 8.649 8.409 0.240 19707 7940 1 16 . 1 1 79 79 GLU N N 79 123.423 123.423 118.396 5.027 19707 7941 1 16 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.315 -0.319 19707 7942 1 16 . 1 1 79 79 GLU C C 79 175.466 175.466 177.520 -2.054 19707 7943 1 16 . 1 1 79 79 GLU CA C 79 55.459 55.459 57.825 -2.366 19707 7944 1 16 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.968 -3.901 19707 7945 1 16 . 1 1 79 79 GLU H H 79 10.375 10.375 8.661 1.714 19707 7946 1 16 . 1 1 80 80 GLU N N 80 113.846 113.846 117.816 -3.970 19707 7947 1 16 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.427 -0.069 19707 7948 1 16 . 1 1 80 80 GLU C C 80 173.293 173.293 176.794 -3.501 19707 7949 1 16 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.941 -4.165 19707 7950 1 16 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.471 -4.740 19707 7951 1 16 . 1 1 80 80 GLU H H 80 7.679 7.679 8.660 -0.981 19707 7952 1 16 . 1 1 81 81 GLY N N 81 105.493 105.493 109.006 -3.513 19707 7953 1 16 . 1 1 81 81 GLY C C 81 170.427 170.427 173.788 -3.361 19707 7954 1 16 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.205 -2.593 19707 7955 1 16 . 1 1 81 81 GLY H H 81 7.476 7.476 7.628 -0.152 19707 7956 1 16 . 1 1 82 82 GLU N N 82 122.160 122.160 119.009 3.151 19707 7957 1 16 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.351 0.603 19707 7958 1 16 . 1 1 82 82 GLU C C 82 171.004 171.004 175.046 -4.042 19707 7959 1 16 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.705 -4.384 19707 7960 1 16 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.740 -4.674 19707 7961 1 16 . 1 1 82 82 GLU H H 82 9.585 9.585 8.152 1.433 19707 7962 1 16 . 1 1 83 83 THR N N 83 114.756 114.756 114.604 0.152 19707 7963 1 16 . 1 1 83 83 THR HA H 83 4.990 4.990 5.049 -0.059 19707 7964 1 16 . 1 1 83 83 THR C C 83 170.909 170.909 173.400 -2.491 19707 7965 1 16 . 1 1 83 83 THR CA C 83 57.957 57.957 62.097 -4.140 19707 7966 1 16 . 1 1 83 83 THR CB C 83 68.271 68.271 71.924 -3.653 19707 7967 1 16 . 1 1 83 83 THR H H 83 8.490 8.490 7.877 0.613 19707 7968 1 16 . 1 1 84 84 VAL N N 84 122.639 122.639 124.665 -2.026 19707 7969 1 16 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.989 -0.334 19707 7970 1 16 . 1 1 84 84 VAL C C 84 170.962 170.962 173.578 -2.616 19707 7971 1 16 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.117 -2.820 19707 7972 1 16 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.699 -3.475 19707 7973 1 16 . 1 1 84 84 VAL H H 84 9.001 9.001 8.934 0.067 19707 7974 1 16 . 1 1 85 85 LEU N N 85 129.903 129.903 125.960 3.943 19707 7975 1 16 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.375 0.017 19707 7976 1 16 . 1 1 85 85 LEU C C 85 172.346 172.346 174.534 -2.188 19707 7977 1 16 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.334 -2.537 19707 7978 1 16 . 1 1 85 85 LEU CB C 85 42.515 42.515 47.058 -4.543 19707 7979 1 16 . 1 1 85 85 LEU H H 85 8.610 8.610 8.889 -0.279 19707 7980 1 16 . 1 1 86 86 VAL N N 86 122.778 122.778 122.725 0.053 19707 7981 1 16 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.866 0.175 19707 7982 1 16 . 1 1 86 86 VAL C C 86 172.570 172.570 174.443 -1.873 19707 7983 1 16 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.004 -3.804 19707 7984 1 16 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.323 -3.048 19707 7985 1 16 . 1 1 86 86 VAL H H 86 9.228 9.228 8.952 0.276 19707 7986 1 16 . 1 1 87 87 GLU N N 87 120.437 120.437 126.006 -5.569 19707 7987 1 16 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.498 0.233 19707 7988 1 16 . 1 1 87 87 GLU C C 87 172.267 172.267 174.874 -2.607 19707 7989 1 16 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.409 -3.060 19707 7990 1 16 . 1 1 87 87 GLU CB C 87 31.124 31.124 34.053 -2.929 19707 7991 1 16 . 1 1 87 87 GLU H H 87 8.851 8.851 9.124 -0.273 19707 7992 1 16 . 1 1 88 88 GLU N N 88 118.525 118.525 120.043 -1.518 19707 7993 1 16 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.613 0.388 19707 7994 1 16 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.934 -3.017 19707 7995 1 16 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.113 -1.166 19707 7996 1 16 . 1 1 88 88 GLU H H 88 8.380 8.380 8.133 0.247 19707 7997 1 16 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.487 0.042 19707 7998 1 16 . 1 1 89 89 PRO C C 89 172.774 172.774 176.753 -3.979 19707 7999 1 16 . 1 1 89 89 PRO CA C 89 60.381 60.381 62.937 -2.556 19707 8000 1 16 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.210 -2.876 19707 8001 1 17 . 1 1 2 2 SER N N 2 115.963 115.963 116.305 -0.342 19707 8002 1 17 . 1 1 2 2 SER HA H 2 4.408 4.408 4.717 -0.309 19707 8003 1 17 . 1 1 2 2 SER C C 2 171.788 171.788 173.853 -2.065 19707 8004 1 17 . 1 1 2 2 SER CA C 2 55.870 55.870 57.597 -1.727 19707 8005 1 17 . 1 1 2 2 SER CB C 2 61.022 61.022 64.892 -3.870 19707 8006 1 17 . 1 1 2 2 SER H H 2 8.661 8.661 8.211 0.450 19707 8007 1 17 . 1 1 3 3 GLU N N 3 122.941 122.941 122.045 0.896 19707 8008 1 17 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.481 -0.161 19707 8009 1 17 . 1 1 3 3 GLU C C 3 173.817 173.817 175.454 -1.637 19707 8010 1 17 . 1 1 3 3 GLU CA C 3 53.954 53.954 57.199 -3.245 19707 8011 1 17 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.390 -3.554 19707 8012 1 17 . 1 1 3 3 GLU H H 3 8.706 8.706 8.904 -0.198 19707 8013 1 17 . 1 1 4 4 THR N N 4 116.182 116.182 114.507 1.675 19707 8014 1 17 . 1 1 4 4 THR HA H 4 4.233 4.233 4.546 -0.313 19707 8015 1 17 . 1 1 4 4 THR C C 4 171.719 171.719 173.017 -1.298 19707 8016 1 17 . 1 1 4 4 THR CA C 4 59.414 59.414 61.483 -2.069 19707 8017 1 17 . 1 1 4 4 THR CB C 4 67.009 67.009 70.417 -3.408 19707 8018 1 17 . 1 1 4 4 THR H H 4 8.165 8.165 7.961 0.204 19707 8019 1 17 . 1 1 5 5 ARG N N 5 124.184 124.184 122.815 1.369 19707 8020 1 17 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.657 -0.297 19707 8021 1 17 . 1 1 5 5 ARG C C 5 173.520 173.520 175.632 -2.112 19707 8022 1 17 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.569 -2.226 19707 8023 1 17 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.942 -2.777 19707 8024 1 17 . 1 1 5 5 ARG H H 5 8.354 8.354 8.406 -0.052 19707 8025 1 17 . 1 1 6 6 THR N N 6 116.652 116.652 120.006 -3.354 19707 8026 1 17 . 1 1 6 6 THR HA H 6 4.263 4.263 4.474 -0.211 19707 8027 1 17 . 1 1 6 6 THR C C 6 171.784 171.784 173.848 -2.064 19707 8028 1 17 . 1 1 6 6 THR CA C 6 59.218 59.218 62.782 -3.563 19707 8029 1 17 . 1 1 6 6 THR CB C 6 67.213 67.213 69.528 -2.315 19707 8030 1 17 . 1 1 6 6 THR H H 6 8.224 8.224 8.498 -0.274 19707 8031 1 17 . 1 1 7 7 ILE N N 7 123.882 123.882 121.049 2.833 19707 8032 1 17 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.403 -0.265 19707 8033 1 17 . 1 1 7 7 ILE C C 7 173.572 173.572 175.080 -1.508 19707 8034 1 17 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.603 -2.122 19707 8035 1 17 . 1 1 7 7 ILE CB C 7 36.069 36.069 41.106 -5.037 19707 8036 1 17 . 1 1 7 7 ILE H H 7 8.247 8.247 8.092 0.155 19707 8037 1 17 . 1 1 8 8 SER N N 8 120.287 120.287 119.205 1.082 19707 8038 1 17 . 1 1 8 8 SER HA H 8 4.445 4.445 4.643 -0.198 19707 8039 1 17 . 1 1 8 8 SER C C 8 171.926 171.926 174.740 -2.814 19707 8040 1 17 . 1 1 8 8 SER CA C 8 55.522 55.522 57.535 -2.013 19707 8041 1 17 . 1 1 8 8 SER CB C 8 61.073 61.073 63.743 -2.671 19707 8042 1 17 . 1 1 8 8 SER H H 8 8.402 8.402 8.519 -0.117 19707 8043 1 17 . 1 1 9 9 SER N N 9 118.425 118.425 124.669 -6.244 19707 8044 1 17 . 1 1 9 9 SER HA H 9 4.525 4.525 4.323 0.202 19707 8045 1 17 . 1 1 9 9 SER C C 9 172.663 172.663 174.142 -1.479 19707 8046 1 17 . 1 1 9 9 SER CA C 9 55.897 55.897 59.628 -3.731 19707 8047 1 17 . 1 1 9 9 SER CB C 9 61.375 61.375 61.706 -0.331 19707 8048 1 17 . 1 1 9 9 SER H H 9 8.362 8.362 9.073 -0.711 19707 8049 1 17 . 1 1 10 10 THR N N 10 115.676 115.676 112.747 2.929 19707 8050 1 17 . 1 1 10 10 THR HA H 10 4.232 4.232 4.449 -0.217 19707 8051 1 17 . 1 1 10 10 THR C C 10 173.070 173.070 175.637 -2.567 19707 8052 1 17 . 1 1 10 10 THR CA C 10 60.318 60.318 62.680 -2.362 19707 8053 1 17 . 1 1 10 10 THR CB C 10 67.205 67.205 69.283 -2.078 19707 8054 1 17 . 1 1 10 10 THR H H 10 8.274 8.274 8.213 0.061 19707 8055 1 17 . 1 1 11 11 ALA N N 11 124.726 124.726 125.362 -0.636 19707 8056 1 17 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.077 -0.090 19707 8057 1 17 . 1 1 11 11 ALA C C 11 176.825 176.825 179.358 -2.533 19707 8058 1 17 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.941 -2.400 19707 8059 1 17 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.119 -2.230 19707 8060 1 17 . 1 1 11 11 ALA H H 11 8.347 8.347 8.311 0.036 19707 8061 1 17 . 1 1 12 12 GLN N N 12 117.915 117.915 117.871 0.044 19707 8062 1 17 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.095 -0.306 19707 8063 1 17 . 1 1 12 12 GLN C C 12 174.697 174.697 177.963 -3.266 19707 8064 1 17 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.080 -3.076 19707 8065 1 17 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.587 -2.362 19707 8066 1 17 . 1 1 12 12 GLN H H 12 8.194 8.194 8.274 -0.080 19707 8067 1 17 . 1 1 13 13 GLU N N 13 118.510 118.510 119.792 -1.282 19707 8068 1 17 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.099 0.004 19707 8069 1 17 . 1 1 13 13 GLU C C 13 176.192 176.192 179.199 -3.007 19707 8070 1 17 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.941 -2.626 19707 8071 1 17 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.582 -3.550 19707 8072 1 17 . 1 1 13 13 GLU H H 13 7.917 7.917 8.127 -0.210 19707 8073 1 17 . 1 1 14 14 ARG N N 14 118.193 118.193 119.363 -1.170 19707 8074 1 17 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.052 -0.084 19707 8075 1 17 . 1 1 14 14 ARG C C 14 176.764 176.764 178.501 -1.737 19707 8076 1 17 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.042 -1.759 19707 8077 1 17 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.741 -2.504 19707 8078 1 17 . 1 1 14 14 ARG H H 14 7.907 7.907 8.010 -0.103 19707 8079 1 17 . 1 1 15 15 VAL N N 15 117.991 117.991 114.329 3.662 19707 8080 1 17 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.896 0.007 19707 8081 1 17 . 1 1 15 15 VAL C C 15 174.922 174.922 177.155 -2.233 19707 8082 1 17 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.812 -1.981 19707 8083 1 17 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.287 -2.564 19707 8084 1 17 . 1 1 15 15 VAL H H 15 7.658 7.658 7.435 0.223 19707 8085 1 17 . 1 1 16 16 ASP N N 16 124.314 124.314 120.340 3.974 19707 8086 1 17 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.402 -0.086 19707 8087 1 17 . 1 1 16 16 ASP C C 16 176.462 176.462 177.957 -1.495 19707 8088 1 17 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.535 -2.209 19707 8089 1 17 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.298 -4.629 19707 8090 1 17 . 1 1 16 16 ASP H H 16 8.291 8.291 7.992 0.299 19707 8091 1 17 . 1 1 17 17 LEU N N 17 120.212 120.212 119.438 0.774 19707 8092 1 17 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.140 -0.086 19707 8093 1 17 . 1 1 17 17 LEU C C 17 177.171 177.171 179.107 -1.936 19707 8094 1 17 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.644 -2.664 19707 8095 1 17 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.244 -2.399 19707 8096 1 17 . 1 1 17 17 LEU H H 17 8.172 8.172 7.647 0.525 19707 8097 1 17 . 1 1 18 18 GLU N N 18 120.587 120.587 118.998 1.589 19707 8098 1 17 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.929 0.264 19707 8099 1 17 . 1 1 18 18 GLU C C 18 175.997 175.997 178.554 -2.557 19707 8100 1 17 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.509 -3.407 19707 8101 1 17 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.822 -2.750 19707 8102 1 17 . 1 1 18 18 GLU H H 18 7.876 7.876 7.799 0.077 19707 8103 1 17 . 1 1 19 19 ALA N N 19 121.800 121.800 122.695 -0.895 19707 8104 1 17 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.130 -0.339 19707 8105 1 17 . 1 1 19 19 ALA C C 19 175.708 175.708 179.783 -4.075 19707 8106 1 17 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.911 -2.059 19707 8107 1 17 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.344 -4.190 19707 8108 1 17 . 1 1 19 19 ALA H H 19 7.792 7.792 7.585 0.207 19707 8109 1 17 . 1 1 20 20 VAL N N 20 118.680 118.680 118.935 -0.255 19707 8110 1 17 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.582 -0.282 19707 8111 1 17 . 1 1 20 20 VAL C C 20 176.276 176.276 178.448 -2.172 19707 8112 1 17 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.520 -2.713 19707 8113 1 17 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.431 -1.880 19707 8114 1 17 . 1 1 20 20 VAL H H 20 7.712 7.712 8.033 -0.321 19707 8115 1 17 . 1 1 21 21 ARG N N 21 121.935 121.935 120.162 1.773 19707 8116 1 17 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.087 -0.092 19707 8117 1 17 . 1 1 21 21 ARG C C 21 176.828 176.828 179.042 -2.214 19707 8118 1 17 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.580 -1.920 19707 8119 1 17 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.590 -2.300 19707 8120 1 17 . 1 1 21 21 ARG H H 21 8.444 8.444 8.379 0.065 19707 8121 1 17 . 1 1 22 22 LEU N N 22 119.327 119.327 120.129 -0.802 19707 8122 1 17 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.106 -0.111 19707 8123 1 17 . 1 1 22 22 LEU C C 22 175.664 175.664 178.572 -2.908 19707 8124 1 17 . 1 1 22 22 LEU CA C 22 54.868 54.868 57.948 -3.080 19707 8125 1 17 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.389 -2.254 19707 8126 1 17 . 1 1 22 22 LEU H H 22 8.248 8.248 8.356 -0.108 19707 8127 1 17 . 1 1 23 23 ALA N N 23 121.202 121.202 122.219 -1.017 19707 8128 1 17 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.960 -0.225 19707 8129 1 17 . 1 1 23 23 ALA C C 23 175.492 175.492 179.669 -4.177 19707 8130 1 17 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.323 -2.254 19707 8131 1 17 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.027 -3.960 19707 8132 1 17 . 1 1 23 23 ALA H H 23 8.392 8.392 8.623 -0.231 19707 8133 1 17 . 1 1 24 24 SER N N 24 112.377 112.377 115.032 -2.655 19707 8134 1 17 . 1 1 24 24 SER HA H 24 4.214 4.214 4.280 -0.066 19707 8135 1 17 . 1 1 24 24 SER C C 24 174.773 174.773 176.376 -1.603 19707 8136 1 17 . 1 1 24 24 SER CA C 24 59.258 59.258 62.457 -3.199 19707 8137 1 17 . 1 1 24 24 SER CB C 24 60.149 60.149 63.171 -3.022 19707 8138 1 17 . 1 1 24 24 SER H H 24 7.690 7.690 8.069 -0.379 19707 8139 1 17 . 1 1 25 25 ILE N N 25 123.886 123.886 121.574 2.312 19707 8140 1 17 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.966 -0.124 19707 8141 1 17 . 1 1 25 25 ILE C C 25 176.487 176.487 177.904 -1.417 19707 8142 1 17 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.074 -0.081 19707 8143 1 17 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.187 -0.255 19707 8144 1 17 . 1 1 25 25 ILE H H 25 7.837 7.837 8.249 -0.412 19707 8145 1 17 . 1 1 26 26 VAL N N 26 122.538 122.538 121.246 1.292 19707 8146 1 17 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.668 -0.280 19707 8147 1 17 . 1 1 26 26 VAL C C 26 174.624 174.624 177.709 -3.085 19707 8148 1 17 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.524 -2.609 19707 8149 1 17 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.264 -3.369 19707 8150 1 17 . 1 1 26 26 VAL H H 26 8.804 8.804 8.683 0.121 19707 8151 1 17 . 1 1 27 27 ASP N N 27 120.433 120.433 120.251 0.182 19707 8152 1 17 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.245 -0.081 19707 8153 1 17 . 1 1 27 27 ASP C C 27 174.966 174.966 178.332 -3.366 19707 8154 1 17 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.724 -2.395 19707 8155 1 17 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.717 -2.863 19707 8156 1 17 . 1 1 27 27 ASP H H 27 8.719 8.719 8.288 0.431 19707 8157 1 17 . 1 1 28 28 SER N N 28 112.397 112.397 115.369 -2.972 19707 8158 1 17 . 1 1 28 28 SER HA H 28 4.073 4.073 4.109 -0.036 19707 8159 1 17 . 1 1 28 28 SER C C 28 174.405 174.405 176.820 -2.415 19707 8160 1 17 . 1 1 28 28 SER CA C 28 59.115 59.115 61.276 -2.162 19707 8161 1 17 . 1 1 28 28 SER CB C 28 60.125 60.125 63.231 -3.106 19707 8162 1 17 . 1 1 28 28 SER H H 28 7.599 7.599 8.017 -0.417 19707 8163 1 17 . 1 1 29 29 ARG N N 29 123.945 123.945 122.151 1.794 19707 8164 1 17 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.881 0.146 19707 8165 1 17 . 1 1 29 29 ARG C C 29 175.902 175.902 178.539 -2.637 19707 8166 1 17 . 1 1 29 29 ARG CA C 29 54.274 54.274 58.258 -3.984 19707 8167 1 17 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.162 -1.422 19707 8168 1 17 . 1 1 29 29 ARG H H 29 7.769 7.769 7.845 -0.076 19707 8169 1 17 . 1 1 30 30 LEU N N 30 121.580 121.580 120.276 1.304 19707 8170 1 17 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.990 -0.241 19707 8171 1 17 . 1 1 30 30 LEU C C 30 177.474 177.474 179.670 -2.196 19707 8172 1 17 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.778 -2.465 19707 8173 1 17 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.867 -2.838 19707 8174 1 17 . 1 1 30 30 LEU H H 30 8.665 8.665 8.249 0.416 19707 8175 1 17 . 1 1 31 31 ILE N N 31 119.330 119.330 117.580 1.750 19707 8176 1 17 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.740 -0.049 19707 8177 1 17 . 1 1 31 31 ILE C C 31 175.341 175.341 177.894 -2.553 19707 8178 1 17 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.041 -2.529 19707 8179 1 17 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.946 -2.379 19707 8180 1 17 . 1 1 31 31 ILE H H 31 8.226 8.226 8.402 -0.176 19707 8181 1 17 . 1 1 32 32 GLY N N 32 106.092 106.092 107.135 -1.043 19707 8182 1 17 . 1 1 32 32 GLY C C 32 172.413 172.413 175.405 -2.992 19707 8183 1 17 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.896 -3.399 19707 8184 1 17 . 1 1 32 32 GLY H H 32 7.767 7.767 7.922 -0.155 19707 8185 1 17 . 1 1 33 33 THR N N 33 110.966 110.966 113.759 -2.793 19707 8186 1 17 . 1 1 33 33 THR HA H 33 4.455 4.455 4.402 0.053 19707 8187 1 17 . 1 1 33 33 THR C C 33 172.714 172.714 175.456 -2.742 19707 8188 1 17 . 1 1 33 33 THR CA C 33 60.032 60.032 62.113 -2.081 19707 8189 1 17 . 1 1 33 33 THR CB C 33 68.287 68.287 70.169 -1.882 19707 8190 1 17 . 1 1 33 33 THR H H 33 8.102 8.102 7.723 0.379 19707 8191 1 17 . 1 1 34 34 GLY N N 34 110.320 110.320 110.943 -0.623 19707 8192 1 17 . 1 1 34 34 GLY C C 34 170.505 170.505 173.624 -3.119 19707 8193 1 17 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.010 -2.427 19707 8194 1 17 . 1 1 34 34 GLY H H 34 8.072 8.072 8.134 -0.062 19707 8195 1 17 . 1 1 35 35 SER N N 35 112.944 112.944 115.249 -2.305 19707 8196 1 17 . 1 1 35 35 SER HA H 35 4.385 4.385 4.822 -0.437 19707 8197 1 17 . 1 1 35 35 SER C C 35 169.537 169.537 172.518 -2.981 19707 8198 1 17 . 1 1 35 35 SER CA C 35 54.794 54.794 57.863 -3.069 19707 8199 1 17 . 1 1 35 35 SER CB C 35 62.029 62.029 66.413 -4.384 19707 8200 1 17 . 1 1 35 35 SER H H 35 7.719 7.719 7.641 0.078 19707 8201 1 17 . 1 1 36 36 VAL N N 36 118.566 118.566 123.440 -4.874 19707 8202 1 17 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.165 -0.132 19707 8203 1 17 . 1 1 36 36 VAL C C 36 169.876 169.876 173.882 -4.006 19707 8204 1 17 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.361 -1.796 19707 8205 1 17 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.791 -2.839 19707 8206 1 17 . 1 1 36 36 VAL H H 36 8.490 8.490 8.630 -0.140 19707 8207 1 17 . 1 1 37 37 ASP N N 37 121.640 121.640 126.502 -4.862 19707 8208 1 17 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.875 -0.073 19707 8209 1 17 . 1 1 37 37 ASP C C 37 172.806 172.806 176.544 -3.738 19707 8210 1 17 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.748 -3.705 19707 8211 1 17 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.372 -3.166 19707 8212 1 17 . 1 1 37 37 ASP H H 37 7.195 7.195 8.006 -0.811 19707 8213 1 17 . 1 1 38 38 GLU N N 38 120.018 120.018 121.152 -1.134 19707 8214 1 17 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.915 -0.258 19707 8215 1 17 . 1 1 38 38 GLU C C 38 174.753 174.753 177.282 -2.529 19707 8216 1 17 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.325 -2.833 19707 8217 1 17 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.679 -3.600 19707 8218 1 17 . 1 1 38 38 GLU H H 38 8.908 8.908 8.823 0.085 19707 8219 1 17 . 1 1 39 39 ASP N N 39 118.668 118.668 116.958 1.710 19707 8220 1 17 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.469 -0.223 19707 8221 1 17 . 1 1 39 39 ASP C C 39 175.393 175.393 177.891 -2.498 19707 8222 1 17 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.529 -1.665 19707 8223 1 17 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.310 -3.341 19707 8224 1 17 . 1 1 39 39 ASP H H 39 8.242 8.242 8.726 -0.484 19707 8225 1 17 . 1 1 40 40 PHE N N 40 119.851 119.851 119.596 0.255 19707 8226 1 17 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.422 -0.218 19707 8227 1 17 . 1 1 40 40 PHE C C 40 174.929 174.929 175.557 -0.628 19707 8228 1 17 . 1 1 40 40 PHE CA C 40 58.171 58.171 59.721 -1.550 19707 8229 1 17 . 1 1 40 40 PHE CB C 40 36.833 36.833 39.838 -3.005 19707 8230 1 17 . 1 1 40 40 PHE H H 40 8.037 8.037 7.855 0.182 19707 8231 1 17 . 1 1 41 41 LEU N N 41 117.882 117.882 116.882 1.000 19707 8232 1 17 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.239 -0.717 19707 8233 1 17 . 1 1 41 41 LEU C C 41 175.938 175.938 178.851 -2.913 19707 8234 1 17 . 1 1 41 41 LEU CA C 41 54.860 54.860 55.763 -0.903 19707 8235 1 17 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.715 -3.484 19707 8236 1 17 . 1 1 41 41 LEU H H 41 7.816 7.816 7.275 0.541 19707 8237 1 17 . 1 1 42 42 ARG N N 42 118.360 118.360 119.745 -1.385 19707 8238 1 17 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.013 -0.273 19707 8239 1 17 . 1 1 42 42 ARG C C 42 175.435 175.435 177.353 -1.918 19707 8240 1 17 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.005 -2.034 19707 8241 1 17 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.696 -2.432 19707 8242 1 17 . 1 1 42 42 ARG H H 42 8.540 8.540 8.041 0.499 19707 8243 1 17 . 1 1 43 43 GLU N N 43 114.947 114.947 117.208 -2.261 19707 8244 1 17 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.240 -0.190 19707 8245 1 17 . 1 1 43 43 GLU C C 43 174.518 174.518 177.602 -3.084 19707 8246 1 17 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.789 -3.218 19707 8247 1 17 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.244 -3.203 19707 8248 1 17 . 1 1 43 43 GLU H H 43 7.223 7.223 8.405 -1.182 19707 8249 1 17 . 1 1 44 44 GLN N N 44 114.109 114.109 117.279 -3.170 19707 8250 1 17 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.315 -0.209 19707 8251 1 17 . 1 1 44 44 GLN C C 44 173.777 173.777 177.634 -3.857 19707 8252 1 17 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.748 -3.567 19707 8253 1 17 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.298 -3.428 19707 8254 1 17 . 1 1 44 44 GLN H H 44 7.372 7.372 7.964 -0.592 19707 8255 1 17 . 1 1 45 45 ILE N N 45 117.470 117.470 116.712 0.758 19707 8256 1 17 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.793 0.155 19707 8257 1 17 . 1 1 45 45 ILE C C 45 172.305 172.305 177.215 -4.910 19707 8258 1 17 . 1 1 45 45 ILE CA C 45 58.505 58.505 64.058 -5.553 19707 8259 1 17 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.979 -2.279 19707 8260 1 17 . 1 1 45 45 ILE H H 45 7.235 7.235 7.289 -0.054 19707 8261 1 17 . 1 1 46 46 ARG N N 46 122.996 122.996 114.952 8.044 19707 8262 1 17 . 1 1 46 46 ARG HA H 46 4.190 4.190 4.041 0.149 19707 8263 1 17 . 1 1 46 46 ARG C C 46 172.992 172.992 175.215 -2.223 19707 8264 1 17 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.326 -4.565 19707 8265 1 17 . 1 1 46 46 ARG CB C 46 27.952 27.952 27.625 0.327 19707 8266 1 17 . 1 1 46 46 ARG H H 46 8.336 8.336 8.728 -0.392 19707 8267 1 17 . 1 1 47 47 ASP N N 47 118.676 118.676 116.525 2.151 19707 8268 1 17 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.707 -0.259 19707 8269 1 17 . 1 1 47 47 ASP C C 47 172.520 172.520 174.585 -2.065 19707 8270 1 17 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.742 -2.852 19707 8271 1 17 . 1 1 47 47 ASP CB C 47 37.657 37.657 43.533 -5.876 19707 8272 1 17 . 1 1 47 47 ASP H H 47 8.313 8.313 8.223 0.090 19707 8273 1 17 . 1 1 48 48 ALA N N 48 120.922 120.922 123.262 -2.340 19707 8274 1 17 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.562 -0.193 19707 8275 1 17 . 1 1 48 48 ALA C C 48 174.295 174.295 177.267 -2.972 19707 8276 1 17 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.127 -2.490 19707 8277 1 17 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.764 -3.550 19707 8278 1 17 . 1 1 48 48 ALA H H 48 7.824 7.824 7.327 0.497 19707 8279 1 17 . 1 1 49 49 ARG N N 49 118.644 118.644 120.858 -2.214 19707 8280 1 17 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.142 0.200 19707 8281 1 17 . 1 1 49 49 ARG C C 49 172.504 172.504 176.017 -3.513 19707 8282 1 17 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.072 -3.163 19707 8283 1 17 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.967 -2.624 19707 8284 1 17 . 1 1 49 49 ARG H H 49 7.911 7.911 8.158 -0.247 19707 8285 1 17 . 1 1 50 50 TYR N N 50 119.470 119.470 115.526 3.944 19707 8286 1 17 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.029 0.262 19707 8287 1 17 . 1 1 50 50 TYR C C 50 170.470 170.470 174.110 -3.640 19707 8288 1 17 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.068 -1.800 19707 8289 1 17 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.006 -0.493 19707 8290 1 17 . 1 1 50 50 TYR H H 50 7.639 7.639 8.002 -0.363 19707 8291 1 17 . 1 1 51 51 ALA N N 51 127.418 127.418 126.569 0.849 19707 8292 1 17 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.126 0.095 19707 8293 1 17 . 1 1 51 51 ALA C C 51 171.328 171.328 175.697 -4.369 19707 8294 1 17 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.494 -3.061 19707 8295 1 17 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.111 -0.799 19707 8296 1 17 . 1 1 51 51 ALA H H 51 8.222 8.222 8.758 -0.536 19707 8297 1 17 . 1 1 52 52 VAL N N 52 117.832 117.832 122.185 -4.353 19707 8298 1 17 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.235 -0.568 19707 8299 1 17 . 1 1 52 52 VAL C C 52 172.436 172.436 174.291 -1.855 19707 8300 1 17 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.657 -2.900 19707 8301 1 17 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.127 -4.024 19707 8302 1 17 . 1 1 52 52 VAL H H 52 8.753 8.753 9.137 -0.384 19707 8303 1 17 . 1 1 53 53 ILE N N 53 128.027 128.027 125.956 2.071 19707 8304 1 17 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.543 0.299 19707 8305 1 17 . 1 1 53 53 ILE C C 53 172.110 172.110 174.257 -2.147 19707 8306 1 17 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.256 -2.503 19707 8307 1 17 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.083 -3.924 19707 8308 1 17 . 1 1 53 53 ILE H H 53 9.261 9.261 9.006 0.255 19707 8309 1 17 . 1 1 54 54 ARG N N 54 127.885 127.885 127.554 0.331 19707 8310 1 17 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.705 0.048 19707 8311 1 17 . 1 1 54 54 ARG C C 54 172.285 172.285 174.377 -2.092 19707 8312 1 17 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.676 -1.417 19707 8313 1 17 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.395 -2.502 19707 8314 1 17 . 1 1 54 54 ARG H H 54 8.686 8.686 8.761 -0.076 19707 8315 1 17 . 1 1 55 55 ILE N N 55 129.907 129.907 124.084 5.823 19707 8316 1 17 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.390 -0.237 19707 8317 1 17 . 1 1 55 55 ILE CA C 55 55.595 55.595 57.992 -2.397 19707 8318 1 17 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.052 -1.439 19707 8319 1 17 . 1 1 55 55 ILE H H 55 9.292 9.292 8.313 0.979 19707 8320 1 17 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.322 -0.130 19707 8321 1 17 . 1 1 56 56 PRO C C 56 174.787 174.787 177.714 -2.927 19707 8322 1 17 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.131 -2.397 19707 8323 1 17 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.851 -2.938 19707 8324 1 17 . 1 1 57 57 GLY N N 57 111.828 111.828 111.446 0.382 19707 8325 1 17 . 1 1 57 57 GLY C C 57 171.039 171.039 173.528 -2.489 19707 8326 1 17 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.916 -2.099 19707 8327 1 17 . 1 1 57 57 GLY H H 57 8.708 8.708 8.888 -0.180 19707 8328 1 17 . 1 1 58 58 GLN N N 58 118.457 118.457 119.687 -1.230 19707 8329 1 17 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.854 0.046 19707 8330 1 17 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.017 -2.745 19707 8331 1 17 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.774 -2.620 19707 8332 1 17 . 1 1 58 58 GLN H H 58 7.909 7.909 7.584 0.325 19707 8333 1 17 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.437 -0.001 19707 8334 1 17 . 1 1 59 59 PRO C C 59 174.607 174.607 176.832 -2.225 19707 8335 1 17 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.763 -2.708 19707 8336 1 17 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.129 -2.952 19707 8337 1 17 . 1 1 60 60 VAL N N 60 122.695 122.695 120.607 2.088 19707 8338 1 17 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.077 -0.122 19707 8339 1 17 . 1 1 60 60 VAL C C 60 172.403 172.403 176.382 -3.979 19707 8340 1 17 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.661 -1.766 19707 8341 1 17 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.007 -2.365 19707 8342 1 17 . 1 1 60 60 VAL H H 60 8.364 8.364 8.067 0.297 19707 8343 1 17 . 1 1 61 61 VAL N N 61 126.097 126.097 127.829 -1.732 19707 8344 1 17 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.353 -0.053 19707 8345 1 17 . 1 1 61 61 VAL C C 61 170.891 170.891 174.528 -3.637 19707 8346 1 17 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.466 -2.652 19707 8347 1 17 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.424 -3.226 19707 8348 1 17 . 1 1 61 61 VAL H H 61 8.023 8.023 8.260 -0.237 19707 8349 1 17 . 1 1 62 62 GLU N N 62 126.097 126.097 125.140 0.957 19707 8350 1 17 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.069 0.090 19707 8351 1 17 . 1 1 62 62 GLU C C 62 172.252 172.252 175.590 -3.338 19707 8352 1 17 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.104 -3.564 19707 8353 1 17 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.782 -2.482 19707 8354 1 17 . 1 1 62 62 GLU H H 62 8.591 8.591 8.539 0.052 19707 8355 1 17 . 1 1 63 63 VAL N N 63 120.374 120.374 123.554 -3.180 19707 8356 1 17 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.151 0.242 19707 8357 1 17 . 1 1 63 63 VAL C C 63 171.040 171.040 176.651 -5.611 19707 8358 1 17 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.800 -3.966 19707 8359 1 17 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.954 -0.377 19707 8360 1 17 . 1 1 63 63 VAL H H 63 8.732 8.732 8.847 -0.115 19707 8361 1 17 . 1 1 64 64 GLY N N 64 109.935 109.935 112.073 -2.138 19707 8362 1 17 . 1 1 64 64 GLY C C 64 171.656 171.656 173.726 -2.070 19707 8363 1 17 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.212 -5.035 19707 8364 1 17 . 1 1 64 64 GLY H H 64 8.259 8.259 8.561 -0.302 19707 8365 1 17 . 1 1 65 65 THR N N 65 115.478 115.478 115.972 -0.494 19707 8366 1 17 . 1 1 65 65 THR HA H 65 4.342 4.342 4.377 -0.035 19707 8367 1 17 . 1 1 65 65 THR C C 65 170.663 170.663 172.615 -1.952 19707 8368 1 17 . 1 1 65 65 THR CA C 65 58.357 58.357 60.621 -2.264 19707 8369 1 17 . 1 1 65 65 THR CB C 65 67.923 67.923 70.350 -2.427 19707 8370 1 17 . 1 1 65 65 THR H H 65 8.123 8.123 7.937 0.186 19707 8371 1 17 . 1 1 66 66 LYS N N 66 130.775 130.775 123.805 6.970 19707 8372 1 17 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.245 -1.315 19707 8373 1 17 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.668 -2.478 19707 8374 1 17 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.946 -3.256 19707 8375 1 17 . 1 1 66 66 LYS H H 66 8.472 8.472 8.241 0.231 19707 8376 1 17 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.528 -0.117 19707 8377 1 17 . 1 1 67 67 PRO C C 67 173.211 173.211 177.045 -3.834 19707 8378 1 17 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.467 -2.901 19707 8379 1 17 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.647 -3.244 19707 8380 1 17 . 1 1 68 68 THR N N 68 111.983 111.983 114.496 -2.513 19707 8381 1 17 . 1 1 68 68 THR HA H 68 4.277 4.277 4.267 0.010 19707 8382 1 17 . 1 1 68 68 THR C C 68 171.720 171.720 175.630 -3.910 19707 8383 1 17 . 1 1 68 68 THR CA C 68 58.193 58.193 62.841 -4.648 19707 8384 1 17 . 1 1 68 68 THR CB C 68 67.723 67.723 69.316 -1.593 19707 8385 1 17 . 1 1 68 68 THR H H 68 8.091 8.091 8.077 0.014 19707 8386 1 17 . 1 1 69 69 GLY N N 69 109.918 109.918 108.567 1.351 19707 8387 1 17 . 1 1 69 69 GLY C C 69 170.783 170.783 173.972 -3.189 19707 8388 1 17 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.742 -2.686 19707 8389 1 17 . 1 1 69 69 GLY H H 69 8.119 8.119 7.993 0.126 19707 8390 1 17 . 1 1 70 70 ASP N N 70 123.294 123.294 123.840 -0.546 19707 8391 1 17 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.822 -0.273 19707 8392 1 17 . 1 1 70 70 ASP C C 70 173.651 173.651 174.998 -1.347 19707 8393 1 17 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.774 -2.913 19707 8394 1 17 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.337 -1.604 19707 8395 1 17 . 1 1 70 70 ASP H H 70 8.444 8.444 8.758 -0.314 19707 8396 1 17 . 1 1 71 71 VAL N N 71 117.772 117.772 114.232 3.540 19707 8397 1 17 . 1 1 71 71 VAL HA H 71 4.707 4.707 4.992 -0.285 19707 8398 1 17 . 1 1 71 71 VAL C C 71 172.992 172.992 173.796 -0.804 19707 8399 1 17 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.822 -2.446 19707 8400 1 17 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.663 -2.641 19707 8401 1 17 . 1 1 71 71 VAL H H 71 8.173 8.173 7.756 0.417 19707 8402 1 17 . 1 1 72 72 LEU N N 72 123.435 123.435 121.062 2.373 19707 8403 1 17 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.397 0.239 19707 8404 1 17 . 1 1 72 72 LEU C C 72 173.189 173.189 176.726 -3.537 19707 8405 1 17 . 1 1 72 72 LEU CA C 72 51.207 51.207 55.066 -3.859 19707 8406 1 17 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.632 -0.994 19707 8407 1 17 . 1 1 72 72 LEU H H 72 8.859 8.859 8.713 0.146 19707 8408 1 17 . 1 1 73 73 GLN N N 73 119.520 119.520 118.439 1.081 19707 8409 1 17 . 1 1 73 73 GLN HA H 73 5.345 5.345 4.927 0.418 19707 8410 1 17 . 1 1 73 73 GLN C C 73 172.249 172.249 175.284 -3.035 19707 8411 1 17 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.997 -3.664 19707 8412 1 17 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.407 -1.637 19707 8413 1 17 . 1 1 73 73 GLN H H 73 9.196 9.196 8.206 0.990 19707 8414 1 17 . 1 1 74 74 GLY N N 74 113.513 113.513 110.921 2.592 19707 8415 1 17 . 1 1 74 74 GLY C C 74 169.072 169.072 172.194 -3.122 19707 8416 1 17 . 1 1 74 74 GLY CA C 74 41.297 41.297 44.148 -2.851 19707 8417 1 17 . 1 1 74 74 GLY H H 74 9.373 9.373 8.922 0.451 19707 8418 1 17 . 1 1 75 75 ARG N N 75 122.479 122.479 122.505 -0.026 19707 8419 1 17 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.386 0.116 19707 8420 1 17 . 1 1 75 75 ARG C C 75 172.348 172.348 174.023 -1.675 19707 8421 1 17 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.717 -3.959 19707 8422 1 17 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.594 -2.776 19707 8423 1 17 . 1 1 75 75 ARG H H 75 8.615 8.615 8.239 0.376 19707 8424 1 17 . 1 1 76 76 ALA N N 76 122.346 122.346 125.775 -3.429 19707 8425 1 17 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.780 -0.244 19707 8426 1 17 . 1 1 76 76 ALA C C 76 172.704 172.704 174.467 -1.763 19707 8427 1 17 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.935 -2.908 19707 8428 1 17 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.898 -2.873 19707 8429 1 17 . 1 1 76 76 ALA H H 76 8.590 8.590 8.853 -0.263 19707 8430 1 17 . 1 1 77 77 THR N N 77 116.961 116.961 117.651 -0.690 19707 8431 1 17 . 1 1 77 77 THR HA H 77 4.988 4.988 5.085 -0.097 19707 8432 1 17 . 1 1 77 77 THR C C 77 172.800 172.800 174.776 -1.976 19707 8433 1 17 . 1 1 77 77 THR CA C 77 58.344 58.344 61.127 -2.783 19707 8434 1 17 . 1 1 77 77 THR CB C 77 67.712 67.712 70.093 -2.381 19707 8435 1 17 . 1 1 77 77 THR H H 77 8.491 8.491 8.330 0.161 19707 8436 1 17 . 1 1 78 78 GLY N N 78 111.103 111.103 113.101 -1.998 19707 8437 1 17 . 1 1 78 78 GLY C C 78 172.567 172.567 174.727 -2.160 19707 8438 1 17 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.680 -2.371 19707 8439 1 17 . 1 1 78 78 GLY H H 78 8.649 8.649 8.603 0.046 19707 8440 1 17 . 1 1 79 79 GLU N N 79 123.423 123.423 119.657 3.766 19707 8441 1 17 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.310 -0.314 19707 8442 1 17 . 1 1 79 79 GLU C C 79 175.466 175.466 177.060 -1.594 19707 8443 1 17 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.082 -2.623 19707 8444 1 17 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.653 -3.586 19707 8445 1 17 . 1 1 79 79 GLU H H 79 10.375 10.375 8.841 1.534 19707 8446 1 17 . 1 1 80 80 GLU N N 80 113.846 113.846 117.457 -3.611 19707 8447 1 17 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.431 -0.073 19707 8448 1 17 . 1 1 80 80 GLU C C 80 173.293 173.293 176.843 -3.550 19707 8449 1 17 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.938 -4.162 19707 8450 1 17 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.647 -4.916 19707 8451 1 17 . 1 1 80 80 GLU H H 80 7.679 7.679 8.530 -0.851 19707 8452 1 17 . 1 1 81 81 GLY N N 81 105.493 105.493 109.176 -3.683 19707 8453 1 17 . 1 1 81 81 GLY C C 81 170.427 170.427 174.185 -3.758 19707 8454 1 17 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.104 -2.492 19707 8455 1 17 . 1 1 81 81 GLY H H 81 7.476 7.476 7.706 -0.230 19707 8456 1 17 . 1 1 82 82 GLU N N 82 122.160 122.160 119.074 3.086 19707 8457 1 17 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.387 0.567 19707 8458 1 17 . 1 1 82 82 GLU C C 82 171.004 171.004 175.451 -4.447 19707 8459 1 17 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.536 -4.215 19707 8460 1 17 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.210 -5.144 19707 8461 1 17 . 1 1 82 82 GLU H H 82 9.585 9.585 8.009 1.576 19707 8462 1 17 . 1 1 83 83 THR N N 83 114.756 114.756 115.894 -1.138 19707 8463 1 17 . 1 1 83 83 THR HA H 83 4.990 4.990 5.163 -0.173 19707 8464 1 17 . 1 1 83 83 THR C C 83 170.909 170.909 173.124 -2.215 19707 8465 1 17 . 1 1 83 83 THR CA C 83 57.957 57.957 61.821 -3.864 19707 8466 1 17 . 1 1 83 83 THR CB C 83 68.271 68.271 71.403 -3.132 19707 8467 1 17 . 1 1 83 83 THR H H 83 8.490 8.490 8.520 -0.030 19707 8468 1 17 . 1 1 84 84 VAL N N 84 122.639 122.639 125.112 -2.473 19707 8469 1 17 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.886 -0.231 19707 8470 1 17 . 1 1 84 84 VAL C C 84 170.962 170.962 173.640 -2.678 19707 8471 1 17 . 1 1 84 84 VAL CA C 84 58.297 58.297 60.492 -2.195 19707 8472 1 17 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.832 -2.608 19707 8473 1 17 . 1 1 84 84 VAL H H 84 9.001 9.001 9.089 -0.088 19707 8474 1 17 . 1 1 85 85 LEU N N 85 129.903 129.903 126.870 3.033 19707 8475 1 17 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.292 0.100 19707 8476 1 17 . 1 1 85 85 LEU C C 85 172.346 172.346 174.500 -2.154 19707 8477 1 17 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.494 -2.697 19707 8478 1 17 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.797 -4.282 19707 8479 1 17 . 1 1 85 85 LEU H H 85 8.610 8.610 8.860 -0.250 19707 8480 1 17 . 1 1 86 86 VAL N N 86 122.778 122.778 124.438 -1.660 19707 8481 1 17 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.926 0.115 19707 8482 1 17 . 1 1 86 86 VAL C C 86 172.570 172.570 174.917 -2.347 19707 8483 1 17 . 1 1 86 86 VAL CA C 86 57.200 57.200 60.827 -3.627 19707 8484 1 17 . 1 1 86 86 VAL CB C 86 32.275 32.275 34.265 -1.990 19707 8485 1 17 . 1 1 86 86 VAL H H 86 9.228 9.228 9.136 0.092 19707 8486 1 17 . 1 1 87 87 GLU N N 87 120.437 120.437 126.295 -5.858 19707 8487 1 17 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.228 0.503 19707 8488 1 17 . 1 1 87 87 GLU C C 87 172.267 172.267 174.722 -2.455 19707 8489 1 17 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.601 -3.252 19707 8490 1 17 . 1 1 87 87 GLU CB C 87 31.124 31.124 34.148 -3.024 19707 8491 1 17 . 1 1 87 87 GLU H H 87 8.851 8.851 9.090 -0.239 19707 8492 1 17 . 1 1 88 88 GLU N N 88 118.525 118.525 119.690 -1.165 19707 8493 1 17 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.499 0.502 19707 8494 1 17 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.397 -3.480 19707 8495 1 17 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.351 -1.404 19707 8496 1 17 . 1 1 88 88 GLU H H 88 8.380 8.380 8.114 0.266 19707 8497 1 17 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.387 0.142 19707 8498 1 17 . 1 1 89 89 PRO C C 89 172.774 172.774 176.648 -3.874 19707 8499 1 17 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.026 -2.645 19707 8500 1 17 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.363 -3.029 19707 8501 1 18 . 1 1 2 2 SER N N 2 115.963 115.963 115.871 0.092 19707 8502 1 18 . 1 1 2 2 SER HA H 2 4.408 4.408 4.250 0.158 19707 8503 1 18 . 1 1 2 2 SER C C 2 171.788 171.788 173.319 -1.531 19707 8504 1 18 . 1 1 2 2 SER CA C 2 55.870 55.870 58.352 -2.482 19707 8505 1 18 . 1 1 2 2 SER CB C 2 61.022 61.022 63.278 -2.256 19707 8506 1 18 . 1 1 2 2 SER H H 2 8.661 8.661 8.222 0.439 19707 8507 1 18 . 1 1 3 3 GLU N N 3 122.941 122.941 120.450 2.491 19707 8508 1 18 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.390 -0.070 19707 8509 1 18 . 1 1 3 3 GLU C C 3 173.817 173.817 177.075 -3.258 19707 8510 1 18 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.561 -2.607 19707 8511 1 18 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.246 -3.409 19707 8512 1 18 . 1 1 3 3 GLU H H 3 8.706 8.706 8.024 0.682 19707 8513 1 18 . 1 1 4 4 THR N N 4 116.182 116.182 114.438 1.744 19707 8514 1 18 . 1 1 4 4 THR HA H 4 4.233 4.233 4.052 0.181 19707 8515 1 18 . 1 1 4 4 THR C C 4 171.719 171.719 173.882 -2.163 19707 8516 1 18 . 1 1 4 4 THR CA C 4 59.414 59.414 62.914 -3.500 19707 8517 1 18 . 1 1 4 4 THR CB C 4 67.009 67.009 67.708 -0.699 19707 8518 1 18 . 1 1 4 4 THR H H 4 8.165 8.165 8.399 -0.234 19707 8519 1 18 . 1 1 5 5 ARG N N 5 124.184 124.184 121.351 2.833 19707 8520 1 18 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.716 -0.356 19707 8521 1 18 . 1 1 5 5 ARG C C 5 173.520 173.520 175.420 -1.900 19707 8522 1 18 . 1 1 5 5 ARG CA C 5 53.343 53.343 54.776 -1.433 19707 8523 1 18 . 1 1 5 5 ARG CB C 5 28.165 28.165 32.883 -4.718 19707 8524 1 18 . 1 1 5 5 ARG H H 5 8.354 8.354 8.202 0.152 19707 8525 1 18 . 1 1 6 6 THR N N 6 116.652 116.652 118.181 -1.529 19707 8526 1 18 . 1 1 6 6 THR HA H 6 4.263 4.263 4.646 -0.383 19707 8527 1 18 . 1 1 6 6 THR C C 6 171.784 171.784 173.888 -2.104 19707 8528 1 18 . 1 1 6 6 THR CA C 6 59.218 59.218 61.851 -2.633 19707 8529 1 18 . 1 1 6 6 THR CB C 6 67.213 67.213 69.936 -2.723 19707 8530 1 18 . 1 1 6 6 THR H H 6 8.224 8.224 8.315 -0.091 19707 8531 1 18 . 1 1 7 7 ILE N N 7 123.882 123.882 123.607 0.275 19707 8532 1 18 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.383 -0.245 19707 8533 1 18 . 1 1 7 7 ILE C C 7 173.572 173.572 176.303 -2.731 19707 8534 1 18 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.381 -1.899 19707 8535 1 18 . 1 1 7 7 ILE CB C 7 36.069 36.069 39.778 -3.709 19707 8536 1 18 . 1 1 7 7 ILE H H 7 8.247 8.247 8.394 -0.147 19707 8537 1 18 . 1 1 8 8 SER N N 8 120.287 120.287 120.932 -0.645 19707 8538 1 18 . 1 1 8 8 SER HA H 8 4.445 4.445 4.319 0.126 19707 8539 1 18 . 1 1 8 8 SER C C 8 171.926 171.926 174.106 -2.180 19707 8540 1 18 . 1 1 8 8 SER CA C 8 55.522 55.522 58.968 -3.446 19707 8541 1 18 . 1 1 8 8 SER CB C 8 61.073 61.073 63.931 -2.858 19707 8542 1 18 . 1 1 8 8 SER H H 8 8.402 8.402 8.430 -0.028 19707 8543 1 18 . 1 1 9 9 SER N N 9 118.425 118.425 119.743 -1.318 19707 8544 1 18 . 1 1 9 9 SER HA H 9 4.525 4.525 4.690 -0.165 19707 8545 1 18 . 1 1 9 9 SER C C 9 172.663 172.663 173.781 -1.118 19707 8546 1 18 . 1 1 9 9 SER CA C 9 55.897 55.897 58.148 -2.251 19707 8547 1 18 . 1 1 9 9 SER CB C 9 61.375 61.375 63.842 -2.467 19707 8548 1 18 . 1 1 9 9 SER H H 9 8.362 8.362 8.667 -0.305 19707 8549 1 18 . 1 1 10 10 THR N N 10 115.676 115.676 113.730 1.946 19707 8550 1 18 . 1 1 10 10 THR HA H 10 4.232 4.232 4.567 -0.335 19707 8551 1 18 . 1 1 10 10 THR C C 10 173.070 173.070 175.280 -2.210 19707 8552 1 18 . 1 1 10 10 THR CA C 10 60.318 60.318 63.270 -2.952 19707 8553 1 18 . 1 1 10 10 THR CB C 10 67.205 67.205 69.082 -1.877 19707 8554 1 18 . 1 1 10 10 THR H H 10 8.274 8.274 7.944 0.330 19707 8555 1 18 . 1 1 11 11 ALA N N 11 124.726 124.726 123.745 0.981 19707 8556 1 18 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.154 -0.167 19707 8557 1 18 . 1 1 11 11 ALA C C 11 176.825 176.825 179.191 -2.366 19707 8558 1 18 . 1 1 11 11 ALA CA C 11 52.541 52.541 54.915 -2.374 19707 8559 1 18 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.404 -2.515 19707 8560 1 18 . 1 1 11 11 ALA H H 11 8.347 8.347 8.038 0.309 19707 8561 1 18 . 1 1 12 12 GLN N N 12 117.915 117.915 117.037 0.878 19707 8562 1 18 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.206 -0.417 19707 8563 1 18 . 1 1 12 12 GLN C C 12 174.697 174.697 177.234 -2.537 19707 8564 1 18 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.606 -2.602 19707 8565 1 18 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.803 -2.578 19707 8566 1 18 . 1 1 12 12 GLN H H 12 8.194 8.194 7.741 0.453 19707 8567 1 18 . 1 1 13 13 GLU N N 13 118.510 118.510 120.206 -1.696 19707 8568 1 18 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.123 -0.020 19707 8569 1 18 . 1 1 13 13 GLU C C 13 176.192 176.192 178.980 -2.788 19707 8570 1 18 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.867 -2.552 19707 8571 1 18 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.636 -3.603 19707 8572 1 18 . 1 1 13 13 GLU H H 13 7.917 7.917 8.273 -0.356 19707 8573 1 18 . 1 1 14 14 ARG N N 14 118.193 118.193 119.763 -1.570 19707 8574 1 18 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.087 -0.119 19707 8575 1 18 . 1 1 14 14 ARG C C 14 176.764 176.764 178.530 -1.766 19707 8576 1 18 . 1 1 14 14 ARG CA C 14 57.283 57.283 58.850 -1.567 19707 8577 1 18 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.334 -2.097 19707 8578 1 18 . 1 1 14 14 ARG H H 14 7.907 7.907 8.420 -0.513 19707 8579 1 18 . 1 1 15 15 VAL N N 15 117.991 117.991 115.070 2.921 19707 8580 1 18 . 1 1 15 15 VAL HA H 15 3.903 3.903 4.008 -0.105 19707 8581 1 18 . 1 1 15 15 VAL C C 15 174.922 174.922 177.572 -2.650 19707 8582 1 18 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.777 -1.946 19707 8583 1 18 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.370 -2.647 19707 8584 1 18 . 1 1 15 15 VAL H H 15 7.658 7.658 7.472 0.186 19707 8585 1 18 . 1 1 16 16 ASP N N 16 124.314 124.314 120.845 3.469 19707 8586 1 18 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.397 -0.081 19707 8587 1 18 . 1 1 16 16 ASP C C 16 176.462 176.462 177.851 -1.389 19707 8588 1 18 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.439 -2.113 19707 8589 1 18 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.249 -4.580 19707 8590 1 18 . 1 1 16 16 ASP H H 16 8.291 8.291 8.133 0.158 19707 8591 1 18 . 1 1 17 17 LEU N N 17 120.212 120.212 119.221 0.991 19707 8592 1 18 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.149 -0.095 19707 8593 1 18 . 1 1 17 17 LEU C C 17 177.171 177.171 179.102 -1.931 19707 8594 1 18 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.619 -2.639 19707 8595 1 18 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.230 -2.385 19707 8596 1 18 . 1 1 17 17 LEU H H 17 8.172 8.172 7.721 0.451 19707 8597 1 18 . 1 1 18 18 GLU N N 18 120.587 120.587 119.468 1.119 19707 8598 1 18 . 1 1 18 18 GLU HA H 18 4.193 4.193 4.007 0.186 19707 8599 1 18 . 1 1 18 18 GLU C C 18 175.997 175.997 178.646 -2.649 19707 8600 1 18 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.367 -3.265 19707 8601 1 18 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.834 -2.763 19707 8602 1 18 . 1 1 18 18 GLU H H 18 7.876 7.876 7.819 0.057 19707 8603 1 18 . 1 1 19 19 ALA N N 19 121.800 121.800 123.019 -1.219 19707 8604 1 18 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.152 -0.361 19707 8605 1 18 . 1 1 19 19 ALA C C 19 175.708 175.708 179.800 -4.092 19707 8606 1 18 . 1 1 19 19 ALA CA C 19 52.852 52.852 55.015 -2.163 19707 8607 1 18 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.352 -4.198 19707 8608 1 18 . 1 1 19 19 ALA H H 19 7.792 7.792 7.532 0.260 19707 8609 1 18 . 1 1 20 20 VAL N N 20 118.680 118.680 119.298 -0.618 19707 8610 1 18 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.723 -0.423 19707 8611 1 18 . 1 1 20 20 VAL C C 20 176.276 176.276 178.096 -1.820 19707 8612 1 18 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.247 -2.440 19707 8613 1 18 . 1 1 20 20 VAL CB C 20 29.551 29.551 30.957 -1.406 19707 8614 1 18 . 1 1 20 20 VAL H H 20 7.712 7.712 7.984 -0.272 19707 8615 1 18 . 1 1 21 21 ARG N N 21 121.935 121.935 121.097 0.838 19707 8616 1 18 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.081 -0.086 19707 8617 1 18 . 1 1 21 21 ARG C C 21 176.828 176.828 178.753 -1.925 19707 8618 1 18 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.576 -1.916 19707 8619 1 18 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.561 -2.271 19707 8620 1 18 . 1 1 21 21 ARG H H 21 8.444 8.444 8.328 0.116 19707 8621 1 18 . 1 1 22 22 LEU N N 22 119.327 119.327 119.527 -0.200 19707 8622 1 18 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.102 -0.107 19707 8623 1 18 . 1 1 22 22 LEU C C 22 175.664 175.664 178.608 -2.944 19707 8624 1 18 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.144 -3.276 19707 8625 1 18 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.562 -2.427 19707 8626 1 18 . 1 1 22 22 LEU H H 22 8.248 8.248 8.187 0.061 19707 8627 1 18 . 1 1 23 23 ALA N N 23 121.202 121.202 122.225 -1.023 19707 8628 1 18 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.953 -0.218 19707 8629 1 18 . 1 1 23 23 ALA C C 23 175.492 175.492 179.630 -4.138 19707 8630 1 18 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.335 -2.266 19707 8631 1 18 . 1 1 23 23 ALA CB C 23 14.067 14.067 18.025 -3.958 19707 8632 1 18 . 1 1 23 23 ALA H H 23 8.392 8.392 8.582 -0.190 19707 8633 1 18 . 1 1 24 24 SER N N 24 112.377 112.377 114.939 -2.562 19707 8634 1 18 . 1 1 24 24 SER HA H 24 4.214 4.214 4.274 -0.060 19707 8635 1 18 . 1 1 24 24 SER C C 24 174.773 174.773 176.334 -1.561 19707 8636 1 18 . 1 1 24 24 SER CA C 24 59.258 59.258 62.562 -3.304 19707 8637 1 18 . 1 1 24 24 SER CB C 24 60.149 60.149 63.102 -2.953 19707 8638 1 18 . 1 1 24 24 SER H H 24 7.690 7.690 8.002 -0.312 19707 8639 1 18 . 1 1 25 25 ILE N N 25 123.886 123.886 122.619 1.267 19707 8640 1 18 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.971 -0.129 19707 8641 1 18 . 1 1 25 25 ILE C C 25 176.487 176.487 177.920 -1.433 19707 8642 1 18 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.917 -0.924 19707 8643 1 18 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.342 -0.410 19707 8644 1 18 . 1 1 25 25 ILE H H 25 7.837 7.837 8.169 -0.332 19707 8645 1 18 . 1 1 26 26 VAL N N 26 122.538 122.538 121.125 1.413 19707 8646 1 18 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.684 -0.296 19707 8647 1 18 . 1 1 26 26 VAL C C 26 174.624 174.624 178.025 -3.401 19707 8648 1 18 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.121 -2.206 19707 8649 1 18 . 1 1 26 26 VAL CB C 26 27.895 27.895 30.783 -2.888 19707 8650 1 18 . 1 1 26 26 VAL H H 26 8.804 8.804 8.667 0.137 19707 8651 1 18 . 1 1 27 27 ASP N N 27 120.433 120.433 120.662 -0.229 19707 8652 1 18 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.324 -0.160 19707 8653 1 18 . 1 1 27 27 ASP C C 27 174.966 174.966 178.475 -3.509 19707 8654 1 18 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.587 -2.258 19707 8655 1 18 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.724 -2.869 19707 8656 1 18 . 1 1 27 27 ASP H H 27 8.719 8.719 8.568 0.151 19707 8657 1 18 . 1 1 28 28 SER N N 28 112.397 112.397 115.743 -3.346 19707 8658 1 18 . 1 1 28 28 SER HA H 28 4.073 4.073 4.181 -0.108 19707 8659 1 18 . 1 1 28 28 SER C C 28 174.405 174.405 176.749 -2.344 19707 8660 1 18 . 1 1 28 28 SER CA C 28 59.115 59.115 62.020 -2.905 19707 8661 1 18 . 1 1 28 28 SER CB C 28 60.125 60.125 63.101 -2.976 19707 8662 1 18 . 1 1 28 28 SER H H 28 7.599 7.599 8.242 -0.643 19707 8663 1 18 . 1 1 29 29 ARG N N 29 123.945 123.945 122.428 1.517 19707 8664 1 18 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.987 0.040 19707 8665 1 18 . 1 1 29 29 ARG C C 29 175.902 175.902 178.110 -2.208 19707 8666 1 18 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.871 -3.597 19707 8667 1 18 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.234 -1.494 19707 8668 1 18 . 1 1 29 29 ARG H H 29 7.769 7.769 7.746 0.023 19707 8669 1 18 . 1 1 30 30 LEU N N 30 121.580 121.580 119.986 1.594 19707 8670 1 18 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.937 -0.188 19707 8671 1 18 . 1 1 30 30 LEU C C 30 177.474 177.474 179.125 -1.651 19707 8672 1 18 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.849 -2.536 19707 8673 1 18 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.757 -2.728 19707 8674 1 18 . 1 1 30 30 LEU H H 30 8.665 8.665 8.298 0.367 19707 8675 1 18 . 1 1 31 31 ILE N N 31 119.330 119.330 117.529 1.801 19707 8676 1 18 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.756 -0.065 19707 8677 1 18 . 1 1 31 31 ILE C C 31 175.341 175.341 177.839 -2.498 19707 8678 1 18 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.046 -2.534 19707 8679 1 18 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.921 -2.354 19707 8680 1 18 . 1 1 31 31 ILE H H 31 8.226 8.226 8.460 -0.234 19707 8681 1 18 . 1 1 32 32 GLY N N 32 106.092 106.092 106.171 -0.079 19707 8682 1 18 . 1 1 32 32 GLY C C 32 172.413 172.413 175.038 -2.625 19707 8683 1 18 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.775 -3.278 19707 8684 1 18 . 1 1 32 32 GLY H H 32 7.767 7.767 7.825 -0.058 19707 8685 1 18 . 1 1 33 33 THR N N 33 110.966 110.966 112.743 -1.777 19707 8686 1 18 . 1 1 33 33 THR HA H 33 4.455 4.455 4.340 0.115 19707 8687 1 18 . 1 1 33 33 THR C C 33 172.714 172.714 174.735 -2.021 19707 8688 1 18 . 1 1 33 33 THR CA C 33 60.032 60.032 62.628 -2.596 19707 8689 1 18 . 1 1 33 33 THR CB C 33 68.287 68.287 70.081 -1.794 19707 8690 1 18 . 1 1 33 33 THR H H 33 8.102 8.102 7.788 0.314 19707 8691 1 18 . 1 1 34 34 GLY N N 34 110.320 110.320 110.592 -0.272 19707 8692 1 18 . 1 1 34 34 GLY C C 34 170.505 170.505 173.636 -3.131 19707 8693 1 18 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.159 -2.576 19707 8694 1 18 . 1 1 34 34 GLY H H 34 8.072 8.072 8.182 -0.110 19707 8695 1 18 . 1 1 35 35 SER N N 35 112.944 112.944 113.280 -0.336 19707 8696 1 18 . 1 1 35 35 SER HA H 35 4.385 4.385 4.594 -0.209 19707 8697 1 18 . 1 1 35 35 SER C C 35 169.537 169.537 172.621 -3.084 19707 8698 1 18 . 1 1 35 35 SER CA C 35 54.794 54.794 57.553 -2.760 19707 8699 1 18 . 1 1 35 35 SER CB C 35 62.029 62.029 65.550 -3.521 19707 8700 1 18 . 1 1 35 35 SER H H 35 7.719 7.719 7.603 0.116 19707 8701 1 18 . 1 1 36 36 VAL N N 36 118.566 118.566 121.321 -2.755 19707 8702 1 18 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.337 -0.304 19707 8703 1 18 . 1 1 36 36 VAL C C 36 169.876 169.876 174.366 -4.490 19707 8704 1 18 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.368 -1.803 19707 8705 1 18 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.302 -2.350 19707 8706 1 18 . 1 1 36 36 VAL H H 36 8.490 8.490 8.393 0.097 19707 8707 1 18 . 1 1 37 37 ASP N N 37 121.640 121.640 127.078 -5.438 19707 8708 1 18 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.786 0.016 19707 8709 1 18 . 1 1 37 37 ASP C C 37 172.806 172.806 175.744 -2.938 19707 8710 1 18 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.846 -3.803 19707 8711 1 18 . 1 1 37 37 ASP CB C 37 40.206 40.206 42.939 -2.733 19707 8712 1 18 . 1 1 37 37 ASP H H 37 7.195 7.195 8.275 -1.080 19707 8713 1 18 . 1 1 38 38 GLU N N 38 120.018 120.018 121.141 -1.123 19707 8714 1 18 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.980 -0.323 19707 8715 1 18 . 1 1 38 38 GLU C C 38 174.753 174.753 177.632 -2.879 19707 8716 1 18 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.054 -2.562 19707 8717 1 18 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.808 -3.728 19707 8718 1 18 . 1 1 38 38 GLU H H 38 8.908 8.908 8.778 0.130 19707 8719 1 18 . 1 1 39 39 ASP N N 39 118.668 118.668 116.963 1.705 19707 8720 1 18 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.461 -0.215 19707 8721 1 18 . 1 1 39 39 ASP C C 39 175.393 175.393 177.882 -2.489 19707 8722 1 18 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.469 -1.605 19707 8723 1 18 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.346 -3.376 19707 8724 1 18 . 1 1 39 39 ASP H H 39 8.242 8.242 8.689 -0.447 19707 8725 1 18 . 1 1 40 40 PHE N N 40 119.851 119.851 118.899 0.952 19707 8726 1 18 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.525 -0.321 19707 8727 1 18 . 1 1 40 40 PHE C C 40 174.929 174.929 175.319 -0.390 19707 8728 1 18 . 1 1 40 40 PHE CA C 40 58.171 58.171 59.200 -1.029 19707 8729 1 18 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.124 -3.291 19707 8730 1 18 . 1 1 40 40 PHE H H 40 8.037 8.037 8.010 0.027 19707 8731 1 18 . 1 1 41 41 LEU N N 41 117.882 117.882 119.342 -1.460 19707 8732 1 18 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.315 -0.793 19707 8733 1 18 . 1 1 41 41 LEU C C 41 175.938 175.938 178.263 -2.325 19707 8734 1 18 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.201 -1.341 19707 8735 1 18 . 1 1 41 41 LEU CB C 41 39.231 39.231 43.325 -4.094 19707 8736 1 18 . 1 1 41 41 LEU H H 41 7.816 7.816 7.887 -0.071 19707 8737 1 18 . 1 1 42 42 ARG N N 42 118.360 118.360 119.999 -1.639 19707 8738 1 18 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.058 -0.318 19707 8739 1 18 . 1 1 42 42 ARG C C 42 175.435 175.435 177.059 -1.624 19707 8740 1 18 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.129 -2.158 19707 8741 1 18 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.981 -2.717 19707 8742 1 18 . 1 1 42 42 ARG H H 42 8.540 8.540 8.304 0.236 19707 8743 1 18 . 1 1 43 43 GLU N N 43 114.947 114.947 116.627 -1.680 19707 8744 1 18 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.317 -0.267 19707 8745 1 18 . 1 1 43 43 GLU C C 43 174.518 174.518 177.415 -2.897 19707 8746 1 18 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.026 -2.455 19707 8747 1 18 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.076 -3.035 19707 8748 1 18 . 1 1 43 43 GLU H H 43 7.223 7.223 8.345 -1.122 19707 8749 1 18 . 1 1 44 44 GLN N N 44 114.109 114.109 116.979 -2.870 19707 8750 1 18 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.337 -0.231 19707 8751 1 18 . 1 1 44 44 GLN C C 44 173.777 173.777 177.397 -3.620 19707 8752 1 18 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.608 -3.427 19707 8753 1 18 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.843 -3.973 19707 8754 1 18 . 1 1 44 44 GLN H H 44 7.372 7.372 8.123 -0.751 19707 8755 1 18 . 1 1 45 45 ILE N N 45 117.470 117.470 116.219 1.251 19707 8756 1 18 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.863 0.085 19707 8757 1 18 . 1 1 45 45 ILE C C 45 172.305 172.305 177.124 -4.819 19707 8758 1 18 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.716 -5.211 19707 8759 1 18 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.815 -2.115 19707 8760 1 18 . 1 1 45 45 ILE H H 45 7.235 7.235 7.559 -0.324 19707 8761 1 18 . 1 1 46 46 ARG N N 46 122.996 122.996 115.417 7.579 19707 8762 1 18 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.997 0.193 19707 8763 1 18 . 1 1 46 46 ARG C C 46 172.992 172.992 175.497 -2.505 19707 8764 1 18 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.009 -4.248 19707 8765 1 18 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.686 -0.734 19707 8766 1 18 . 1 1 46 46 ARG H H 46 8.336 8.336 8.669 -0.334 19707 8767 1 18 . 1 1 47 47 ASP N N 47 118.676 118.676 116.534 2.142 19707 8768 1 18 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.681 -0.233 19707 8769 1 18 . 1 1 47 47 ASP C C 47 172.520 172.520 175.005 -2.485 19707 8770 1 18 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.136 -2.246 19707 8771 1 18 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.677 -5.020 19707 8772 1 18 . 1 1 47 47 ASP H H 47 8.313 8.313 8.042 0.271 19707 8773 1 18 . 1 1 48 48 ALA N N 48 120.922 120.922 122.005 -1.083 19707 8774 1 18 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.494 -0.125 19707 8775 1 18 . 1 1 48 48 ALA C C 48 174.295 174.295 177.197 -2.902 19707 8776 1 18 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.770 -2.132 19707 8777 1 18 . 1 1 48 48 ALA CB C 48 16.214 16.214 20.047 -3.833 19707 8778 1 18 . 1 1 48 48 ALA H H 48 7.824 7.824 7.417 0.407 19707 8779 1 18 . 1 1 49 49 ARG N N 49 118.644 118.644 120.138 -1.494 19707 8780 1 18 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.030 0.312 19707 8781 1 18 . 1 1 49 49 ARG C C 49 172.504 172.504 176.249 -3.745 19707 8782 1 18 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.850 -3.941 19707 8783 1 18 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.683 -2.341 19707 8784 1 18 . 1 1 49 49 ARG H H 49 7.911 7.911 8.428 -0.517 19707 8785 1 18 . 1 1 50 50 TYR N N 50 119.470 119.470 113.279 6.191 19707 8786 1 18 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.044 0.247 19707 8787 1 18 . 1 1 50 50 TYR C C 50 170.470 170.470 174.033 -3.563 19707 8788 1 18 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.366 -2.098 19707 8789 1 18 . 1 1 50 50 TYR CB C 50 39.513 39.513 41.244 -1.731 19707 8790 1 18 . 1 1 50 50 TYR H H 50 7.639 7.639 7.953 -0.314 19707 8791 1 18 . 1 1 51 51 ALA N N 51 127.418 127.418 123.023 4.395 19707 8792 1 18 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.212 0.009 19707 8793 1 18 . 1 1 51 51 ALA C C 51 171.328 171.328 175.139 -3.811 19707 8794 1 18 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.103 -2.670 19707 8795 1 18 . 1 1 51 51 ALA CB C 51 20.312 20.312 22.453 -2.140 19707 8796 1 18 . 1 1 51 51 ALA H H 51 8.222 8.222 8.492 -0.270 19707 8797 1 18 . 1 1 52 52 VAL N N 52 117.832 117.832 120.582 -2.750 19707 8798 1 18 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.083 -0.416 19707 8799 1 18 . 1 1 52 52 VAL C C 52 172.436 172.436 174.247 -1.811 19707 8800 1 18 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.358 -3.601 19707 8801 1 18 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.572 -4.469 19707 8802 1 18 . 1 1 52 52 VAL H H 52 8.753 8.753 8.963 -0.210 19707 8803 1 18 . 1 1 53 53 ILE N N 53 128.027 128.027 125.606 2.421 19707 8804 1 18 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.555 0.287 19707 8805 1 18 . 1 1 53 53 ILE C C 53 172.110 172.110 174.059 -1.949 19707 8806 1 18 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.285 -2.532 19707 8807 1 18 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.964 -3.805 19707 8808 1 18 . 1 1 53 53 ILE H H 53 9.261 9.261 8.776 0.485 19707 8809 1 18 . 1 1 54 54 ARG N N 54 127.885 127.885 128.325 -0.440 19707 8810 1 18 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.668 0.085 19707 8811 1 18 . 1 1 54 54 ARG C C 54 172.285 172.285 173.975 -1.690 19707 8812 1 18 . 1 1 54 54 ARG CA C 54 52.260 52.260 54.334 -2.074 19707 8813 1 18 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.956 -3.064 19707 8814 1 18 . 1 1 54 54 ARG H H 54 8.686 8.686 8.531 0.155 19707 8815 1 18 . 1 1 55 55 ILE N N 55 129.907 129.907 124.843 5.064 19707 8816 1 18 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.363 -0.210 19707 8817 1 18 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.103 -2.508 19707 8818 1 18 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.028 -1.415 19707 8819 1 18 . 1 1 55 55 ILE H H 55 9.292 9.292 8.232 1.060 19707 8820 1 18 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.302 -0.110 19707 8821 1 18 . 1 1 56 56 PRO C C 56 174.787 174.787 177.692 -2.905 19707 8822 1 18 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.207 -2.473 19707 8823 1 18 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.877 -2.963 19707 8824 1 18 . 1 1 57 57 GLY N N 57 111.828 111.828 111.317 0.511 19707 8825 1 18 . 1 1 57 57 GLY C C 57 171.039 171.039 173.572 -2.533 19707 8826 1 18 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.941 -2.124 19707 8827 1 18 . 1 1 57 57 GLY H H 57 8.708 8.708 8.893 -0.185 19707 8828 1 18 . 1 1 58 58 GLN N N 58 118.457 118.457 119.993 -1.536 19707 8829 1 18 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.821 0.079 19707 8830 1 18 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.065 -2.793 19707 8831 1 18 . 1 1 58 58 GLN CB C 58 27.154 27.154 30.288 -3.134 19707 8832 1 18 . 1 1 58 58 GLN H H 58 7.909 7.909 7.574 0.335 19707 8833 1 18 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.483 -0.047 19707 8834 1 18 . 1 1 59 59 PRO C C 59 174.607 174.607 176.386 -1.779 19707 8835 1 18 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.776 -2.721 19707 8836 1 18 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.282 -3.105 19707 8837 1 18 . 1 1 60 60 VAL N N 60 122.695 122.695 120.785 1.910 19707 8838 1 18 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.168 -0.213 19707 8839 1 18 . 1 1 60 60 VAL C C 60 172.403 172.403 175.124 -2.721 19707 8840 1 18 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.631 -1.736 19707 8841 1 18 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.492 -2.850 19707 8842 1 18 . 1 1 60 60 VAL H H 60 8.364 8.364 8.237 0.127 19707 8843 1 18 . 1 1 61 61 VAL N N 61 126.097 126.097 127.289 -1.192 19707 8844 1 18 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.526 -0.226 19707 8845 1 18 . 1 1 61 61 VAL C C 61 170.891 170.891 174.039 -3.148 19707 8846 1 18 . 1 1 61 61 VAL CA C 61 58.814 58.814 60.231 -1.417 19707 8847 1 18 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.714 -3.516 19707 8848 1 18 . 1 1 61 61 VAL H H 61 8.023 8.023 8.331 -0.308 19707 8849 1 18 . 1 1 62 62 GLU N N 62 126.097 126.097 126.680 -0.583 19707 8850 1 18 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.018 0.141 19707 8851 1 18 . 1 1 62 62 GLU C C 62 172.252 172.252 175.356 -3.104 19707 8852 1 18 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.172 -3.632 19707 8853 1 18 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.529 -2.229 19707 8854 1 18 . 1 1 62 62 GLU H H 62 8.591 8.591 8.566 0.025 19707 8855 1 18 . 1 1 63 63 VAL N N 63 120.374 120.374 123.564 -3.190 19707 8856 1 18 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.548 -0.155 19707 8857 1 18 . 1 1 63 63 VAL C C 63 171.040 171.040 176.284 -5.244 19707 8858 1 18 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.180 -3.347 19707 8859 1 18 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.955 -0.378 19707 8860 1 18 . 1 1 63 63 VAL H H 63 8.732 8.732 8.849 -0.117 19707 8861 1 18 . 1 1 64 64 GLY N N 64 109.935 109.935 114.733 -4.798 19707 8862 1 18 . 1 1 64 64 GLY C C 64 171.656 171.656 174.033 -2.377 19707 8863 1 18 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.048 -4.871 19707 8864 1 18 . 1 1 64 64 GLY H H 64 8.259 8.259 8.469 -0.210 19707 8865 1 18 . 1 1 65 65 THR N N 65 115.478 115.478 115.410 0.068 19707 8866 1 18 . 1 1 65 65 THR HA H 65 4.342 4.342 4.317 0.025 19707 8867 1 18 . 1 1 65 65 THR C C 65 170.663 170.663 172.439 -1.776 19707 8868 1 18 . 1 1 65 65 THR CA C 65 58.357 58.357 59.944 -1.587 19707 8869 1 18 . 1 1 65 65 THR CB C 65 67.923 67.923 71.540 -3.617 19707 8870 1 18 . 1 1 65 65 THR H H 65 8.123 8.123 7.704 0.419 19707 8871 1 18 . 1 1 66 66 LYS N N 66 130.775 130.775 123.573 7.202 19707 8872 1 18 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.224 -1.294 19707 8873 1 18 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.819 -2.629 19707 8874 1 18 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.876 -3.186 19707 8875 1 18 . 1 1 66 66 LYS H H 66 8.472 8.472 8.190 0.282 19707 8876 1 18 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.562 -0.151 19707 8877 1 18 . 1 1 67 67 PRO C C 67 173.211 173.211 176.753 -3.542 19707 8878 1 18 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.212 -2.646 19707 8879 1 18 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.459 -3.056 19707 8880 1 18 . 1 1 68 68 THR N N 68 111.983 111.983 114.121 -2.138 19707 8881 1 18 . 1 1 68 68 THR HA H 68 4.277 4.277 4.271 0.006 19707 8882 1 18 . 1 1 68 68 THR C C 68 171.720 171.720 175.615 -3.895 19707 8883 1 18 . 1 1 68 68 THR CA C 68 58.193 58.193 63.067 -4.874 19707 8884 1 18 . 1 1 68 68 THR CB C 68 67.723 67.723 69.199 -1.476 19707 8885 1 18 . 1 1 68 68 THR H H 68 8.091 8.091 8.234 -0.143 19707 8886 1 18 . 1 1 69 69 GLY N N 69 109.918 109.918 108.769 1.149 19707 8887 1 18 . 1 1 69 69 GLY C C 69 170.783 170.783 174.555 -3.772 19707 8888 1 18 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.771 -2.715 19707 8889 1 18 . 1 1 69 69 GLY H H 69 8.119 8.119 8.095 0.024 19707 8890 1 18 . 1 1 70 70 ASP N N 70 123.294 123.294 124.020 -0.726 19707 8891 1 18 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.796 -0.247 19707 8892 1 18 . 1 1 70 70 ASP C C 70 173.651 173.651 175.085 -1.434 19707 8893 1 18 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.686 -2.825 19707 8894 1 18 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.305 -1.572 19707 8895 1 18 . 1 1 70 70 ASP H H 70 8.444 8.444 8.703 -0.259 19707 8896 1 18 . 1 1 71 71 VAL N N 71 117.772 117.772 114.031 3.741 19707 8897 1 18 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.025 -0.318 19707 8898 1 18 . 1 1 71 71 VAL C C 71 172.992 172.992 174.389 -1.397 19707 8899 1 18 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.722 -2.346 19707 8900 1 18 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.760 -2.738 19707 8901 1 18 . 1 1 71 71 VAL H H 71 8.173 8.173 7.696 0.477 19707 8902 1 18 . 1 1 72 72 LEU N N 72 123.435 123.435 123.449 -0.014 19707 8903 1 18 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.546 0.090 19707 8904 1 18 . 1 1 72 72 LEU C C 72 173.189 173.189 176.234 -3.045 19707 8905 1 18 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.441 -3.234 19707 8906 1 18 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.105 -1.467 19707 8907 1 18 . 1 1 72 72 LEU H H 72 8.859 8.859 8.887 -0.028 19707 8908 1 18 . 1 1 73 73 GLN N N 73 119.520 119.520 122.087 -2.567 19707 8909 1 18 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.091 0.254 19707 8910 1 18 . 1 1 73 73 GLN C C 73 172.249 172.249 175.710 -3.461 19707 8911 1 18 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.547 -3.214 19707 8912 1 18 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.163 -1.393 19707 8913 1 18 . 1 1 73 73 GLN H H 73 9.196 9.196 8.287 0.909 19707 8914 1 18 . 1 1 74 74 GLY N N 74 113.513 113.513 111.887 1.626 19707 8915 1 18 . 1 1 74 74 GLY C C 74 169.072 169.072 172.009 -2.937 19707 8916 1 18 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.826 -2.529 19707 8917 1 18 . 1 1 74 74 GLY H H 74 9.373 9.373 9.184 0.189 19707 8918 1 18 . 1 1 75 75 ARG N N 75 122.479 122.479 123.756 -1.277 19707 8919 1 18 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.351 0.151 19707 8920 1 18 . 1 1 75 75 ARG C C 75 172.348 172.348 174.013 -1.665 19707 8921 1 18 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.698 -3.940 19707 8922 1 18 . 1 1 75 75 ARG CB C 75 31.818 31.818 33.951 -2.133 19707 8923 1 18 . 1 1 75 75 ARG H H 75 8.615 8.615 8.397 0.218 19707 8924 1 18 . 1 1 76 76 ALA N N 76 122.346 122.346 128.642 -6.296 19707 8925 1 18 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.801 -0.265 19707 8926 1 18 . 1 1 76 76 ALA C C 76 172.704 172.704 174.737 -2.033 19707 8927 1 18 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.307 -2.280 19707 8928 1 18 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.974 -2.949 19707 8929 1 18 . 1 1 76 76 ALA H H 76 8.590 8.590 9.204 -0.614 19707 8930 1 18 . 1 1 77 77 THR N N 77 116.961 116.961 116.078 0.883 19707 8931 1 18 . 1 1 77 77 THR HA H 77 4.988 4.988 5.153 -0.165 19707 8932 1 18 . 1 1 77 77 THR C C 77 172.800 172.800 175.017 -2.217 19707 8933 1 18 . 1 1 77 77 THR CA C 77 58.344 58.344 61.077 -2.732 19707 8934 1 18 . 1 1 77 77 THR CB C 77 67.712 67.712 70.430 -2.718 19707 8935 1 18 . 1 1 77 77 THR H H 77 8.491 8.491 8.311 0.180 19707 8936 1 18 . 1 1 78 78 GLY N N 78 111.103 111.103 112.610 -1.507 19707 8937 1 18 . 1 1 78 78 GLY C C 78 172.567 172.567 174.684 -2.117 19707 8938 1 18 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.464 -2.155 19707 8939 1 18 . 1 1 78 78 GLY H H 78 8.649 8.649 8.592 0.057 19707 8940 1 18 . 1 1 79 79 GLU N N 79 123.423 123.423 119.662 3.761 19707 8941 1 18 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.282 -0.286 19707 8942 1 18 . 1 1 79 79 GLU C C 79 175.466 175.466 177.313 -1.847 19707 8943 1 18 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.314 -2.855 19707 8944 1 18 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.831 -3.764 19707 8945 1 18 . 1 1 79 79 GLU H H 79 10.375 10.375 8.826 1.549 19707 8946 1 18 . 1 1 80 80 GLU N N 80 113.846 113.846 117.552 -3.706 19707 8947 1 18 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.417 -0.059 19707 8948 1 18 . 1 1 80 80 GLU C C 80 173.293 173.293 176.872 -3.579 19707 8949 1 18 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.962 -4.186 19707 8950 1 18 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.593 -4.862 19707 8951 1 18 . 1 1 80 80 GLU H H 80 7.679 7.679 8.443 -0.764 19707 8952 1 18 . 1 1 81 81 GLY N N 81 105.493 105.493 109.262 -3.769 19707 8953 1 18 . 1 1 81 81 GLY C C 81 170.427 170.427 173.799 -3.372 19707 8954 1 18 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.137 -2.525 19707 8955 1 18 . 1 1 81 81 GLY H H 81 7.476 7.476 7.713 -0.237 19707 8956 1 18 . 1 1 82 82 GLU N N 82 122.160 122.160 119.686 2.474 19707 8957 1 18 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.408 0.546 19707 8958 1 18 . 1 1 82 82 GLU C C 82 171.004 171.004 174.817 -3.813 19707 8959 1 18 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.253 -3.932 19707 8960 1 18 . 1 1 82 82 GLU CB C 82 26.066 26.066 30.866 -4.800 19707 8961 1 18 . 1 1 82 82 GLU H H 82 9.585 9.585 8.071 1.514 19707 8962 1 18 . 1 1 83 83 THR N N 83 114.756 114.756 115.708 -0.952 19707 8963 1 18 . 1 1 83 83 THR HA H 83 4.990 4.990 5.155 -0.165 19707 8964 1 18 . 1 1 83 83 THR C C 83 170.909 170.909 173.330 -2.421 19707 8965 1 18 . 1 1 83 83 THR CA C 83 57.957 57.957 62.222 -4.265 19707 8966 1 18 . 1 1 83 83 THR CB C 83 68.271 68.271 71.584 -3.313 19707 8967 1 18 . 1 1 83 83 THR H H 83 8.490 8.490 8.407 0.083 19707 8968 1 18 . 1 1 84 84 VAL N N 84 122.639 122.639 125.286 -2.647 19707 8969 1 18 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.633 0.022 19707 8970 1 18 . 1 1 84 84 VAL C C 84 170.962 170.962 173.708 -2.746 19707 8971 1 18 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.245 -2.948 19707 8972 1 18 . 1 1 84 84 VAL CB C 84 32.224 32.224 35.219 -2.995 19707 8973 1 18 . 1 1 84 84 VAL H H 84 9.001 9.001 9.056 -0.055 19707 8974 1 18 . 1 1 85 85 LEU N N 85 129.903 129.903 127.302 2.601 19707 8975 1 18 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.504 -0.112 19707 8976 1 18 . 1 1 85 85 LEU C C 85 172.346 172.346 174.698 -2.352 19707 8977 1 18 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.300 -2.502 19707 8978 1 18 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.831 -4.316 19707 8979 1 18 . 1 1 85 85 LEU H H 85 8.610 8.610 8.830 -0.220 19707 8980 1 18 . 1 1 86 86 VAL N N 86 122.778 122.778 123.679 -0.901 19707 8981 1 18 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.814 0.227 19707 8982 1 18 . 1 1 86 86 VAL C C 86 172.570 172.570 174.350 -1.780 19707 8983 1 18 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.064 -3.864 19707 8984 1 18 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.314 -3.039 19707 8985 1 18 . 1 1 86 86 VAL H H 86 9.228 9.228 9.143 0.085 19707 8986 1 18 . 1 1 87 87 GLU N N 87 120.437 120.437 125.469 -5.032 19707 8987 1 18 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.557 0.174 19707 8988 1 18 . 1 1 87 87 GLU C C 87 172.267 172.267 175.144 -2.877 19707 8989 1 18 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.593 -3.244 19707 8990 1 18 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.976 -2.852 19707 8991 1 18 . 1 1 87 87 GLU H H 87 8.851 8.851 9.148 -0.297 19707 8992 1 18 . 1 1 88 88 GLU N N 88 118.525 118.525 122.509 -3.984 19707 8993 1 18 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.798 0.203 19707 8994 1 18 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.778 -2.861 19707 8995 1 18 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.864 -1.917 19707 8996 1 18 . 1 1 88 88 GLU H H 88 8.380 8.380 8.543 -0.163 19707 8997 1 18 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.293 0.236 19707 8998 1 18 . 1 1 89 89 PRO C C 89 172.774 172.774 176.658 -3.884 19707 8999 1 18 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.316 -2.935 19707 9000 1 18 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.054 -2.720 19707 9001 1 19 . 1 1 2 2 SER N N 2 115.963 115.963 114.330 1.633 19707 9002 1 19 . 1 1 2 2 SER HA H 2 4.408 4.408 4.569 -0.161 19707 9003 1 19 . 1 1 2 2 SER C C 2 171.788 171.788 173.546 -1.758 19707 9004 1 19 . 1 1 2 2 SER CA C 2 55.870 55.870 57.474 -1.604 19707 9005 1 19 . 1 1 2 2 SER CB C 2 61.022 61.022 65.088 -4.066 19707 9006 1 19 . 1 1 2 2 SER H H 2 8.661 8.661 8.506 0.155 19707 9007 1 19 . 1 1 3 3 GLU N N 3 122.941 122.941 123.372 -0.431 19707 9008 1 19 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.263 0.057 19707 9009 1 19 . 1 1 3 3 GLU C C 3 173.817 173.817 176.076 -2.259 19707 9010 1 19 . 1 1 3 3 GLU CA C 3 53.954 53.954 57.410 -3.455 19707 9011 1 19 . 1 1 3 3 GLU CB C 3 26.837 26.837 29.364 -2.527 19707 9012 1 19 . 1 1 3 3 GLU H H 3 8.706 8.706 8.698 0.008 19707 9013 1 19 . 1 1 4 4 THR N N 4 116.182 116.182 118.990 -2.808 19707 9014 1 19 . 1 1 4 4 THR HA H 4 4.233 4.233 4.617 -0.384 19707 9015 1 19 . 1 1 4 4 THR C C 4 171.719 171.719 174.382 -2.663 19707 9016 1 19 . 1 1 4 4 THR CA C 4 59.414 59.414 61.448 -2.034 19707 9017 1 19 . 1 1 4 4 THR CB C 4 67.009 67.009 70.784 -3.775 19707 9018 1 19 . 1 1 4 4 THR H H 4 8.165 8.165 8.329 -0.164 19707 9019 1 19 . 1 1 5 5 ARG N N 5 124.184 124.184 124.552 -0.368 19707 9020 1 19 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.596 -0.236 19707 9021 1 19 . 1 1 5 5 ARG C C 5 173.520 173.520 175.827 -2.307 19707 9022 1 19 . 1 1 5 5 ARG CA C 5 53.343 53.343 56.744 -3.401 19707 9023 1 19 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.828 -2.663 19707 9024 1 19 . 1 1 5 5 ARG H H 5 8.354 8.354 8.716 -0.362 19707 9025 1 19 . 1 1 6 6 THR N N 6 116.652 116.652 114.328 2.324 19707 9026 1 19 . 1 1 6 6 THR HA H 6 4.263 4.263 4.584 -0.321 19707 9027 1 19 . 1 1 6 6 THR C C 6 171.784 171.784 173.223 -1.439 19707 9028 1 19 . 1 1 6 6 THR CA C 6 59.218 59.218 61.233 -2.015 19707 9029 1 19 . 1 1 6 6 THR CB C 6 67.213 67.213 69.775 -2.562 19707 9030 1 19 . 1 1 6 6 THR H H 6 8.224 8.224 8.112 0.112 19707 9031 1 19 . 1 1 7 7 ILE N N 7 123.882 123.882 123.602 0.280 19707 9032 1 19 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.431 -0.293 19707 9033 1 19 . 1 1 7 7 ILE C C 7 173.572 173.572 176.309 -2.737 19707 9034 1 19 . 1 1 7 7 ILE CA C 7 58.482 58.482 59.819 -1.337 19707 9035 1 19 . 1 1 7 7 ILE CB C 7 36.069 36.069 38.261 -2.192 19707 9036 1 19 . 1 1 7 7 ILE H H 7 8.247 8.247 8.402 -0.155 19707 9037 1 19 . 1 1 8 8 SER N N 8 120.287 120.287 122.667 -2.380 19707 9038 1 19 . 1 1 8 8 SER HA H 8 4.445 4.445 4.299 0.146 19707 9039 1 19 . 1 1 8 8 SER C C 8 171.926 171.926 174.298 -2.372 19707 9040 1 19 . 1 1 8 8 SER CA C 8 55.522 55.522 59.146 -3.624 19707 9041 1 19 . 1 1 8 8 SER CB C 8 61.073 61.073 64.022 -2.949 19707 9042 1 19 . 1 1 8 8 SER H H 8 8.402 8.402 8.511 -0.109 19707 9043 1 19 . 1 1 9 9 SER N N 9 118.425 118.425 120.206 -1.781 19707 9044 1 19 . 1 1 9 9 SER HA H 9 4.525 4.525 4.764 -0.239 19707 9045 1 19 . 1 1 9 9 SER C C 9 172.663 172.663 173.629 -0.966 19707 9046 1 19 . 1 1 9 9 SER CA C 9 55.897 55.897 57.952 -2.055 19707 9047 1 19 . 1 1 9 9 SER CB C 9 61.375 61.375 63.915 -2.540 19707 9048 1 19 . 1 1 9 9 SER H H 9 8.362 8.362 8.630 -0.268 19707 9049 1 19 . 1 1 10 10 THR N N 10 115.676 115.676 113.254 2.422 19707 9050 1 19 . 1 1 10 10 THR HA H 10 4.232 4.232 4.671 -0.439 19707 9051 1 19 . 1 1 10 10 THR C C 10 173.070 173.070 175.087 -2.017 19707 9052 1 19 . 1 1 10 10 THR CA C 10 60.318 60.318 62.732 -2.414 19707 9053 1 19 . 1 1 10 10 THR CB C 10 67.205 67.205 69.159 -1.954 19707 9054 1 19 . 1 1 10 10 THR H H 10 8.274 8.274 8.038 0.236 19707 9055 1 19 . 1 1 11 11 ALA N N 11 124.726 124.726 124.890 -0.164 19707 9056 1 19 . 1 1 11 11 ALA HA H 11 3.987 3.987 3.987 -0.000 19707 9057 1 19 . 1 1 11 11 ALA C C 11 176.825 176.825 179.429 -2.604 19707 9058 1 19 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.298 -2.757 19707 9059 1 19 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.228 -2.339 19707 9060 1 19 . 1 1 11 11 ALA H H 11 8.347 8.347 8.118 0.229 19707 9061 1 19 . 1 1 12 12 GLN N N 12 117.915 117.915 118.284 -0.369 19707 9062 1 19 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.059 -0.270 19707 9063 1 19 . 1 1 12 12 GLN C C 12 174.697 174.697 177.866 -3.169 19707 9064 1 19 . 1 1 12 12 GLN CA C 12 55.004 55.004 58.444 -3.440 19707 9065 1 19 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.459 -2.234 19707 9066 1 19 . 1 1 12 12 GLN H H 12 8.194 8.194 7.831 0.363 19707 9067 1 19 . 1 1 13 13 GLU N N 13 118.510 118.510 120.533 -2.023 19707 9068 1 19 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.024 0.079 19707 9069 1 19 . 1 1 13 13 GLU C C 13 176.192 176.192 178.585 -2.393 19707 9070 1 19 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.988 -2.673 19707 9071 1 19 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.661 -3.628 19707 9072 1 19 . 1 1 13 13 GLU H H 13 7.917 7.917 8.273 -0.356 19707 9073 1 19 . 1 1 14 14 ARG N N 14 118.193 118.193 118.748 -0.555 19707 9074 1 19 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.072 -0.104 19707 9075 1 19 . 1 1 14 14 ARG C C 14 176.764 176.764 178.703 -1.939 19707 9076 1 19 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.092 -1.809 19707 9077 1 19 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.547 -2.310 19707 9078 1 19 . 1 1 14 14 ARG H H 14 7.907 7.907 8.183 -0.276 19707 9079 1 19 . 1 1 15 15 VAL N N 15 117.991 117.991 118.983 -0.992 19707 9080 1 19 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.812 0.091 19707 9081 1 19 . 1 1 15 15 VAL C C 15 174.922 174.922 177.955 -3.033 19707 9082 1 19 . 1 1 15 15 VAL CA C 15 62.831 62.831 65.940 -3.109 19707 9083 1 19 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.509 -2.787 19707 9084 1 19 . 1 1 15 15 VAL H H 15 7.658 7.658 7.716 -0.058 19707 9085 1 19 . 1 1 16 16 ASP N N 16 124.314 124.314 120.921 3.393 19707 9086 1 19 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.447 -0.131 19707 9087 1 19 . 1 1 16 16 ASP C C 16 176.462 176.462 178.095 -1.633 19707 9088 1 19 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.157 -1.831 19707 9089 1 19 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.006 -4.337 19707 9090 1 19 . 1 1 16 16 ASP H H 16 8.291 8.291 7.607 0.684 19707 9091 1 19 . 1 1 17 17 LEU N N 17 120.212 120.212 119.550 0.662 19707 9092 1 19 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.080 -0.026 19707 9093 1 19 . 1 1 17 17 LEU C C 17 177.171 177.171 178.673 -1.502 19707 9094 1 19 . 1 1 17 17 LEU CA C 17 54.980 54.980 58.208 -3.228 19707 9095 1 19 . 1 1 17 17 LEU CB C 17 38.845 38.845 42.103 -3.259 19707 9096 1 19 . 1 1 17 17 LEU H H 17 8.172 8.172 7.504 0.668 19707 9097 1 19 . 1 1 18 18 GLU N N 18 120.587 120.587 119.866 0.721 19707 9098 1 19 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.960 0.233 19707 9099 1 19 . 1 1 18 18 GLU C C 18 175.997 175.997 178.692 -2.695 19707 9100 1 19 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.430 -3.328 19707 9101 1 19 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.840 -2.768 19707 9102 1 19 . 1 1 18 18 GLU H H 18 7.876 7.876 8.057 -0.181 19707 9103 1 19 . 1 1 19 19 ALA N N 19 121.800 121.800 122.639 -0.839 19707 9104 1 19 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.150 -0.359 19707 9105 1 19 . 1 1 19 19 ALA C C 19 175.708 175.708 179.626 -3.918 19707 9106 1 19 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.861 -2.009 19707 9107 1 19 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.317 -4.163 19707 9108 1 19 . 1 1 19 19 ALA H H 19 7.792 7.792 7.467 0.325 19707 9109 1 19 . 1 1 20 20 VAL N N 20 118.680 118.680 119.242 -0.562 19707 9110 1 19 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.567 -0.267 19707 9111 1 19 . 1 1 20 20 VAL C C 20 176.276 176.276 177.832 -1.556 19707 9112 1 19 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.570 -2.763 19707 9113 1 19 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.577 -2.026 19707 9114 1 19 . 1 1 20 20 VAL H H 20 7.712 7.712 7.628 0.084 19707 9115 1 19 . 1 1 21 21 ARG N N 21 121.935 121.935 120.668 1.267 19707 9116 1 19 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.069 -0.074 19707 9117 1 19 . 1 1 21 21 ARG C C 21 176.828 176.828 178.499 -1.671 19707 9118 1 19 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.456 -1.796 19707 9119 1 19 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.548 -2.258 19707 9120 1 19 . 1 1 21 21 ARG H H 21 8.444 8.444 8.309 0.135 19707 9121 1 19 . 1 1 22 22 LEU N N 22 119.327 119.327 119.595 -0.268 19707 9122 1 19 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.092 -0.097 19707 9123 1 19 . 1 1 22 22 LEU C C 22 175.664 175.664 178.578 -2.914 19707 9124 1 19 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.146 -3.278 19707 9125 1 19 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.554 -2.419 19707 9126 1 19 . 1 1 22 22 LEU H H 22 8.248 8.248 7.945 0.303 19707 9127 1 19 . 1 1 23 23 ALA N N 23 121.202 121.202 122.398 -1.196 19707 9128 1 19 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.937 -0.202 19707 9129 1 19 . 1 1 23 23 ALA C C 23 175.492 175.492 179.577 -4.085 19707 9130 1 19 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.461 -2.392 19707 9131 1 19 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.963 -3.896 19707 9132 1 19 . 1 1 23 23 ALA H H 23 8.392 8.392 8.678 -0.286 19707 9133 1 19 . 1 1 24 24 SER N N 24 112.377 112.377 115.101 -2.724 19707 9134 1 19 . 1 1 24 24 SER HA H 24 4.214 4.214 4.286 -0.072 19707 9135 1 19 . 1 1 24 24 SER C C 24 174.773 174.773 176.426 -1.653 19707 9136 1 19 . 1 1 24 24 SER CA C 24 59.258 59.258 62.446 -3.188 19707 9137 1 19 . 1 1 24 24 SER CB C 24 60.149 60.149 63.063 -2.914 19707 9138 1 19 . 1 1 24 24 SER H H 24 7.690 7.690 8.110 -0.420 19707 9139 1 19 . 1 1 25 25 ILE N N 25 123.886 123.886 122.554 1.332 19707 9140 1 19 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.968 -0.126 19707 9141 1 19 . 1 1 25 25 ILE C C 25 176.487 176.487 178.153 -1.666 19707 9142 1 19 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.295 -0.302 19707 9143 1 19 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.379 -0.447 19707 9144 1 19 . 1 1 25 25 ILE H H 25 7.837 7.837 8.113 -0.276 19707 9145 1 19 . 1 1 26 26 VAL N N 26 122.538 122.538 122.242 0.296 19707 9146 1 19 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.590 -0.202 19707 9147 1 19 . 1 1 26 26 VAL C C 26 174.624 174.624 177.916 -3.292 19707 9148 1 19 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.672 -2.757 19707 9149 1 19 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.514 -3.619 19707 9150 1 19 . 1 1 26 26 VAL H H 26 8.804 8.804 8.806 -0.002 19707 9151 1 19 . 1 1 27 27 ASP N N 27 120.433 120.433 120.670 -0.237 19707 9152 1 19 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.331 -0.167 19707 9153 1 19 . 1 1 27 27 ASP C C 27 174.966 174.966 179.015 -4.049 19707 9154 1 19 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.807 -2.478 19707 9155 1 19 . 1 1 27 27 ASP CB C 27 37.854 37.854 39.947 -2.093 19707 9156 1 19 . 1 1 27 27 ASP H H 27 8.719 8.719 8.709 0.010 19707 9157 1 19 . 1 1 28 28 SER N N 28 112.397 112.397 115.580 -3.183 19707 9158 1 19 . 1 1 28 28 SER HA H 28 4.073 4.073 4.243 -0.170 19707 9159 1 19 . 1 1 28 28 SER C C 28 174.405 174.405 176.642 -2.237 19707 9160 1 19 . 1 1 28 28 SER CA C 28 59.115 59.115 61.794 -2.679 19707 9161 1 19 . 1 1 28 28 SER CB C 28 60.125 60.125 63.124 -2.999 19707 9162 1 19 . 1 1 28 28 SER H H 28 7.599 7.599 8.240 -0.641 19707 9163 1 19 . 1 1 29 29 ARG N N 29 123.945 123.945 122.537 1.408 19707 9164 1 19 . 1 1 29 29 ARG HA H 29 4.027 4.027 4.008 0.019 19707 9165 1 19 . 1 1 29 29 ARG C C 29 175.902 175.902 178.030 -2.128 19707 9166 1 19 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.784 -3.510 19707 9167 1 19 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.146 -1.406 19707 9168 1 19 . 1 1 29 29 ARG H H 29 7.769 7.769 7.802 -0.033 19707 9169 1 19 . 1 1 30 30 LEU N N 30 121.580 121.580 120.784 0.796 19707 9170 1 19 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.995 -0.246 19707 9171 1 19 . 1 1 30 30 LEU C C 30 177.474 177.474 179.656 -2.182 19707 9172 1 19 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.908 -2.595 19707 9173 1 19 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.889 -2.860 19707 9174 1 19 . 1 1 30 30 LEU H H 30 8.665 8.665 8.461 0.204 19707 9175 1 19 . 1 1 31 31 ILE N N 31 119.330 119.330 117.902 1.428 19707 9176 1 19 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.805 -0.114 19707 9177 1 19 . 1 1 31 31 ILE C C 31 175.341 175.341 177.789 -2.448 19707 9178 1 19 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.103 -2.591 19707 9179 1 19 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.807 -2.240 19707 9180 1 19 . 1 1 31 31 ILE H H 31 8.226 8.226 8.544 -0.318 19707 9181 1 19 . 1 1 32 32 GLY N N 32 106.092 106.092 105.948 0.144 19707 9182 1 19 . 1 1 32 32 GLY C C 32 172.413 172.413 175.186 -2.773 19707 9183 1 19 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.737 -3.240 19707 9184 1 19 . 1 1 32 32 GLY H H 32 7.767 7.767 7.672 0.095 19707 9185 1 19 . 1 1 33 33 THR N N 33 110.966 110.966 113.192 -2.226 19707 9186 1 19 . 1 1 33 33 THR HA H 33 4.455 4.455 4.365 0.090 19707 9187 1 19 . 1 1 33 33 THR C C 33 172.714 172.714 174.908 -2.194 19707 9188 1 19 . 1 1 33 33 THR CA C 33 60.032 60.032 62.816 -2.784 19707 9189 1 19 . 1 1 33 33 THR CB C 33 68.287 68.287 70.148 -1.861 19707 9190 1 19 . 1 1 33 33 THR H H 33 8.102 8.102 7.844 0.258 19707 9191 1 19 . 1 1 34 34 GLY N N 34 110.320 110.320 110.862 -0.542 19707 9192 1 19 . 1 1 34 34 GLY C C 34 170.505 170.505 173.681 -3.176 19707 9193 1 19 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.142 -2.559 19707 9194 1 19 . 1 1 34 34 GLY H H 34 8.072 8.072 8.239 -0.167 19707 9195 1 19 . 1 1 35 35 SER N N 35 112.944 112.944 114.857 -1.913 19707 9196 1 19 . 1 1 35 35 SER HA H 35 4.385 4.385 4.803 -0.418 19707 9197 1 19 . 1 1 35 35 SER C C 35 169.537 169.537 172.753 -3.216 19707 9198 1 19 . 1 1 35 35 SER CA C 35 54.794 54.794 58.017 -3.223 19707 9199 1 19 . 1 1 35 35 SER CB C 35 62.029 62.029 66.105 -4.076 19707 9200 1 19 . 1 1 35 35 SER H H 35 7.719 7.719 7.654 0.065 19707 9201 1 19 . 1 1 36 36 VAL N N 36 118.566 118.566 122.912 -4.346 19707 9202 1 19 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.122 -0.089 19707 9203 1 19 . 1 1 36 36 VAL C C 36 169.876 169.876 174.533 -4.657 19707 9204 1 19 . 1 1 36 36 VAL CA C 36 58.565 58.565 61.688 -3.123 19707 9205 1 19 . 1 1 36 36 VAL CB C 36 30.952 30.952 32.821 -1.869 19707 9206 1 19 . 1 1 36 36 VAL H H 36 8.490 8.490 8.871 -0.381 19707 9207 1 19 . 1 1 37 37 ASP N N 37 121.640 121.640 124.144 -2.504 19707 9208 1 19 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.927 -0.125 19707 9209 1 19 . 1 1 37 37 ASP C C 37 172.806 172.806 176.306 -3.500 19707 9210 1 19 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.876 -3.833 19707 9211 1 19 . 1 1 37 37 ASP CB C 37 40.206 40.206 44.241 -4.035 19707 9212 1 19 . 1 1 37 37 ASP H H 37 7.195 7.195 8.415 -1.220 19707 9213 1 19 . 1 1 38 38 GLU N N 38 120.018 120.018 121.281 -1.263 19707 9214 1 19 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.897 -0.240 19707 9215 1 19 . 1 1 38 38 GLU C C 38 174.753 174.753 177.709 -2.956 19707 9216 1 19 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.502 -3.010 19707 9217 1 19 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.801 -3.722 19707 9218 1 19 . 1 1 38 38 GLU H H 38 8.908 8.908 8.944 -0.036 19707 9219 1 19 . 1 1 39 39 ASP N N 39 118.668 118.668 117.459 1.209 19707 9220 1 19 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.473 -0.227 19707 9221 1 19 . 1 1 39 39 ASP C C 39 175.393 175.393 177.540 -2.147 19707 9222 1 19 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.334 -1.470 19707 9223 1 19 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.531 -3.561 19707 9224 1 19 . 1 1 39 39 ASP H H 39 8.242 8.242 8.657 -0.415 19707 9225 1 19 . 1 1 40 40 PHE N N 40 119.851 119.851 118.278 1.573 19707 9226 1 19 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.445 -0.241 19707 9227 1 19 . 1 1 40 40 PHE C C 40 174.929 174.929 175.735 -0.806 19707 9228 1 19 . 1 1 40 40 PHE CA C 40 58.171 58.171 59.784 -1.613 19707 9229 1 19 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.172 -3.339 19707 9230 1 19 . 1 1 40 40 PHE H H 40 8.037 8.037 7.730 0.307 19707 9231 1 19 . 1 1 41 41 LEU N N 41 117.882 117.882 116.877 1.005 19707 9232 1 19 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.110 -0.588 19707 9233 1 19 . 1 1 41 41 LEU C C 41 175.938 175.938 179.099 -3.161 19707 9234 1 19 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.242 -1.382 19707 9235 1 19 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.606 -3.375 19707 9236 1 19 . 1 1 41 41 LEU H H 41 7.816 7.816 7.761 0.055 19707 9237 1 19 . 1 1 42 42 ARG N N 42 118.360 118.360 118.718 -0.358 19707 9238 1 19 . 1 1 42 42 ARG HA H 42 3.740 3.740 3.995 -0.255 19707 9239 1 19 . 1 1 42 42 ARG C C 42 175.435 175.435 177.147 -1.712 19707 9240 1 19 . 1 1 42 42 ARG CA C 42 56.971 56.971 58.998 -2.027 19707 9241 1 19 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.850 -2.586 19707 9242 1 19 . 1 1 42 42 ARG H H 42 8.540 8.540 7.970 0.570 19707 9243 1 19 . 1 1 43 43 GLU N N 43 114.947 114.947 116.922 -1.975 19707 9244 1 19 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.237 -0.187 19707 9245 1 19 . 1 1 43 43 GLU C C 43 174.518 174.518 177.916 -3.398 19707 9246 1 19 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.762 -3.191 19707 9247 1 19 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.238 -3.197 19707 9248 1 19 . 1 1 43 43 GLU H H 43 7.223 7.223 8.376 -1.153 19707 9249 1 19 . 1 1 44 44 GLN N N 44 114.109 114.109 118.244 -4.135 19707 9250 1 19 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.269 -0.163 19707 9251 1 19 . 1 1 44 44 GLN C C 44 173.777 173.777 178.028 -4.251 19707 9252 1 19 . 1 1 44 44 GLN CA C 44 52.181 52.181 56.559 -4.378 19707 9253 1 19 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.121 -3.251 19707 9254 1 19 . 1 1 44 44 GLN H H 44 7.372 7.372 8.075 -0.703 19707 9255 1 19 . 1 1 45 45 ILE N N 45 117.470 117.470 115.233 2.237 19707 9256 1 19 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.583 0.365 19707 9257 1 19 . 1 1 45 45 ILE C C 45 172.305 172.305 177.206 -4.901 19707 9258 1 19 . 1 1 45 45 ILE CA C 45 58.505 58.505 64.561 -6.056 19707 9259 1 19 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.369 -1.669 19707 9260 1 19 . 1 1 45 45 ILE H H 45 7.235 7.235 7.348 -0.113 19707 9261 1 19 . 1 1 46 46 ARG N N 46 122.996 122.996 115.147 7.849 19707 9262 1 19 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.893 0.297 19707 9263 1 19 . 1 1 46 46 ARG C C 46 172.992 172.992 175.392 -2.400 19707 9264 1 19 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.047 -4.286 19707 9265 1 19 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.976 -1.024 19707 9266 1 19 . 1 1 46 46 ARG H H 46 8.336 8.336 8.458 -0.122 19707 9267 1 19 . 1 1 47 47 ASP N N 47 118.676 118.676 115.193 3.483 19707 9268 1 19 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.599 -0.151 19707 9269 1 19 . 1 1 47 47 ASP C C 47 172.520 172.520 175.104 -2.584 19707 9270 1 19 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.229 -2.339 19707 9271 1 19 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.297 -4.640 19707 9272 1 19 . 1 1 47 47 ASP H H 47 8.313 8.313 7.921 0.392 19707 9273 1 19 . 1 1 48 48 ALA N N 48 120.922 120.922 123.131 -2.209 19707 9274 1 19 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.400 -0.031 19707 9275 1 19 . 1 1 48 48 ALA C C 48 174.295 174.295 177.656 -3.361 19707 9276 1 19 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.037 -2.400 19707 9277 1 19 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.592 -3.378 19707 9278 1 19 . 1 1 48 48 ALA H H 48 7.824 7.824 7.782 0.042 19707 9279 1 19 . 1 1 49 49 ARG N N 49 118.644 118.644 122.240 -3.596 19707 9280 1 19 . 1 1 49 49 ARG HA H 49 4.342 4.342 3.953 0.389 19707 9281 1 19 . 1 1 49 49 ARG C C 49 172.504 172.504 176.212 -3.708 19707 9282 1 19 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.874 -3.965 19707 9283 1 19 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.453 -2.110 19707 9284 1 19 . 1 1 49 49 ARG H H 49 7.911 7.911 8.887 -0.976 19707 9285 1 19 . 1 1 50 50 TYR N N 50 119.470 119.470 114.270 5.200 19707 9286 1 19 . 1 1 50 50 TYR HA H 50 5.291 5.291 4.967 0.324 19707 9287 1 19 . 1 1 50 50 TYR C C 50 170.470 170.470 174.200 -3.730 19707 9288 1 19 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.330 -2.062 19707 9289 1 19 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.203 -0.690 19707 9290 1 19 . 1 1 50 50 TYR H H 50 7.639 7.639 7.992 -0.353 19707 9291 1 19 . 1 1 51 51 ALA N N 51 127.418 127.418 125.542 1.876 19707 9292 1 19 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.149 0.072 19707 9293 1 19 . 1 1 51 51 ALA C C 51 171.328 171.328 175.402 -4.074 19707 9294 1 19 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.460 -3.027 19707 9295 1 19 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.481 -1.169 19707 9296 1 19 . 1 1 51 51 ALA H H 51 8.222 8.222 8.745 -0.523 19707 9297 1 19 . 1 1 52 52 VAL N N 52 117.832 117.832 121.627 -3.795 19707 9298 1 19 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.004 -0.337 19707 9299 1 19 . 1 1 52 52 VAL C C 52 172.436 172.436 174.118 -1.682 19707 9300 1 19 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.666 -3.909 19707 9301 1 19 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.675 -4.572 19707 9302 1 19 . 1 1 52 52 VAL H H 52 8.753 8.753 9.061 -0.308 19707 9303 1 19 . 1 1 53 53 ILE N N 53 128.027 128.027 124.853 3.174 19707 9304 1 19 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.869 -0.027 19707 9305 1 19 . 1 1 53 53 ILE C C 53 172.110 172.110 174.638 -2.528 19707 9306 1 19 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.103 -2.350 19707 9307 1 19 . 1 1 53 53 ILE CB C 53 37.159 37.159 41.833 -4.674 19707 9308 1 19 . 1 1 53 53 ILE H H 53 9.261 9.261 9.038 0.223 19707 9309 1 19 . 1 1 54 54 ARG N N 54 127.885 127.885 126.757 1.128 19707 9310 1 19 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.674 0.079 19707 9311 1 19 . 1 1 54 54 ARG C C 54 172.285 172.285 174.379 -2.094 19707 9312 1 19 . 1 1 54 54 ARG CA C 54 52.260 52.260 55.223 -2.963 19707 9313 1 19 . 1 1 54 54 ARG CB C 54 27.892 27.892 31.628 -3.736 19707 9314 1 19 . 1 1 54 54 ARG H H 54 8.686 8.686 9.041 -0.355 19707 9315 1 19 . 1 1 55 55 ILE N N 55 129.907 129.907 124.293 5.614 19707 9316 1 19 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.440 -0.287 19707 9317 1 19 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.119 -2.524 19707 9318 1 19 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.855 -2.241 19707 9319 1 19 . 1 1 55 55 ILE H H 55 9.292 9.292 8.516 0.776 19707 9320 1 19 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.406 -0.214 19707 9321 1 19 . 1 1 56 56 PRO C C 56 174.787 174.787 177.806 -3.019 19707 9322 1 19 . 1 1 56 56 PRO CA C 56 61.734 61.734 64.134 -2.400 19707 9323 1 19 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.757 -2.844 19707 9324 1 19 . 1 1 57 57 GLY N N 57 111.828 111.828 110.864 0.964 19707 9325 1 19 . 1 1 57 57 GLY C C 57 171.039 171.039 173.669 -2.630 19707 9326 1 19 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.897 -2.079 19707 9327 1 19 . 1 1 57 57 GLY H H 57 8.708 8.708 8.712 -0.004 19707 9328 1 19 . 1 1 58 58 GLN N N 58 118.457 118.457 119.947 -1.490 19707 9329 1 19 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.818 0.082 19707 9330 1 19 . 1 1 58 58 GLN CA C 58 50.272 50.272 52.995 -2.724 19707 9331 1 19 . 1 1 58 58 GLN CB C 58 27.154 27.154 30.153 -2.999 19707 9332 1 19 . 1 1 58 58 GLN H H 58 7.909 7.909 7.564 0.345 19707 9333 1 19 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.452 -0.016 19707 9334 1 19 . 1 1 59 59 PRO C C 59 174.607 174.607 177.189 -2.582 19707 9335 1 19 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.941 -2.886 19707 9336 1 19 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.105 -2.928 19707 9337 1 19 . 1 1 60 60 VAL N N 60 122.695 122.695 121.412 1.283 19707 9338 1 19 . 1 1 60 60 VAL HA H 60 3.955 3.955 3.849 0.106 19707 9339 1 19 . 1 1 60 60 VAL C C 60 172.403 172.403 175.883 -3.480 19707 9340 1 19 . 1 1 60 60 VAL CA C 60 60.895 60.895 63.281 -2.386 19707 9341 1 19 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.530 -2.888 19707 9342 1 19 . 1 1 60 60 VAL H H 60 8.364 8.364 8.208 0.156 19707 9343 1 19 . 1 1 61 61 VAL N N 61 126.097 126.097 129.137 -3.040 19707 9344 1 19 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.345 -0.045 19707 9345 1 19 . 1 1 61 61 VAL C C 61 170.891 170.891 174.329 -3.438 19707 9346 1 19 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.932 -3.118 19707 9347 1 19 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.982 -3.784 19707 9348 1 19 . 1 1 61 61 VAL H H 61 8.023 8.023 8.346 -0.323 19707 9349 1 19 . 1 1 62 62 GLU N N 62 126.097 126.097 125.811 0.286 19707 9350 1 19 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.035 0.124 19707 9351 1 19 . 1 1 62 62 GLU C C 62 172.252 172.252 175.320 -3.068 19707 9352 1 19 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.154 -3.614 19707 9353 1 19 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.927 -2.627 19707 9354 1 19 . 1 1 62 62 GLU H H 62 8.591 8.591 8.461 0.130 19707 9355 1 19 . 1 1 63 63 VAL N N 63 120.374 120.374 123.222 -2.848 19707 9356 1 19 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.252 0.141 19707 9357 1 19 . 1 1 63 63 VAL C C 63 171.040 171.040 176.802 -5.762 19707 9358 1 19 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.107 -3.274 19707 9359 1 19 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.663 -0.086 19707 9360 1 19 . 1 1 63 63 VAL H H 63 8.732 8.732 8.877 -0.145 19707 9361 1 19 . 1 1 64 64 GLY N N 64 109.935 109.935 113.964 -4.029 19707 9362 1 19 . 1 1 64 64 GLY C C 64 171.656 171.656 174.013 -2.357 19707 9363 1 19 . 1 1 64 64 GLY CA C 64 41.177 41.177 45.937 -4.760 19707 9364 1 19 . 1 1 64 64 GLY H H 64 8.259 8.259 8.449 -0.190 19707 9365 1 19 . 1 1 65 65 THR N N 65 115.478 115.478 115.466 0.012 19707 9366 1 19 . 1 1 65 65 THR HA H 65 4.342 4.342 4.300 0.042 19707 9367 1 19 . 1 1 65 65 THR C C 65 170.663 170.663 171.869 -1.206 19707 9368 1 19 . 1 1 65 65 THR CA C 65 58.357 58.357 60.102 -1.745 19707 9369 1 19 . 1 1 65 65 THR CB C 65 67.923 67.923 71.548 -3.625 19707 9370 1 19 . 1 1 65 65 THR H H 65 8.123 8.123 7.535 0.588 19707 9371 1 19 . 1 1 66 66 LYS N N 66 130.775 130.775 124.418 6.357 19707 9372 1 19 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.174 -1.244 19707 9373 1 19 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.324 -2.134 19707 9374 1 19 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.743 -3.053 19707 9375 1 19 . 1 1 66 66 LYS H H 66 8.472 8.472 8.281 0.191 19707 9376 1 19 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.656 -0.245 19707 9377 1 19 . 1 1 67 67 PRO C C 67 173.211 173.211 177.053 -3.842 19707 9378 1 19 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.548 -2.982 19707 9379 1 19 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.710 -3.307 19707 9380 1 19 . 1 1 68 68 THR N N 68 111.983 111.983 114.574 -2.591 19707 9381 1 19 . 1 1 68 68 THR HA H 68 4.277 4.277 4.265 0.012 19707 9382 1 19 . 1 1 68 68 THR C C 68 171.720 171.720 175.660 -3.940 19707 9383 1 19 . 1 1 68 68 THR CA C 68 58.193 58.193 62.751 -4.558 19707 9384 1 19 . 1 1 68 68 THR CB C 68 67.723 67.723 69.245 -1.522 19707 9385 1 19 . 1 1 68 68 THR H H 68 8.091 8.091 8.046 0.045 19707 9386 1 19 . 1 1 69 69 GLY N N 69 109.918 109.918 108.445 1.473 19707 9387 1 19 . 1 1 69 69 GLY C C 69 170.783 170.783 174.398 -3.615 19707 9388 1 19 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.706 -2.651 19707 9389 1 19 . 1 1 69 69 GLY H H 69 8.119 8.119 8.001 0.118 19707 9390 1 19 . 1 1 70 70 ASP N N 70 123.294 123.294 125.015 -1.721 19707 9391 1 19 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.850 -0.301 19707 9392 1 19 . 1 1 70 70 ASP C C 70 173.651 173.651 175.132 -1.481 19707 9393 1 19 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.890 -3.029 19707 9394 1 19 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.157 -1.425 19707 9395 1 19 . 1 1 70 70 ASP H H 70 8.444 8.444 8.752 -0.308 19707 9396 1 19 . 1 1 71 71 VAL N N 71 117.772 117.772 113.568 4.204 19707 9397 1 19 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.164 -0.457 19707 9398 1 19 . 1 1 71 71 VAL C C 71 172.992 172.992 174.266 -1.274 19707 9399 1 19 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.000 -1.624 19707 9400 1 19 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.688 -2.666 19707 9401 1 19 . 1 1 71 71 VAL H H 71 8.173 8.173 7.741 0.432 19707 9402 1 19 . 1 1 72 72 LEU N N 72 123.435 123.435 123.383 0.052 19707 9403 1 19 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.614 0.022 19707 9404 1 19 . 1 1 72 72 LEU C C 72 173.189 173.189 176.042 -2.853 19707 9405 1 19 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.270 -3.063 19707 9406 1 19 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.028 -1.390 19707 9407 1 19 . 1 1 72 72 LEU H H 72 8.859 8.859 8.903 -0.044 19707 9408 1 19 . 1 1 73 73 GLN N N 73 119.520 119.520 122.824 -3.304 19707 9409 1 19 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.080 0.265 19707 9410 1 19 . 1 1 73 73 GLN C C 73 172.249 172.249 175.758 -3.509 19707 9411 1 19 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.602 -3.269 19707 9412 1 19 . 1 1 73 73 GLN CB C 73 29.770 29.770 30.693 -0.923 19707 9413 1 19 . 1 1 73 73 GLN H H 73 9.196 9.196 8.678 0.518 19707 9414 1 19 . 1 1 74 74 GLY N N 74 113.513 113.513 112.043 1.470 19707 9415 1 19 . 1 1 74 74 GLY C C 74 169.072 169.072 172.098 -3.026 19707 9416 1 19 . 1 1 74 74 GLY CA C 74 41.297 41.297 44.134 -2.837 19707 9417 1 19 . 1 1 74 74 GLY H H 74 9.373 9.373 9.115 0.258 19707 9418 1 19 . 1 1 75 75 ARG N N 75 122.479 122.479 123.985 -1.506 19707 9419 1 19 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.292 0.210 19707 9420 1 19 . 1 1 75 75 ARG C C 75 172.348 172.348 174.001 -1.653 19707 9421 1 19 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.760 -4.002 19707 9422 1 19 . 1 1 75 75 ARG CB C 75 31.818 31.818 33.927 -2.109 19707 9423 1 19 . 1 1 75 75 ARG H H 75 8.615 8.615 7.953 0.662 19707 9424 1 19 . 1 1 76 76 ALA N N 76 122.346 122.346 128.981 -6.635 19707 9425 1 19 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.784 -0.248 19707 9426 1 19 . 1 1 76 76 ALA C C 76 172.704 172.704 174.974 -2.270 19707 9427 1 19 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.410 -2.383 19707 9428 1 19 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.701 -2.676 19707 9429 1 19 . 1 1 76 76 ALA H H 76 8.590 8.590 9.053 -0.463 19707 9430 1 19 . 1 1 77 77 THR N N 77 116.961 116.961 115.496 1.465 19707 9431 1 19 . 1 1 77 77 THR HA H 77 4.988 4.988 4.977 0.011 19707 9432 1 19 . 1 1 77 77 THR C C 77 172.800 172.800 174.545 -1.745 19707 9433 1 19 . 1 1 77 77 THR CA C 77 58.344 58.344 61.406 -3.062 19707 9434 1 19 . 1 1 77 77 THR CB C 77 67.712 67.712 70.923 -3.211 19707 9435 1 19 . 1 1 77 77 THR H H 77 8.491 8.491 8.276 0.215 19707 9436 1 19 . 1 1 78 78 GLY N N 78 111.103 111.103 113.703 -2.600 19707 9437 1 19 . 1 1 78 78 GLY C C 78 172.567 172.567 175.078 -2.511 19707 9438 1 19 . 1 1 78 78 GLY CA C 78 41.309 41.309 44.461 -3.152 19707 9439 1 19 . 1 1 78 78 GLY H H 78 8.649 8.649 9.234 -0.585 19707 9440 1 19 . 1 1 79 79 GLU N N 79 123.423 123.423 121.057 2.366 19707 9441 1 19 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.072 -0.076 19707 9442 1 19 . 1 1 79 79 GLU C C 79 175.466 175.466 177.738 -2.272 19707 9443 1 19 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.949 -3.490 19707 9444 1 19 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.726 -3.659 19707 9445 1 19 . 1 1 79 79 GLU H H 79 10.375 10.375 9.090 1.285 19707 9446 1 19 . 1 1 80 80 GLU N N 80 113.846 113.846 116.915 -3.069 19707 9447 1 19 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.315 0.043 19707 9448 1 19 . 1 1 80 80 GLU C C 80 173.293 173.293 177.105 -3.812 19707 9449 1 19 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.954 -4.178 19707 9450 1 19 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.615 -4.884 19707 9451 1 19 . 1 1 80 80 GLU H H 80 7.679 7.679 8.189 -0.510 19707 9452 1 19 . 1 1 81 81 GLY N N 81 105.493 105.493 108.593 -3.100 19707 9453 1 19 . 1 1 81 81 GLY C C 81 170.427 170.427 174.199 -3.772 19707 9454 1 19 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.257 -2.645 19707 9455 1 19 . 1 1 81 81 GLY H H 81 7.476 7.476 7.921 -0.445 19707 9456 1 19 . 1 1 82 82 GLU N N 82 122.160 122.160 119.535 2.625 19707 9457 1 19 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.373 0.581 19707 9458 1 19 . 1 1 82 82 GLU C C 82 171.004 171.004 175.770 -4.766 19707 9459 1 19 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.016 -3.695 19707 9460 1 19 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.359 -5.293 19707 9461 1 19 . 1 1 82 82 GLU H H 82 9.585 9.585 7.880 1.705 19707 9462 1 19 . 1 1 83 83 THR N N 83 114.756 114.756 115.328 -0.572 19707 9463 1 19 . 1 1 83 83 THR HA H 83 4.990 4.990 5.009 -0.019 19707 9464 1 19 . 1 1 83 83 THR C C 83 170.909 170.909 173.108 -2.199 19707 9465 1 19 . 1 1 83 83 THR CA C 83 57.957 57.957 61.910 -3.953 19707 9466 1 19 . 1 1 83 83 THR CB C 83 68.271 68.271 71.544 -3.273 19707 9467 1 19 . 1 1 83 83 THR H H 83 8.490 8.490 8.077 0.413 19707 9468 1 19 . 1 1 84 84 VAL N N 84 122.639 122.639 126.967 -4.328 19707 9469 1 19 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.831 -0.176 19707 9470 1 19 . 1 1 84 84 VAL C C 84 170.962 170.962 174.170 -3.208 19707 9471 1 19 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.619 -3.322 19707 9472 1 19 . 1 1 84 84 VAL CB C 84 32.224 32.224 33.717 -1.493 19707 9473 1 19 . 1 1 84 84 VAL H H 84 9.001 9.001 8.932 0.069 19707 9474 1 19 . 1 1 85 85 LEU N N 85 129.903 129.903 127.776 2.127 19707 9475 1 19 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.506 -0.114 19707 9476 1 19 . 1 1 85 85 LEU C C 85 172.346 172.346 174.685 -2.339 19707 9477 1 19 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.375 -2.578 19707 9478 1 19 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.905 -4.390 19707 9479 1 19 . 1 1 85 85 LEU H H 85 8.610 8.610 9.049 -0.439 19707 9480 1 19 . 1 1 86 86 VAL N N 86 122.778 122.778 123.641 -0.863 19707 9481 1 19 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.945 0.096 19707 9482 1 19 . 1 1 86 86 VAL C C 86 172.570 172.570 174.569 -1.999 19707 9483 1 19 . 1 1 86 86 VAL CA C 86 57.200 57.200 60.836 -3.635 19707 9484 1 19 . 1 1 86 86 VAL CB C 86 32.275 32.275 34.904 -2.629 19707 9485 1 19 . 1 1 86 86 VAL H H 86 9.228 9.228 9.083 0.145 19707 9486 1 19 . 1 1 87 87 GLU N N 87 120.437 120.437 125.990 -5.553 19707 9487 1 19 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.531 0.200 19707 9488 1 19 . 1 1 87 87 GLU C C 87 172.267 172.267 174.990 -2.723 19707 9489 1 19 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.570 -3.221 19707 9490 1 19 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.653 -2.529 19707 9491 1 19 . 1 1 87 87 GLU H H 87 8.851 8.851 9.247 -0.396 19707 9492 1 19 . 1 1 88 88 GLU N N 88 118.525 118.525 122.703 -4.178 19707 9493 1 19 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.791 0.210 19707 9494 1 19 . 1 1 88 88 GLU CA C 88 49.917 49.917 53.026 -3.110 19707 9495 1 19 . 1 1 88 88 GLU CB C 88 29.947 29.947 33.118 -3.171 19707 9496 1 19 . 1 1 88 88 GLU H H 88 8.380 8.380 8.651 -0.271 19707 9497 1 19 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.440 0.089 19707 9498 1 19 . 1 1 89 89 PRO C C 89 172.774 172.774 176.752 -3.978 19707 9499 1 19 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.050 -2.669 19707 9500 1 19 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.153 -2.819 19707 9501 1 20 . 1 1 2 2 SER N N 2 115.963 115.963 115.388 0.575 19707 9502 1 20 . 1 1 2 2 SER HA H 2 4.408 4.408 4.584 -0.176 19707 9503 1 20 . 1 1 2 2 SER C C 2 171.788 171.788 173.693 -1.905 19707 9504 1 20 . 1 1 2 2 SER CA C 2 55.870 55.870 58.041 -2.171 19707 9505 1 20 . 1 1 2 2 SER CB C 2 61.022 61.022 64.361 -3.339 19707 9506 1 20 . 1 1 2 2 SER H H 2 8.661 8.661 8.362 0.299 19707 9507 1 20 . 1 1 3 3 GLU N N 3 122.941 122.941 121.035 1.906 19707 9508 1 20 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.498 -0.178 19707 9509 1 20 . 1 1 3 3 GLU C C 3 173.817 173.817 175.548 -1.731 19707 9510 1 20 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.036 -2.082 19707 9511 1 20 . 1 1 3 3 GLU CB C 3 26.837 26.837 31.732 -4.895 19707 9512 1 20 . 1 1 3 3 GLU H H 3 8.706 8.706 8.526 0.180 19707 9513 1 20 . 1 1 4 4 THR N N 4 116.182 116.182 117.069 -0.887 19707 9514 1 20 . 1 1 4 4 THR HA H 4 4.233 4.233 4.490 -0.257 19707 9515 1 20 . 1 1 4 4 THR C C 4 171.719 171.719 174.502 -2.783 19707 9516 1 20 . 1 1 4 4 THR CA C 4 59.414 59.414 62.794 -3.381 19707 9517 1 20 . 1 1 4 4 THR CB C 4 67.009 67.009 68.399 -1.390 19707 9518 1 20 . 1 1 4 4 THR H H 4 8.165 8.165 8.477 -0.312 19707 9519 1 20 . 1 1 5 5 ARG N N 5 124.184 124.184 124.716 -0.532 19707 9520 1 20 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.655 -0.295 19707 9521 1 20 . 1 1 5 5 ARG C C 5 173.520 173.520 174.554 -1.034 19707 9522 1 20 . 1 1 5 5 ARG CA C 5 53.343 53.343 55.346 -2.003 19707 9523 1 20 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.574 -2.409 19707 9524 1 20 . 1 1 5 5 ARG H H 5 8.354 8.354 8.732 -0.378 19707 9525 1 20 . 1 1 6 6 THR N N 6 116.652 116.652 116.783 -0.131 19707 9526 1 20 . 1 1 6 6 THR HA H 6 4.263 4.263 4.592 -0.329 19707 9527 1 20 . 1 1 6 6 THR C C 6 171.784 171.784 173.963 -2.179 19707 9528 1 20 . 1 1 6 6 THR CA C 6 59.218 59.218 62.518 -3.300 19707 9529 1 20 . 1 1 6 6 THR CB C 6 67.213 67.213 69.392 -2.179 19707 9530 1 20 . 1 1 6 6 THR H H 6 8.224 8.224 8.277 -0.053 19707 9531 1 20 . 1 1 7 7 ILE N N 7 123.882 123.882 123.541 0.341 19707 9532 1 20 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.269 -0.131 19707 9533 1 20 . 1 1 7 7 ILE C C 7 173.572 173.572 176.286 -2.714 19707 9534 1 20 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.458 -1.976 19707 9535 1 20 . 1 1 7 7 ILE CB C 7 36.069 36.069 40.515 -4.446 19707 9536 1 20 . 1 1 7 7 ILE H H 7 8.247 8.247 8.223 0.024 19707 9537 1 20 . 1 1 8 8 SER N N 8 120.287 120.287 120.544 -0.257 19707 9538 1 20 . 1 1 8 8 SER HA H 8 4.445 4.445 4.581 -0.136 19707 9539 1 20 . 1 1 8 8 SER C C 8 171.926 171.926 174.867 -2.941 19707 9540 1 20 . 1 1 8 8 SER CA C 8 55.522 55.522 57.844 -2.322 19707 9541 1 20 . 1 1 8 8 SER CB C 8 61.073 61.073 62.798 -1.725 19707 9542 1 20 . 1 1 8 8 SER H H 8 8.402 8.402 8.582 -0.180 19707 9543 1 20 . 1 1 9 9 SER N N 9 118.425 118.425 118.342 0.083 19707 9544 1 20 . 1 1 9 9 SER HA H 9 4.525 4.525 4.300 0.225 19707 9545 1 20 . 1 1 9 9 SER C C 9 172.663 172.663 174.696 -2.033 19707 9546 1 20 . 1 1 9 9 SER CA C 9 55.897 55.897 59.389 -3.492 19707 9547 1 20 . 1 1 9 9 SER CB C 9 61.375 61.375 62.195 -0.820 19707 9548 1 20 . 1 1 9 9 SER H H 9 8.362 8.362 8.112 0.250 19707 9549 1 20 . 1 1 10 10 THR N N 10 115.676 115.676 112.027 3.649 19707 9550 1 20 . 1 1 10 10 THR HA H 10 4.232 4.232 4.454 -0.222 19707 9551 1 20 . 1 1 10 10 THR C C 10 173.070 173.070 175.723 -2.653 19707 9552 1 20 . 1 1 10 10 THR CA C 10 60.318 60.318 62.589 -2.271 19707 9553 1 20 . 1 1 10 10 THR CB C 10 67.205 67.205 69.310 -2.105 19707 9554 1 20 . 1 1 10 10 THR H H 10 8.274 8.274 7.984 0.290 19707 9555 1 20 . 1 1 11 11 ALA N N 11 124.726 124.726 124.352 0.374 19707 9556 1 20 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.148 -0.161 19707 9557 1 20 . 1 1 11 11 ALA C C 11 176.825 176.825 179.457 -2.632 19707 9558 1 20 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.020 -2.479 19707 9559 1 20 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.268 -2.379 19707 9560 1 20 . 1 1 11 11 ALA H H 11 8.347 8.347 8.194 0.152 19707 9561 1 20 . 1 1 12 12 GLN N N 12 117.915 117.915 117.354 0.561 19707 9562 1 20 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.130 -0.341 19707 9563 1 20 . 1 1 12 12 GLN C C 12 174.697 174.697 177.497 -2.800 19707 9564 1 20 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.804 -2.800 19707 9565 1 20 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.680 -2.455 19707 9566 1 20 . 1 1 12 12 GLN H H 12 8.194 8.194 8.234 -0.040 19707 9567 1 20 . 1 1 13 13 GLU N N 13 118.510 118.510 119.296 -0.786 19707 9568 1 20 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.125 -0.022 19707 9569 1 20 . 1 1 13 13 GLU C C 13 176.192 176.192 179.237 -3.045 19707 9570 1 20 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.866 -2.551 19707 9571 1 20 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.763 -3.730 19707 9572 1 20 . 1 1 13 13 GLU H H 13 7.917 7.917 7.761 0.156 19707 9573 1 20 . 1 1 14 14 ARG N N 14 118.193 118.193 119.569 -1.376 19707 9574 1 20 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.077 -0.109 19707 9575 1 20 . 1 1 14 14 ARG C C 14 176.764 176.764 178.554 -1.790 19707 9576 1 20 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.071 -1.788 19707 9577 1 20 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.600 -2.363 19707 9578 1 20 . 1 1 14 14 ARG H H 14 7.907 7.907 8.314 -0.407 19707 9579 1 20 . 1 1 15 15 VAL N N 15 117.991 117.991 114.446 3.545 19707 9580 1 20 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.872 0.031 19707 9581 1 20 . 1 1 15 15 VAL C C 15 174.922 174.922 177.427 -2.505 19707 9582 1 20 . 1 1 15 15 VAL CA C 15 62.831 62.831 64.610 -1.779 19707 9583 1 20 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.264 -2.541 19707 9584 1 20 . 1 1 15 15 VAL H H 15 7.658 7.658 7.366 0.292 19707 9585 1 20 . 1 1 16 16 ASP N N 16 124.314 124.314 121.139 3.175 19707 9586 1 20 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.434 -0.118 19707 9587 1 20 . 1 1 16 16 ASP C C 16 176.462 176.462 178.035 -1.573 19707 9588 1 20 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.487 -2.161 19707 9589 1 20 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.320 -4.651 19707 9590 1 20 . 1 1 16 16 ASP H H 16 8.291 8.291 8.218 0.073 19707 9591 1 20 . 1 1 17 17 LEU N N 17 120.212 120.212 119.571 0.641 19707 9592 1 20 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.149 -0.095 19707 9593 1 20 . 1 1 17 17 LEU C C 17 177.171 177.171 179.080 -1.909 19707 9594 1 20 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.600 -2.620 19707 9595 1 20 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.260 -2.415 19707 9596 1 20 . 1 1 17 17 LEU H H 17 8.172 8.172 7.564 0.608 19707 9597 1 20 . 1 1 18 18 GLU N N 18 120.587 120.587 118.880 1.707 19707 9598 1 20 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.920 0.273 19707 9599 1 20 . 1 1 18 18 GLU C C 18 175.997 175.997 178.678 -2.681 19707 9600 1 20 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.570 -3.468 19707 9601 1 20 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.744 -2.672 19707 9602 1 20 . 1 1 18 18 GLU H H 18 7.876 7.876 7.873 0.003 19707 9603 1 20 . 1 1 19 19 ALA N N 19 121.800 121.800 122.879 -1.079 19707 9604 1 20 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.093 -0.302 19707 9605 1 20 . 1 1 19 19 ALA C C 19 175.708 175.708 179.633 -3.925 19707 9606 1 20 . 1 1 19 19 ALA CA C 19 52.852 52.852 55.013 -2.161 19707 9607 1 20 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.469 -4.315 19707 9608 1 20 . 1 1 19 19 ALA H H 19 7.792 7.792 7.460 0.332 19707 9609 1 20 . 1 1 20 20 VAL N N 20 118.680 118.680 119.149 -0.469 19707 9610 1 20 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.683 -0.383 19707 9611 1 20 . 1 1 20 20 VAL C C 20 176.276 176.276 178.066 -1.790 19707 9612 1 20 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.327 -2.520 19707 9613 1 20 . 1 1 20 20 VAL CB C 20 29.551 29.551 30.974 -1.423 19707 9614 1 20 . 1 1 20 20 VAL H H 20 7.712 7.712 7.953 -0.241 19707 9615 1 20 . 1 1 21 21 ARG N N 21 121.935 121.935 121.064 0.871 19707 9616 1 20 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.069 -0.074 19707 9617 1 20 . 1 1 21 21 ARG C C 21 176.828 176.828 178.767 -1.939 19707 9618 1 20 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.695 -2.035 19707 9619 1 20 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.625 -2.335 19707 9620 1 20 . 1 1 21 21 ARG H H 21 8.444 8.444 8.427 0.017 19707 9621 1 20 . 1 1 22 22 LEU N N 22 119.327 119.327 119.502 -0.175 19707 9622 1 20 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.105 -0.110 19707 9623 1 20 . 1 1 22 22 LEU C C 22 175.664 175.664 178.615 -2.951 19707 9624 1 20 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.151 -3.283 19707 9625 1 20 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.553 -2.418 19707 9626 1 20 . 1 1 22 22 LEU H H 22 8.248 8.248 8.299 -0.051 19707 9627 1 20 . 1 1 23 23 ALA N N 23 121.202 121.202 122.347 -1.145 19707 9628 1 20 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.927 -0.192 19707 9629 1 20 . 1 1 23 23 ALA C C 23 175.492 175.492 179.427 -3.935 19707 9630 1 20 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.304 -2.235 19707 9631 1 20 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.957 -3.890 19707 9632 1 20 . 1 1 23 23 ALA H H 23 8.392 8.392 8.626 -0.234 19707 9633 1 20 . 1 1 24 24 SER N N 24 112.377 112.377 115.081 -2.704 19707 9634 1 20 . 1 1 24 24 SER HA H 24 4.214 4.214 4.305 -0.091 19707 9635 1 20 . 1 1 24 24 SER C C 24 174.773 174.773 176.430 -1.657 19707 9636 1 20 . 1 1 24 24 SER CA C 24 59.258 59.258 62.326 -3.068 19707 9637 1 20 . 1 1 24 24 SER CB C 24 60.149 60.149 63.097 -2.948 19707 9638 1 20 . 1 1 24 24 SER H H 24 7.690 7.690 8.080 -0.390 19707 9639 1 20 . 1 1 25 25 ILE N N 25 123.886 123.886 122.751 1.135 19707 9640 1 20 . 1 1 25 25 ILE HA H 25 3.842 3.842 3.996 -0.154 19707 9641 1 20 . 1 1 25 25 ILE C C 25 176.487 176.487 178.168 -1.681 19707 9642 1 20 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.099 -0.106 19707 9643 1 20 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.372 -0.440 19707 9644 1 20 . 1 1 25 25 ILE H H 25 7.837 7.837 8.222 -0.385 19707 9645 1 20 . 1 1 26 26 VAL N N 26 122.538 122.538 122.267 0.271 19707 9646 1 20 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.553 -0.165 19707 9647 1 20 . 1 1 26 26 VAL C C 26 174.624 174.624 177.929 -3.305 19707 9648 1 20 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.588 -2.673 19707 9649 1 20 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.470 -3.575 19707 9650 1 20 . 1 1 26 26 VAL H H 26 8.804 8.804 8.771 0.033 19707 9651 1 20 . 1 1 27 27 ASP N N 27 120.433 120.433 120.775 -0.342 19707 9652 1 20 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.332 -0.168 19707 9653 1 20 . 1 1 27 27 ASP C C 27 174.966 174.966 179.018 -4.052 19707 9654 1 20 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.781 -2.452 19707 9655 1 20 . 1 1 27 27 ASP CB C 27 37.854 37.854 39.938 -2.084 19707 9656 1 20 . 1 1 27 27 ASP H H 27 8.719 8.719 8.639 0.080 19707 9657 1 20 . 1 1 28 28 SER N N 28 112.397 112.397 115.885 -3.488 19707 9658 1 20 . 1 1 28 28 SER HA H 28 4.073 4.073 4.214 -0.141 19707 9659 1 20 . 1 1 28 28 SER C C 28 174.405 174.405 176.685 -2.280 19707 9660 1 20 . 1 1 28 28 SER CA C 28 59.115 59.115 61.932 -2.817 19707 9661 1 20 . 1 1 28 28 SER CB C 28 60.125 60.125 63.114 -2.990 19707 9662 1 20 . 1 1 28 28 SER H H 28 7.599 7.599 8.437 -0.838 19707 9663 1 20 . 1 1 29 29 ARG N N 29 123.945 123.945 122.341 1.604 19707 9664 1 20 . 1 1 29 29 ARG HA H 29 4.027 4.027 4.022 0.005 19707 9665 1 20 . 1 1 29 29 ARG C C 29 175.902 175.902 178.133 -2.231 19707 9666 1 20 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.883 -3.608 19707 9667 1 20 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.257 -1.517 19707 9668 1 20 . 1 1 29 29 ARG H H 29 7.769 7.769 7.772 -0.003 19707 9669 1 20 . 1 1 30 30 LEU N N 30 121.580 121.580 120.535 1.045 19707 9670 1 20 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.997 -0.248 19707 9671 1 20 . 1 1 30 30 LEU C C 30 177.474 177.474 179.660 -2.186 19707 9672 1 20 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.849 -2.536 19707 9673 1 20 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.832 -2.803 19707 9674 1 20 . 1 1 30 30 LEU H H 30 8.665 8.665 8.385 0.280 19707 9675 1 20 . 1 1 31 31 ILE N N 31 119.330 119.330 118.269 1.061 19707 9676 1 20 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.803 -0.112 19707 9677 1 20 . 1 1 31 31 ILE C C 31 175.341 175.341 177.906 -2.565 19707 9678 1 20 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.142 -2.631 19707 9679 1 20 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.823 -2.256 19707 9680 1 20 . 1 1 31 31 ILE H H 31 8.226 8.226 8.503 -0.277 19707 9681 1 20 . 1 1 32 32 GLY N N 32 106.092 106.092 106.105 -0.013 19707 9682 1 20 . 1 1 32 32 GLY C C 32 172.413 172.413 175.224 -2.811 19707 9683 1 20 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.839 -3.342 19707 9684 1 20 . 1 1 32 32 GLY H H 32 7.767 7.767 7.837 -0.070 19707 9685 1 20 . 1 1 33 33 THR N N 33 110.966 110.966 112.855 -1.889 19707 9686 1 20 . 1 1 33 33 THR HA H 33 4.455 4.455 4.368 0.087 19707 9687 1 20 . 1 1 33 33 THR C C 33 172.714 172.714 174.897 -2.183 19707 9688 1 20 . 1 1 33 33 THR CA C 33 60.032 60.032 62.842 -2.809 19707 9689 1 20 . 1 1 33 33 THR CB C 33 68.287 68.287 70.105 -1.818 19707 9690 1 20 . 1 1 33 33 THR H H 33 8.102 8.102 7.881 0.221 19707 9691 1 20 . 1 1 34 34 GLY N N 34 110.320 110.320 111.014 -0.694 19707 9692 1 20 . 1 1 34 34 GLY C C 34 170.505 170.505 173.589 -3.084 19707 9693 1 20 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.099 -2.516 19707 9694 1 20 . 1 1 34 34 GLY H H 34 8.072 8.072 8.146 -0.074 19707 9695 1 20 . 1 1 35 35 SER N N 35 112.944 112.944 115.487 -2.543 19707 9696 1 20 . 1 1 35 35 SER HA H 35 4.385 4.385 4.893 -0.508 19707 9697 1 20 . 1 1 35 35 SER C C 35 169.537 169.537 172.497 -2.960 19707 9698 1 20 . 1 1 35 35 SER CA C 35 54.794 54.794 57.887 -3.093 19707 9699 1 20 . 1 1 35 35 SER CB C 35 62.029 62.029 66.257 -4.228 19707 9700 1 20 . 1 1 35 35 SER H H 35 7.719 7.719 7.702 0.017 19707 9701 1 20 . 1 1 36 36 VAL N N 36 118.566 118.566 121.648 -3.082 19707 9702 1 20 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.229 -0.196 19707 9703 1 20 . 1 1 36 36 VAL C C 36 169.876 169.876 173.736 -3.860 19707 9704 1 20 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.050 -1.485 19707 9705 1 20 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.325 -2.373 19707 9706 1 20 . 1 1 36 36 VAL H H 36 8.490 8.490 8.162 0.328 19707 9707 1 20 . 1 1 37 37 ASP N N 37 121.640 121.640 124.983 -3.343 19707 9708 1 20 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.931 -0.129 19707 9709 1 20 . 1 1 37 37 ASP C C 37 172.806 172.806 176.432 -3.626 19707 9710 1 20 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.957 -3.914 19707 9711 1 20 . 1 1 37 37 ASP CB C 37 40.206 40.206 44.282 -4.076 19707 9712 1 20 . 1 1 37 37 ASP H H 37 7.195 7.195 8.325 -1.129 19707 9713 1 20 . 1 1 38 38 GLU N N 38 120.018 120.018 121.465 -1.447 19707 9714 1 20 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.884 -0.227 19707 9715 1 20 . 1 1 38 38 GLU C C 38 174.753 174.753 177.574 -2.821 19707 9716 1 20 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.355 -2.863 19707 9717 1 20 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.776 -3.697 19707 9718 1 20 . 1 1 38 38 GLU H H 38 8.908 8.908 8.931 -0.023 19707 9719 1 20 . 1 1 39 39 ASP N N 39 118.668 118.668 117.551 1.117 19707 9720 1 20 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.491 -0.245 19707 9721 1 20 . 1 1 39 39 ASP C C 39 175.393 175.393 177.535 -2.142 19707 9722 1 20 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.260 -1.396 19707 9723 1 20 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.531 -3.561 19707 9724 1 20 . 1 1 39 39 ASP H H 39 8.242 8.242 8.584 -0.342 19707 9725 1 20 . 1 1 40 40 PHE N N 40 119.851 119.851 118.189 1.662 19707 9726 1 20 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.410 -0.206 19707 9727 1 20 . 1 1 40 40 PHE C C 40 174.929 174.929 176.497 -1.568 19707 9728 1 20 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.622 -2.451 19707 9729 1 20 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.040 -3.207 19707 9730 1 20 . 1 1 40 40 PHE H H 40 8.037 8.037 7.865 0.172 19707 9731 1 20 . 1 1 41 41 LEU N N 41 117.882 117.882 117.845 0.037 19707 9732 1 20 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.269 -0.747 19707 9733 1 20 . 1 1 41 41 LEU C C 41 175.938 175.938 178.782 -2.844 19707 9734 1 20 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.882 -2.022 19707 9735 1 20 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.447 -3.216 19707 9736 1 20 . 1 1 41 41 LEU H H 41 7.816 7.816 7.712 0.104 19707 9737 1 20 . 1 1 42 42 ARG N N 42 118.360 118.360 118.837 -0.477 19707 9738 1 20 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.001 -0.261 19707 9739 1 20 . 1 1 42 42 ARG C C 42 175.435 175.435 176.925 -1.490 19707 9740 1 20 . 1 1 42 42 ARG CA C 42 56.971 56.971 58.997 -2.026 19707 9741 1 20 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.945 -2.681 19707 9742 1 20 . 1 1 42 42 ARG H H 42 8.540 8.540 8.050 0.490 19707 9743 1 20 . 1 1 43 43 GLU N N 43 114.947 114.947 116.600 -1.653 19707 9744 1 20 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.227 -0.177 19707 9745 1 20 . 1 1 43 43 GLU C C 43 174.518 174.518 177.299 -2.781 19707 9746 1 20 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.440 -2.869 19707 9747 1 20 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.247 -3.206 19707 9748 1 20 . 1 1 43 43 GLU H H 43 7.223 7.223 8.259 -1.036 19707 9749 1 20 . 1 1 44 44 GLN N N 44 114.109 114.109 117.087 -2.978 19707 9750 1 20 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.367 -0.261 19707 9751 1 20 . 1 1 44 44 GLN C C 44 173.777 173.777 177.739 -3.962 19707 9752 1 20 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.682 -3.501 19707 9753 1 20 . 1 1 44 44 GLN CB C 44 25.870 25.870 30.032 -4.162 19707 9754 1 20 . 1 1 44 44 GLN H H 44 7.372 7.372 8.014 -0.642 19707 9755 1 20 . 1 1 45 45 ILE N N 45 117.470 117.470 114.999 2.471 19707 9756 1 20 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.811 0.137 19707 9757 1 20 . 1 1 45 45 ILE C C 45 172.305 172.305 176.200 -3.895 19707 9758 1 20 . 1 1 45 45 ILE CA C 45 58.505 58.505 63.495 -4.990 19707 9759 1 20 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.778 -2.078 19707 9760 1 20 . 1 1 45 45 ILE H H 45 7.235 7.235 7.328 -0.093 19707 9761 1 20 . 1 1 46 46 ARG N N 46 122.996 122.996 114.790 8.206 19707 9762 1 20 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.893 0.297 19707 9763 1 20 . 1 1 46 46 ARG C C 46 172.992 172.992 175.206 -2.214 19707 9764 1 20 . 1 1 46 46 ARG CA C 46 53.761 53.761 57.811 -4.050 19707 9765 1 20 . 1 1 46 46 ARG CB C 46 27.952 27.952 27.851 0.101 19707 9766 1 20 . 1 1 46 46 ARG H H 46 8.336 8.336 8.311 0.025 19707 9767 1 20 . 1 1 47 47 ASP N N 47 118.676 118.676 114.259 4.417 19707 9768 1 20 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.511 -0.063 19707 9769 1 20 . 1 1 47 47 ASP C C 47 172.520 172.520 174.651 -2.131 19707 9770 1 20 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.369 -2.479 19707 9771 1 20 . 1 1 47 47 ASP CB C 47 37.657 37.657 41.238 -3.581 19707 9772 1 20 . 1 1 47 47 ASP H H 47 8.313 8.313 7.904 0.409 19707 9773 1 20 . 1 1 48 48 ALA N N 48 120.922 120.922 123.327 -2.405 19707 9774 1 20 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.274 0.095 19707 9775 1 20 . 1 1 48 48 ALA C C 48 174.295 174.295 177.802 -3.507 19707 9776 1 20 . 1 1 48 48 ALA CA C 48 49.637 49.637 52.682 -3.045 19707 9777 1 20 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.298 -3.084 19707 9778 1 20 . 1 1 48 48 ALA H H 48 7.824 7.824 7.656 0.168 19707 9779 1 20 . 1 1 49 49 ARG N N 49 118.644 118.644 123.635 -4.991 19707 9780 1 20 . 1 1 49 49 ARG HA H 49 4.342 4.342 3.873 0.469 19707 9781 1 20 . 1 1 49 49 ARG C C 49 172.504 172.504 176.236 -3.732 19707 9782 1 20 . 1 1 49 49 ARG CA C 49 53.909 53.909 58.559 -4.650 19707 9783 1 20 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.474 -2.131 19707 9784 1 20 . 1 1 49 49 ARG H H 49 7.911 7.911 8.448 -0.537 19707 9785 1 20 . 1 1 50 50 TYR N N 50 119.470 119.470 113.942 5.528 19707 9786 1 20 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.077 0.214 19707 9787 1 20 . 1 1 50 50 TYR C C 50 170.470 170.470 174.327 -3.857 19707 9788 1 20 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.016 -1.748 19707 9789 1 20 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.386 -0.873 19707 9790 1 20 . 1 1 50 50 TYR H H 50 7.639 7.639 8.035 -0.396 19707 9791 1 20 . 1 1 51 51 ALA N N 51 127.418 127.418 125.915 1.503 19707 9792 1 20 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.182 0.039 19707 9793 1 20 . 1 1 51 51 ALA C C 51 171.328 171.328 175.458 -4.130 19707 9794 1 20 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.264 -2.831 19707 9795 1 20 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.474 -1.162 19707 9796 1 20 . 1 1 51 51 ALA H H 51 8.222 8.222 8.798 -0.576 19707 9797 1 20 . 1 1 52 52 VAL N N 52 117.832 117.832 121.668 -3.836 19707 9798 1 20 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.150 -0.483 19707 9799 1 20 . 1 1 52 52 VAL C C 52 172.436 172.436 174.339 -1.903 19707 9800 1 20 . 1 1 52 52 VAL CA C 52 57.757 57.757 60.638 -2.881 19707 9801 1 20 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.242 -4.139 19707 9802 1 20 . 1 1 52 52 VAL H H 52 8.753 8.753 9.067 -0.314 19707 9803 1 20 . 1 1 53 53 ILE N N 53 128.027 128.027 125.578 2.449 19707 9804 1 20 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.626 0.216 19707 9805 1 20 . 1 1 53 53 ILE C C 53 172.110 172.110 174.584 -2.474 19707 9806 1 20 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.189 -2.436 19707 9807 1 20 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.206 -3.047 19707 9808 1 20 . 1 1 53 53 ILE H H 53 9.261 9.261 9.002 0.259 19707 9809 1 20 . 1 1 54 54 ARG N N 54 127.885 127.885 126.393 1.492 19707 9810 1 20 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.663 0.090 19707 9811 1 20 . 1 1 54 54 ARG C C 54 172.285 172.285 174.517 -2.232 19707 9812 1 20 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.925 -1.665 19707 9813 1 20 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.527 -2.635 19707 9814 1 20 . 1 1 54 54 ARG H H 54 8.686 8.686 8.927 -0.241 19707 9815 1 20 . 1 1 55 55 ILE N N 55 129.907 129.907 123.547 6.360 19707 9816 1 20 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.370 -0.217 19707 9817 1 20 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.456 -2.861 19707 9818 1 20 . 1 1 55 55 ILE CB C 55 37.613 37.613 38.900 -1.286 19707 9819 1 20 . 1 1 55 55 ILE H H 55 9.292 9.292 8.234 1.058 19707 9820 1 20 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.400 -0.208 19707 9821 1 20 . 1 1 56 56 PRO C C 56 174.787 174.787 177.767 -2.980 19707 9822 1 20 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.968 -2.234 19707 9823 1 20 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.686 -2.773 19707 9824 1 20 . 1 1 57 57 GLY N N 57 111.828 111.828 111.306 0.522 19707 9825 1 20 . 1 1 57 57 GLY C C 57 171.039 171.039 173.652 -2.613 19707 9826 1 20 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.886 -2.069 19707 9827 1 20 . 1 1 57 57 GLY H H 57 8.708 8.708 8.720 -0.012 19707 9828 1 20 . 1 1 58 58 GLN N N 58 118.457 118.457 119.737 -1.280 19707 9829 1 20 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.850 0.050 19707 9830 1 20 . 1 1 58 58 GLN CA C 58 50.272 50.272 52.938 -2.666 19707 9831 1 20 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.821 -2.667 19707 9832 1 20 . 1 1 58 58 GLN H H 58 7.909 7.909 7.569 0.340 19707 9833 1 20 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.425 0.011 19707 9834 1 20 . 1 1 59 59 PRO C C 59 174.607 174.607 176.462 -1.855 19707 9835 1 20 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.847 -2.792 19707 9836 1 20 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.252 -3.075 19707 9837 1 20 . 1 1 60 60 VAL N N 60 122.695 122.695 121.601 1.094 19707 9838 1 20 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.001 -0.046 19707 9839 1 20 . 1 1 60 60 VAL C C 60 172.403 172.403 175.754 -3.351 19707 9840 1 20 . 1 1 60 60 VAL CA C 60 60.895 60.895 63.038 -2.143 19707 9841 1 20 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.576 -2.934 19707 9842 1 20 . 1 1 60 60 VAL H H 60 8.364 8.364 8.230 0.134 19707 9843 1 20 . 1 1 61 61 VAL N N 61 126.097 126.097 129.182 -3.085 19707 9844 1 20 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.308 -0.008 19707 9845 1 20 . 1 1 61 61 VAL C C 61 170.891 170.891 174.605 -3.714 19707 9846 1 20 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.983 -3.169 19707 9847 1 20 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.531 -3.333 19707 9848 1 20 . 1 1 61 61 VAL H H 61 8.023 8.023 8.302 -0.279 19707 9849 1 20 . 1 1 62 62 GLU N N 62 126.097 126.097 125.768 0.329 19707 9850 1 20 . 1 1 62 62 GLU HA H 62 5.159 5.159 4.934 0.225 19707 9851 1 20 . 1 1 62 62 GLU C C 62 172.252 172.252 175.352 -3.100 19707 9852 1 20 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.126 -3.586 19707 9853 1 20 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.105 -1.805 19707 9854 1 20 . 1 1 62 62 GLU H H 62 8.591 8.591 8.472 0.119 19707 9855 1 20 . 1 1 63 63 VAL N N 63 120.374 120.374 123.731 -3.357 19707 9856 1 20 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.298 0.095 19707 9857 1 20 . 1 1 63 63 VAL C C 63 171.040 171.040 176.701 -5.661 19707 9858 1 20 . 1 1 63 63 VAL CA C 63 57.833 57.833 62.563 -4.730 19707 9859 1 20 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.249 0.328 19707 9860 1 20 . 1 1 63 63 VAL H H 63 8.732 8.732 8.902 -0.170 19707 9861 1 20 . 1 1 64 64 GLY N N 64 109.935 109.935 115.278 -5.343 19707 9862 1 20 . 1 1 64 64 GLY C C 64 171.656 171.656 174.017 -2.361 19707 9863 1 20 . 1 1 64 64 GLY CA C 64 41.177 41.177 45.840 -4.663 19707 9864 1 20 . 1 1 64 64 GLY H H 64 8.259 8.259 8.371 -0.112 19707 9865 1 20 . 1 1 65 65 THR N N 65 115.478 115.478 115.505 -0.027 19707 9866 1 20 . 1 1 65 65 THR HA H 65 4.342 4.342 4.340 0.002 19707 9867 1 20 . 1 1 65 65 THR C C 65 170.663 170.663 171.881 -1.218 19707 9868 1 20 . 1 1 65 65 THR CA C 65 58.357 58.357 60.132 -1.775 19707 9869 1 20 . 1 1 65 65 THR CB C 65 67.923 67.923 71.601 -3.678 19707 9870 1 20 . 1 1 65 65 THR H H 65 8.123 8.123 7.627 0.496 19707 9871 1 20 . 1 1 66 66 LYS N N 66 130.775 130.775 123.722 7.053 19707 9872 1 20 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.206 -1.276 19707 9873 1 20 . 1 1 66 66 LYS CA C 66 52.190 52.190 53.918 -1.728 19707 9874 1 20 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.810 -3.120 19707 9875 1 20 . 1 1 66 66 LYS H H 66 8.472 8.472 8.290 0.182 19707 9876 1 20 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.550 -0.139 19707 9877 1 20 . 1 1 67 67 PRO C C 67 173.211 173.211 176.960 -3.749 19707 9878 1 20 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.403 -2.837 19707 9879 1 20 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.678 -3.276 19707 9880 1 20 . 1 1 68 68 THR N N 68 111.983 111.983 115.219 -3.236 19707 9881 1 20 . 1 1 68 68 THR HA H 68 4.277 4.277 4.243 0.034 19707 9882 1 20 . 1 1 68 68 THR C C 68 171.720 171.720 175.609 -3.889 19707 9883 1 20 . 1 1 68 68 THR CA C 68 58.193 58.193 62.865 -4.672 19707 9884 1 20 . 1 1 68 68 THR CB C 68 67.723 67.723 69.223 -1.500 19707 9885 1 20 . 1 1 68 68 THR H H 68 8.091 8.091 8.119 -0.028 19707 9886 1 20 . 1 1 69 69 GLY N N 69 109.918 109.918 108.841 1.077 19707 9887 1 20 . 1 1 69 69 GLY C C 69 170.783 170.783 174.376 -3.593 19707 9888 1 20 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.738 -2.682 19707 9889 1 20 . 1 1 69 69 GLY H H 69 8.119 8.119 8.038 0.081 19707 9890 1 20 . 1 1 70 70 ASP N N 70 123.294 123.294 125.161 -1.867 19707 9891 1 20 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.870 -0.321 19707 9892 1 20 . 1 1 70 70 ASP C C 70 173.651 173.651 175.167 -1.516 19707 9893 1 20 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.730 -2.869 19707 9894 1 20 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.630 -1.897 19707 9895 1 20 . 1 1 70 70 ASP H H 70 8.444 8.444 8.702 -0.258 19707 9896 1 20 . 1 1 71 71 VAL N N 71 117.772 117.772 115.043 2.729 19707 9897 1 20 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.121 -0.414 19707 9898 1 20 . 1 1 71 71 VAL C C 71 172.992 172.992 174.321 -1.329 19707 9899 1 20 . 1 1 71 71 VAL CA C 71 57.376 57.376 58.908 -1.532 19707 9900 1 20 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.473 -2.451 19707 9901 1 20 . 1 1 71 71 VAL H H 71 8.173 8.173 7.905 0.268 19707 9902 1 20 . 1 1 72 72 LEU N N 72 123.435 123.435 122.588 0.847 19707 9903 1 20 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.601 0.035 19707 9904 1 20 . 1 1 72 72 LEU C C 72 173.189 173.189 175.954 -2.765 19707 9905 1 20 . 1 1 72 72 LEU CA C 72 51.207 51.207 53.942 -2.735 19707 9906 1 20 . 1 1 72 72 LEU CB C 72 41.638 41.638 42.996 -1.359 19707 9907 1 20 . 1 1 72 72 LEU H H 72 8.859 8.859 8.938 -0.079 19707 9908 1 20 . 1 1 73 73 GLN N N 73 119.520 119.520 123.044 -3.524 19707 9909 1 20 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.132 0.213 19707 9910 1 20 . 1 1 73 73 GLN C C 73 172.249 172.249 175.963 -3.714 19707 9911 1 20 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.612 -3.279 19707 9912 1 20 . 1 1 73 73 GLN CB C 73 29.770 29.770 30.508 -0.738 19707 9913 1 20 . 1 1 73 73 GLN H H 73 9.196 9.196 8.309 0.887 19707 9914 1 20 . 1 1 74 74 GLY N N 74 113.513 113.513 112.023 1.490 19707 9915 1 20 . 1 1 74 74 GLY C C 74 169.072 169.072 172.067 -2.995 19707 9916 1 20 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.926 -2.629 19707 9917 1 20 . 1 1 74 74 GLY H H 74 9.373 9.373 9.059 0.314 19707 9918 1 20 . 1 1 75 75 ARG N N 75 122.479 122.479 123.611 -1.132 19707 9919 1 20 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.286 0.216 19707 9920 1 20 . 1 1 75 75 ARG C C 75 172.348 172.348 174.017 -1.669 19707 9921 1 20 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.784 -4.026 19707 9922 1 20 . 1 1 75 75 ARG CB C 75 31.818 31.818 33.858 -2.040 19707 9923 1 20 . 1 1 75 75 ARG H H 75 8.615 8.615 8.249 0.366 19707 9924 1 20 . 1 1 76 76 ALA N N 76 122.346 122.346 127.780 -5.434 19707 9925 1 20 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.757 -0.221 19707 9926 1 20 . 1 1 76 76 ALA C C 76 172.704 172.704 174.925 -2.221 19707 9927 1 20 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.244 -2.217 19707 9928 1 20 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.727 -2.702 19707 9929 1 20 . 1 1 76 76 ALA H H 76 8.590 8.590 9.067 -0.477 19707 9930 1 20 . 1 1 77 77 THR N N 77 116.961 116.961 115.235 1.726 19707 9931 1 20 . 1 1 77 77 THR HA H 77 4.988 4.988 5.001 -0.013 19707 9932 1 20 . 1 1 77 77 THR C C 77 172.800 172.800 174.450 -1.650 19707 9933 1 20 . 1 1 77 77 THR CA C 77 58.344 58.344 61.852 -3.508 19707 9934 1 20 . 1 1 77 77 THR CB C 77 67.712 67.712 71.271 -3.559 19707 9935 1 20 . 1 1 77 77 THR H H 77 8.491 8.491 8.254 0.237 19707 9936 1 20 . 1 1 78 78 GLY N N 78 111.103 111.103 112.679 -1.576 19707 9937 1 20 . 1 1 78 78 GLY C C 78 172.567 172.567 175.006 -2.439 19707 9938 1 20 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.940 -2.631 19707 9939 1 20 . 1 1 78 78 GLY H H 78 8.649 8.649 9.441 -0.792 19707 9940 1 20 . 1 1 79 79 GLU N N 79 123.423 123.423 120.021 3.402 19707 9941 1 20 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.191 -0.195 19707 9942 1 20 . 1 1 79 79 GLU C C 79 175.466 175.466 177.418 -1.952 19707 9943 1 20 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.307 -2.848 19707 9944 1 20 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.724 -3.657 19707 9945 1 20 . 1 1 79 79 GLU H H 79 10.375 10.375 9.042 1.333 19707 9946 1 20 . 1 1 80 80 GLU N N 80 113.846 113.846 117.292 -3.446 19707 9947 1 20 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.414 -0.056 19707 9948 1 20 . 1 1 80 80 GLU C C 80 173.293 173.293 177.017 -3.724 19707 9949 1 20 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.706 -3.930 19707 9950 1 20 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.337 -4.606 19707 9951 1 20 . 1 1 80 80 GLU H H 80 7.679 7.679 7.852 -0.173 19707 9952 1 20 . 1 1 81 81 GLY N N 81 105.493 105.493 109.059 -3.566 19707 9953 1 20 . 1 1 81 81 GLY C C 81 170.427 170.427 174.318 -3.891 19707 9954 1 20 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.337 -2.725 19707 9955 1 20 . 1 1 81 81 GLY H H 81 7.476 7.476 8.060 -0.584 19707 9956 1 20 . 1 1 82 82 GLU N N 82 122.160 122.160 118.870 3.290 19707 9957 1 20 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.454 0.500 19707 9958 1 20 . 1 1 82 82 GLU C C 82 171.004 171.004 175.461 -4.457 19707 9959 1 20 . 1 1 82 82 GLU CA C 82 51.321 51.321 54.805 -3.484 19707 9960 1 20 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.323 -5.256 19707 9961 1 20 . 1 1 82 82 GLU H H 82 9.585 9.585 7.858 1.727 19707 9962 1 20 . 1 1 83 83 THR N N 83 114.756 114.756 115.155 -0.399 19707 9963 1 20 . 1 1 83 83 THR HA H 83 4.990 4.990 5.120 -0.130 19707 9964 1 20 . 1 1 83 83 THR C C 83 170.909 170.909 173.034 -2.125 19707 9965 1 20 . 1 1 83 83 THR CA C 83 57.957 57.957 61.522 -3.565 19707 9966 1 20 . 1 1 83 83 THR CB C 83 68.271 68.271 71.350 -3.079 19707 9967 1 20 . 1 1 83 83 THR H H 83 8.490 8.490 7.764 0.726 19707 9968 1 20 . 1 1 84 84 VAL N N 84 122.639 122.639 126.625 -3.986 19707 9969 1 20 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.801 -0.146 19707 9970 1 20 . 1 1 84 84 VAL C C 84 170.962 170.962 174.115 -3.153 19707 9971 1 20 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.264 -2.967 19707 9972 1 20 . 1 1 84 84 VAL CB C 84 32.224 32.224 33.535 -1.311 19707 9973 1 20 . 1 1 84 84 VAL H H 84 9.001 9.001 8.765 0.236 19707 9974 1 20 . 1 1 85 85 LEU N N 85 129.903 129.903 128.883 1.020 19707 9975 1 20 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.424 -0.032 19707 9976 1 20 . 1 1 85 85 LEU C C 85 172.346 172.346 174.568 -2.222 19707 9977 1 20 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.214 -2.417 19707 9978 1 20 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.764 -4.249 19707 9979 1 20 . 1 1 85 85 LEU H H 85 8.610 8.610 8.978 -0.368 19707 9980 1 20 . 1 1 86 86 VAL N N 86 122.778 122.778 124.266 -1.488 19707 9981 1 20 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.882 0.159 19707 9982 1 20 . 1 1 86 86 VAL C C 86 172.570 172.570 174.618 -2.048 19707 9983 1 20 . 1 1 86 86 VAL CA C 86 57.200 57.200 61.240 -4.040 19707 9984 1 20 . 1 1 86 86 VAL CB C 86 32.275 32.275 34.856 -2.581 19707 9985 1 20 . 1 1 86 86 VAL H H 86 9.228 9.228 9.009 0.219 19707 9986 1 20 . 1 1 87 87 GLU N N 87 120.437 120.437 126.465 -6.028 19707 9987 1 20 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.595 0.136 19707 9988 1 20 . 1 1 87 87 GLU C C 87 172.267 172.267 175.107 -2.840 19707 9989 1 20 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.429 -3.080 19707 9990 1 20 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.376 -2.252 19707 9991 1 20 . 1 1 87 87 GLU H H 87 8.851 8.851 9.288 -0.437 19707 9992 1 20 . 1 1 88 88 GLU N N 88 118.525 118.525 121.103 -2.578 19707 9993 1 20 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.688 0.313 19707 9994 1 20 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.752 -2.835 19707 9995 1 20 . 1 1 88 88 GLU CB C 88 29.947 29.947 31.144 -1.197 19707 9996 1 20 . 1 1 88 88 GLU H H 88 8.380 8.380 8.279 0.101 19707 9997 1 20 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.553 -0.024 19707 9998 1 20 . 1 1 89 89 PRO C C 89 172.774 172.774 176.743 -3.969 19707 9999 1 20 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.042 -2.661 19707 10000 1 20 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.167 -2.833 19707 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 84 2.578 0.043 2.593 19707 2 1 1 "Average Difference" HA 96 0.305 0.083 0.295 19707 3 1 1 "Average Difference" C 84 2.851 2.695 0.935 19707 4 1 1 "Average Difference" CA 88 2.879 2.734 0.905 19707 5 1 1 "Average Difference" CB 80 3.034 2.840 1.073 19707 6 1 1 "Average Difference" HN 84 0.451 -0.030 0.453 19707 7 1 2 "Average Difference" N 84 2.638 0.222 2.645 19707 8 1 2 "Average Difference" HA 96 0.296 0.068 0.290 19707 9 1 2 "Average Difference" C 84 2.872 2.719 0.931 19707 10 1 2 "Average Difference" CA 88 2.879 2.764 0.810 19707 11 1 2 "Average Difference" CB 80 2.949 2.714 1.160 19707 12 1 2 "Average Difference" HN 84 0.419 -0.021 0.421 19707 13 1 3 "Average Difference" N 84 2.505 0.254 2.507 19707 14 1 3 "Average Difference" HA 96 0.304 0.067 0.298 19707 15 1 3 "Average Difference" C 84 2.907 2.771 0.881 19707 16 1 3 "Average Difference" CA 88 2.952 2.825 0.860 19707 17 1 3 "Average Difference" CB 80 2.948 2.765 1.028 19707 18 1 3 "Average Difference" HN 84 0.433 -0.014 0.435 19707 19 1 4 "Average Difference" N 84 2.659 0.024 2.675 19707 20 1 4 "Average Difference" HA 96 0.301 0.075 0.293 19707 21 1 4 "Average Difference" C 84 2.878 2.740 0.885 19707 22 1 4 "Average Difference" CA 88 2.911 2.771 0.895 19707 23 1 4 "Average Difference" CB 80 2.968 2.774 1.060 19707 24 1 4 "Average Difference" HN 84 0.449 -0.008 0.452 19707 25 1 5 "Average Difference" N 84 2.446 -0.023 2.461 19707 26 1 5 "Average Difference" HA 96 0.297 0.060 0.293 19707 27 1 5 "Average Difference" C 84 2.845 2.694 0.921 19707 28 1 5 "Average Difference" CA 88 2.960 2.821 0.903 19707 29 1 5 "Average Difference" CB 80 2.973 2.755 1.127 19707 30 1 5 "Average Difference" HN 84 0.452 -0.043 0.453 19707 31 1 6 "Average Difference" N 84 2.612 -0.102 2.626 19707 32 1 6 "Average Difference" HA 96 0.304 0.088 0.292 19707 33 1 6 "Average Difference" C 84 2.821 2.691 0.852 19707 34 1 6 "Average Difference" CA 88 2.860 2.725 0.875 19707 35 1 6 "Average Difference" CB 80 3.041 2.860 1.042 19707 36 1 6 "Average Difference" HN 84 0.458 -0.026 0.460 19707 37 1 7 "Average Difference" N 84 2.647 0.090 2.662 19707 38 1 7 "Average Difference" HA 96 0.308 0.061 0.303 19707 39 1 7 "Average Difference" C 84 2.850 2.695 0.932 19707 40 1 7 "Average Difference" CA 88 2.912 2.759 0.938 19707 41 1 7 "Average Difference" CB 80 2.965 2.759 1.092 19707 42 1 7 "Average Difference" HN 84 0.444 -0.047 0.445 19707 43 1 8 "Average Difference" N 84 2.699 0.114 2.713 19707 44 1 8 "Average Difference" HA 96 0.304 0.067 0.298 19707 45 1 8 "Average Difference" C 84 2.854 2.700 0.931 19707 46 1 8 "Average Difference" CA 88 2.845 2.716 0.852 19707 47 1 8 "Average Difference" CB 80 2.999 2.805 1.068 19707 48 1 8 "Average Difference" HN 84 0.464 -0.028 0.466 19707 49 1 9 "Average Difference" N 84 2.587 0.333 2.581 19707 50 1 9 "Average Difference" HA 96 0.299 0.064 0.294 19707 51 1 9 "Average Difference" C 84 2.831 2.672 0.941 19707 52 1 9 "Average Difference" CA 88 2.943 2.794 0.929 19707 53 1 9 "Average Difference" CB 80 3.010 2.821 1.057 19707 54 1 9 "Average Difference" HN 84 0.453 0.005 0.456 19707 55 1 10 "Average Difference" N 84 2.592 0.177 2.601 19707 56 1 10 "Average Difference" HA 96 0.304 0.070 0.297 19707 57 1 10 "Average Difference" C 84 2.832 2.682 0.916 19707 58 1 10 "Average Difference" CA 88 2.870 2.752 0.820 19707 59 1 10 "Average Difference" CB 80 2.998 2.798 1.082 19707 60 1 10 "Average Difference" HN 84 0.421 -0.022 0.423 19707 61 1 11 "Average Difference" N 84 2.575 0.121 2.588 19707 62 1 11 "Average Difference" HA 96 0.301 0.065 0.295 19707 63 1 11 "Average Difference" C 84 2.876 2.731 0.907 19707 64 1 11 "Average Difference" CA 88 2.926 2.796 0.865 19707 65 1 11 "Average Difference" CB 80 2.934 2.742 1.050 19707 66 1 11 "Average Difference" HN 84 0.428 -0.008 0.431 19707 67 1 12 "Average Difference" N 84 2.761 0.203 2.770 19707 68 1 12 "Average Difference" HA 96 0.312 0.052 0.310 19707 69 1 12 "Average Difference" C 84 2.833 2.664 0.970 19707 70 1 12 "Average Difference" CA 88 2.895 2.777 0.825 19707 71 1 12 "Average Difference" CB 80 2.940 2.728 1.103 19707 72 1 12 "Average Difference" HN 84 0.460 -0.012 0.463 19707 73 1 13 "Average Difference" N 84 2.658 0.012 2.674 19707 74 1 13 "Average Difference" HA 96 0.304 0.065 0.299 19707 75 1 13 "Average Difference" C 84 2.881 2.755 0.848 19707 76 1 13 "Average Difference" CA 88 2.859 2.740 0.821 19707 77 1 13 "Average Difference" CB 80 2.935 2.732 1.079 19707 78 1 13 "Average Difference" HN 84 0.435 0.008 0.437 19707 79 1 14 "Average Difference" N 84 2.682 0.184 2.692 19707 80 1 14 "Average Difference" HA 96 0.288 0.052 0.284 19707 81 1 14 "Average Difference" C 84 2.884 2.737 0.912 19707 82 1 14 "Average Difference" CA 88 2.957 2.830 0.861 19707 83 1 14 "Average Difference" CB 80 2.870 2.661 1.083 19707 84 1 14 "Average Difference" HN 84 0.475 -0.014 0.478 19707 85 1 15 "Average Difference" N 84 2.745 0.150 2.758 19707 86 1 15 "Average Difference" HA 96 0.329 0.068 0.323 19707 87 1 15 "Average Difference" C 84 2.873 2.717 0.939 19707 88 1 15 "Average Difference" CA 88 2.989 2.841 0.933 19707 89 1 15 "Average Difference" CB 80 2.907 2.696 1.094 19707 90 1 15 "Average Difference" HN 84 0.475 -0.021 0.477 19707 91 1 16 "Average Difference" N 84 2.726 0.161 2.738 19707 92 1 16 "Average Difference" HA 96 0.326 0.059 0.323 19707 93 1 16 "Average Difference" C 84 2.837 2.691 0.905 19707 94 1 16 "Average Difference" CA 88 2.991 2.836 0.956 19707 95 1 16 "Average Difference" CB 80 2.902 2.662 1.164 19707 96 1 16 "Average Difference" HN 84 0.444 -0.050 0.443 19707 97 1 17 "Average Difference" N 84 2.703 0.038 2.719 19707 98 1 17 "Average Difference" HA 96 0.310 0.060 0.305 19707 99 1 17 "Average Difference" C 84 2.843 2.685 0.939 19707 100 1 17 "Average Difference" CA 88 2.912 2.778 0.877 19707 101 1 17 "Average Difference" CB 80 2.977 2.754 1.138 19707 102 1 17 "Average Difference" HN 84 0.437 -0.020 0.439 19707 103 1 18 "Average Difference" N 84 2.641 0.026 2.657 19707 104 1 18 "Average Difference" HA 96 0.311 0.077 0.303 19707 105 1 18 "Average Difference" C 84 2.768 2.623 0.887 19707 106 1 18 "Average Difference" CA 88 2.851 2.729 0.830 19707 107 1 18 "Average Difference" CB 80 2.989 2.814 1.013 19707 108 1 18 "Average Difference" HN 84 0.442 -0.015 0.445 19707 109 1 19 "Average Difference" N 84 2.682 0.286 2.683 19707 110 1 19 "Average Difference" HA 96 0.301 0.055 0.297 19707 111 1 19 "Average Difference" C 84 2.909 2.746 0.968 19707 112 1 19 "Average Difference" CA 88 2.994 2.868 0.865 19707 113 1 19 "Average Difference" CB 80 3.002 2.815 1.050 19707 114 1 19 "Average Difference" HN 84 0.455 0.015 0.458 19707 115 1 20 "Average Difference" N 84 2.742 0.139 2.755 19707 116 1 20 "Average Difference" HA 96 0.303 0.064 0.298 19707 117 1 20 "Average Difference" C 84 2.859 2.719 0.888 19707 118 1 20 "Average Difference" CA 88 2.897 2.777 0.829 19707 119 1 20 "Average Difference" CB 80 2.896 2.666 1.139 19707 120 1 20 "Average Difference" HN 84 0.450 -0.013 0.452 19707 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 19707 _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 SER N N 2 115.963 115.963 115.648 0.315 19707 2 1 . 1 1 2 2 SER HA H 2 4.408 4.408 4.547 -0.139 19707 3 1 . 1 1 2 2 SER C C 2 171.788 171.788 174.107 -2.319 19707 4 1 . 1 1 2 2 SER CA C 2 55.870 55.870 58.191 -2.321 19707 5 1 . 1 1 2 2 SER CB C 2 61.022 61.022 64.018 -2.996 19707 6 1 . 1 1 2 2 SER H H 2 8.661 8.661 8.443 0.218 19707 7 1 . 1 1 3 3 GLU N N 3 122.941 122.941 121.749 1.192 19707 8 1 . 1 1 3 3 GLU HA H 3 4.320 4.320 4.465 -0.145 19707 9 1 . 1 1 3 3 GLU C C 3 173.817 173.817 175.731 -1.914 19707 10 1 . 1 1 3 3 GLU CA C 3 53.954 53.954 56.196 -2.242 19707 11 1 . 1 1 3 3 GLU CB C 3 26.837 26.837 30.607 -3.770 19707 12 1 . 1 1 3 3 GLU H H 3 8.706 8.706 8.364 0.342 19707 13 1 . 1 1 4 4 THR N N 4 116.182 116.182 116.493 -0.311 19707 14 1 . 1 1 4 4 THR HA H 4 4.233 4.233 4.424 -0.191 19707 15 1 . 1 1 4 4 THR C C 4 171.719 171.719 174.321 -2.602 19707 16 1 . 1 1 4 4 THR CA C 4 59.414 59.414 62.172 -2.758 19707 17 1 . 1 1 4 4 THR CB C 4 67.009 67.009 69.611 -2.602 19707 18 1 . 1 1 4 4 THR H H 4 8.165 8.165 8.241 -0.076 19707 19 1 . 1 1 5 5 ARG N N 5 124.184 124.184 123.309 0.875 19707 20 1 . 1 1 5 5 ARG HA H 5 4.360 4.360 4.504 -0.144 19707 21 1 . 1 1 5 5 ARG C C 5 173.520 173.520 175.821 -2.301 19707 22 1 . 1 1 5 5 ARG CA C 5 53.343 53.343 56.026 -2.683 19707 23 1 . 1 1 5 5 ARG CB C 5 28.165 28.165 30.797 -2.632 19707 24 1 . 1 1 5 5 ARG H H 5 8.354 8.354 8.497 -0.143 19707 25 1 . 1 1 6 6 THR N N 6 116.652 116.652 116.682 -0.030 19707 26 1 . 1 1 6 6 THR HA H 6 4.263 4.263 4.413 -0.150 19707 27 1 . 1 1 6 6 THR C C 6 171.784 171.784 173.910 -2.126 19707 28 1 . 1 1 6 6 THR CA C 6 59.218 59.218 62.054 -2.836 19707 29 1 . 1 1 6 6 THR CB C 6 67.213 67.213 69.547 -2.334 19707 30 1 . 1 1 6 6 THR H H 6 8.224 8.224 8.169 0.055 19707 31 1 . 1 1 7 7 ILE N N 7 123.882 123.882 123.697 0.185 19707 32 1 . 1 1 7 7 ILE HA H 7 4.138 4.138 4.307 -0.169 19707 33 1 . 1 1 7 7 ILE C C 7 173.572 173.572 176.287 -2.715 19707 34 1 . 1 1 7 7 ILE CA C 7 58.482 58.482 60.817 -2.335 19707 35 1 . 1 1 7 7 ILE CB C 7 36.069 36.069 39.359 -3.290 19707 36 1 . 1 1 7 7 ILE H H 7 8.247 8.247 8.298 -0.051 19707 37 1 . 1 1 8 8 SER N N 8 120.287 120.287 121.525 -1.238 19707 38 1 . 1 1 8 8 SER HA H 8 4.445 4.445 4.522 -0.077 19707 39 1 . 1 1 8 8 SER C C 8 171.926 171.926 174.619 -2.693 19707 40 1 . 1 1 8 8 SER CA C 8 55.522 55.522 58.138 -2.616 19707 41 1 . 1 1 8 8 SER CB C 8 61.073 61.073 63.452 -2.379 19707 42 1 . 1 1 8 8 SER H H 8 8.402 8.402 8.594 -0.192 19707 43 1 . 1 1 9 9 SER N N 9 118.425 118.425 119.961 -1.536 19707 44 1 . 1 1 9 9 SER HA H 9 4.525 4.525 4.448 0.077 19707 45 1 . 1 1 9 9 SER C C 9 172.663 172.663 174.242 -1.579 19707 46 1 . 1 1 9 9 SER CA C 9 55.897 55.897 59.136 -3.239 19707 47 1 . 1 1 9 9 SER CB C 9 61.375 61.375 62.481 -1.106 19707 48 1 . 1 1 9 9 SER H H 9 8.362 8.362 8.545 -0.183 19707 49 1 . 1 1 10 10 THR N N 10 115.676 115.676 113.001 2.675 19707 50 1 . 1 1 10 10 THR HA H 10 4.232 4.232 4.484 -0.252 19707 51 1 . 1 1 10 10 THR C C 10 173.070 173.070 175.544 -2.474 19707 52 1 . 1 1 10 10 THR CA C 10 60.318 60.318 62.852 -2.534 19707 53 1 . 1 1 10 10 THR CB C 10 67.205 67.205 69.267 -2.062 19707 54 1 . 1 1 10 10 THR H H 10 8.274 8.274 8.024 0.251 19707 55 1 . 1 1 11 11 ALA N N 11 124.726 124.726 124.700 0.026 19707 56 1 . 1 1 11 11 ALA HA H 11 3.987 3.987 4.146 -0.159 19707 57 1 . 1 1 11 11 ALA C C 11 176.825 176.825 179.406 -2.580 19707 58 1 . 1 1 11 11 ALA CA C 11 52.541 52.541 55.019 -2.478 19707 59 1 . 1 1 11 11 ALA CB C 11 15.889 15.889 18.255 -2.366 19707 60 1 . 1 1 11 11 ALA H H 11 8.347 8.347 8.220 0.127 19707 61 1 . 1 1 12 12 GLN N N 12 117.915 117.915 117.604 0.311 19707 62 1 . 1 1 12 12 GLN HA H 12 3.789 3.789 4.124 -0.335 19707 63 1 . 1 1 12 12 GLN C C 12 174.697 174.697 177.584 -2.887 19707 64 1 . 1 1 12 12 GLN CA C 12 55.004 55.004 57.896 -2.892 19707 65 1 . 1 1 12 12 GLN CB C 12 26.225 26.225 28.633 -2.409 19707 66 1 . 1 1 12 12 GLN H H 12 8.194 8.194 8.108 0.086 19707 67 1 . 1 1 13 13 GLU N N 13 118.510 118.510 119.660 -1.150 19707 68 1 . 1 1 13 13 GLU HA H 13 4.103 4.103 4.109 -0.006 19707 69 1 . 1 1 13 13 GLU C C 13 176.192 176.192 179.093 -2.901 19707 70 1 . 1 1 13 13 GLU CA C 13 56.315 56.315 58.873 -2.558 19707 71 1 . 1 1 13 13 GLU CB C 13 26.033 26.033 29.653 -3.620 19707 72 1 . 1 1 13 13 GLU H H 13 7.917 7.917 8.002 -0.085 19707 73 1 . 1 1 14 14 ARG N N 14 118.193 118.193 119.560 -1.367 19707 74 1 . 1 1 14 14 ARG HA H 14 3.968 3.968 4.067 -0.099 19707 75 1 . 1 1 14 14 ARG C C 14 176.764 176.764 178.553 -1.789 19707 76 1 . 1 1 14 14 ARG CA C 14 57.283 57.283 59.051 -1.768 19707 77 1 . 1 1 14 14 ARG CB C 14 27.237 27.237 29.595 -2.358 19707 78 1 . 1 1 14 14 ARG H H 14 7.907 7.907 8.207 -0.300 19707 79 1 . 1 1 15 15 VAL N N 15 117.991 117.991 115.833 2.158 19707 80 1 . 1 1 15 15 VAL HA H 15 3.903 3.903 3.943 -0.040 19707 81 1 . 1 1 15 15 VAL C C 15 174.922 174.922 177.488 -2.566 19707 82 1 . 1 1 15 15 VAL CA C 15 62.831 62.831 65.004 -2.173 19707 83 1 . 1 1 15 15 VAL CB C 15 28.723 28.723 31.226 -2.503 19707 84 1 . 1 1 15 15 VAL H H 15 7.658 7.658 7.543 0.115 19707 85 1 . 1 1 16 16 ASP N N 16 124.314 124.314 120.706 3.608 19707 86 1 . 1 1 16 16 ASP HA H 16 4.316 4.316 4.440 -0.124 19707 87 1 . 1 1 16 16 ASP C C 16 176.462 176.462 177.970 -1.508 19707 88 1 . 1 1 16 16 ASP CA C 16 55.326 55.326 57.379 -2.053 19707 89 1 . 1 1 16 16 ASP CB C 16 36.669 36.669 41.253 -4.584 19707 90 1 . 1 1 16 16 ASP H H 16 8.291 8.291 8.001 0.290 19707 91 1 . 1 1 17 17 LEU N N 17 120.212 120.212 119.473 0.739 19707 92 1 . 1 1 17 17 LEU HA H 17 4.054 4.054 4.098 -0.044 19707 93 1 . 1 1 17 17 LEU C C 17 177.171 177.171 178.935 -1.764 19707 94 1 . 1 1 17 17 LEU CA C 17 54.980 54.980 57.832 -2.852 19707 95 1 . 1 1 17 17 LEU CB C 17 38.845 38.845 41.573 -2.728 19707 96 1 . 1 1 17 17 LEU H H 17 8.172 8.172 7.568 0.604 19707 97 1 . 1 1 18 18 GLU N N 18 120.587 120.587 119.181 1.406 19707 98 1 . 1 1 18 18 GLU HA H 18 4.193 4.193 3.964 0.229 19707 99 1 . 1 1 18 18 GLU C C 18 175.997 175.997 178.621 -2.624 19707 100 1 . 1 1 18 18 GLU CA C 18 56.102 56.102 59.446 -3.344 19707 101 1 . 1 1 18 18 GLU CB C 18 26.072 26.072 28.832 -2.760 19707 102 1 . 1 1 18 18 GLU H H 18 7.876 7.876 7.906 -0.030 19707 103 1 . 1 1 19 19 ALA N N 19 121.800 121.800 122.834 -1.034 19707 104 1 . 1 1 19 19 ALA HA H 19 3.791 3.791 4.119 -0.328 19707 105 1 . 1 1 19 19 ALA C C 19 175.708 175.708 179.695 -3.987 19707 106 1 . 1 1 19 19 ALA CA C 19 52.852 52.852 54.979 -2.127 19707 107 1 . 1 1 19 19 ALA CB C 19 14.154 14.154 18.393 -4.239 19707 108 1 . 1 1 19 19 ALA H H 19 7.792 7.792 7.521 0.271 19707 109 1 . 1 1 20 20 VAL N N 20 118.680 118.680 119.380 -0.700 19707 110 1 . 1 1 20 20 VAL HA H 20 3.300 3.300 3.658 -0.358 19707 111 1 . 1 1 20 20 VAL C C 20 176.276 176.276 178.009 -1.733 19707 112 1 . 1 1 20 20 VAL CA C 20 63.807 63.807 66.524 -2.717 19707 113 1 . 1 1 20 20 VAL CB C 20 29.551 29.551 31.224 -1.673 19707 114 1 . 1 1 20 20 VAL H H 20 7.712 7.712 8.005 -0.293 19707 115 1 . 1 1 21 21 ARG N N 21 121.935 121.935 120.712 1.223 19707 116 1 . 1 1 21 21 ARG HA H 21 3.995 3.995 4.072 -0.077 19707 117 1 . 1 1 21 21 ARG C C 21 176.828 176.828 178.732 -1.904 19707 118 1 . 1 1 21 21 ARG CA C 21 56.660 56.660 58.660 -2.000 19707 119 1 . 1 1 21 21 ARG CB C 21 27.290 27.290 29.628 -2.338 19707 120 1 . 1 1 21 21 ARG H H 21 8.444 8.444 8.316 0.128 19707 121 1 . 1 1 22 22 LEU N N 22 119.327 119.327 119.621 -0.294 19707 122 1 . 1 1 22 22 LEU HA H 22 3.995 3.995 4.097 -0.102 19707 123 1 . 1 1 22 22 LEU C C 22 175.664 175.664 178.546 -2.882 19707 124 1 . 1 1 22 22 LEU CA C 22 54.868 54.868 58.116 -3.248 19707 125 1 . 1 1 22 22 LEU CB C 22 39.135 39.135 41.555 -2.420 19707 126 1 . 1 1 22 22 LEU H H 22 8.248 8.248 8.184 0.065 19707 127 1 . 1 1 23 23 ALA N N 23 121.202 121.202 122.216 -1.014 19707 128 1 . 1 1 23 23 ALA HA H 23 3.735 3.735 3.943 -0.208 19707 129 1 . 1 1 23 23 ALA C C 23 175.492 175.492 179.587 -4.095 19707 130 1 . 1 1 23 23 ALA CA C 23 53.069 53.069 55.328 -2.259 19707 131 1 . 1 1 23 23 ALA CB C 23 14.067 14.067 17.982 -3.915 19707 132 1 . 1 1 23 23 ALA H H 23 8.392 8.392 8.537 -0.145 19707 133 1 . 1 1 24 24 SER N N 24 112.377 112.377 114.985 -2.608 19707 134 1 . 1 1 24 24 SER HA H 24 4.214 4.214 4.273 -0.059 19707 135 1 . 1 1 24 24 SER C C 24 174.773 174.773 176.442 -1.669 19707 136 1 . 1 1 24 24 SER CA C 24 59.258 59.258 62.371 -3.113 19707 137 1 . 1 1 24 24 SER CB C 24 60.149 60.149 63.126 -2.977 19707 138 1 . 1 1 24 24 SER H H 24 7.690 7.690 7.985 -0.295 19707 139 1 . 1 1 25 25 ILE N N 25 123.886 123.886 122.418 1.468 19707 140 1 . 1 1 25 25 ILE HA H 25 3.842 3.842 4.002 -0.160 19707 141 1 . 1 1 25 25 ILE C C 25 176.487 176.487 178.096 -1.609 19707 142 1 . 1 1 25 25 ILE CA C 25 61.993 61.993 62.373 -0.380 19707 143 1 . 1 1 25 25 ILE CB C 25 35.932 35.932 36.403 -0.471 19707 144 1 . 1 1 25 25 ILE H H 25 7.837 7.837 8.113 -0.276 19707 145 1 . 1 1 26 26 VAL N N 26 122.538 122.538 121.449 1.089 19707 146 1 . 1 1 26 26 VAL HA H 26 3.388 3.388 3.635 -0.247 19707 147 1 . 1 1 26 26 VAL C C 26 174.624 174.624 177.774 -3.150 19707 148 1 . 1 1 26 26 VAL CA C 26 64.915 64.915 67.431 -2.516 19707 149 1 . 1 1 26 26 VAL CB C 26 27.895 27.895 31.266 -3.371 19707 150 1 . 1 1 26 26 VAL H H 26 8.804 8.804 8.686 0.118 19707 151 1 . 1 1 27 27 ASP N N 27 120.433 120.433 120.406 0.027 19707 152 1 . 1 1 27 27 ASP HA H 27 4.164 4.164 4.309 -0.145 19707 153 1 . 1 1 27 27 ASP C C 27 174.966 174.966 178.577 -3.611 19707 154 1 . 1 1 27 27 ASP CA C 27 55.329 55.329 57.611 -2.282 19707 155 1 . 1 1 27 27 ASP CB C 27 37.854 37.854 40.521 -2.667 19707 156 1 . 1 1 27 27 ASP H H 27 8.719 8.719 8.496 0.223 19707 157 1 . 1 1 28 28 SER N N 28 112.397 112.397 115.365 -2.968 19707 158 1 . 1 1 28 28 SER HA H 28 4.073 4.073 4.183 -0.110 19707 159 1 . 1 1 28 28 SER C C 28 174.405 174.405 176.661 -2.256 19707 160 1 . 1 1 28 28 SER CA C 28 59.115 59.115 61.748 -2.633 19707 161 1 . 1 1 28 28 SER CB C 28 60.125 60.125 63.154 -3.029 19707 162 1 . 1 1 28 28 SER H H 28 7.599 7.599 8.184 -0.585 19707 163 1 . 1 1 29 29 ARG N N 29 123.945 123.945 122.322 1.623 19707 164 1 . 1 1 29 29 ARG HA H 29 4.027 4.027 3.975 0.052 19707 165 1 . 1 1 29 29 ARG C C 29 175.902 175.902 178.130 -2.228 19707 166 1 . 1 1 29 29 ARG CA C 29 54.274 54.274 57.902 -3.628 19707 167 1 . 1 1 29 29 ARG CB C 29 27.740 27.740 29.110 -1.370 19707 168 1 . 1 1 29 29 ARG H H 29 7.769 7.769 7.697 0.072 19707 169 1 . 1 1 30 30 LEU N N 30 121.580 121.580 120.484 1.097 19707 170 1 . 1 1 30 30 LEU HA H 30 3.749 3.749 3.998 -0.249 19707 171 1 . 1 1 30 30 LEU C C 30 177.474 177.474 179.593 -2.119 19707 172 1 . 1 1 30 30 LEU CA C 30 55.313 55.313 57.837 -2.524 19707 173 1 . 1 1 30 30 LEU CB C 30 39.029 39.029 41.825 -2.796 19707 174 1 . 1 1 30 30 LEU H H 30 8.665 8.665 8.316 0.349 19707 175 1 . 1 1 31 31 ILE N N 31 119.330 119.330 117.656 1.674 19707 176 1 . 1 1 31 31 ILE HA H 31 3.691 3.691 3.772 -0.081 19707 177 1 . 1 1 31 31 ILE C C 31 175.341 175.341 177.795 -2.454 19707 178 1 . 1 1 31 31 ILE CA C 31 61.512 61.512 64.041 -2.529 19707 179 1 . 1 1 31 31 ILE CB C 31 35.567 35.567 37.871 -2.304 19707 180 1 . 1 1 31 31 ILE H H 31 8.226 8.226 8.422 -0.196 19707 181 1 . 1 1 32 32 GLY N N 32 106.092 106.092 106.131 -0.039 19707 182 1 . 1 1 32 32 GLY C C 32 172.413 172.413 175.068 -2.655 19707 183 1 . 1 1 32 32 GLY CA C 32 43.497 43.497 46.713 -3.216 19707 184 1 . 1 1 32 32 GLY H H 32 7.767 7.767 7.777 -0.010 19707 185 1 . 1 1 33 33 THR N N 33 110.966 110.966 112.910 -1.944 19707 186 1 . 1 1 33 33 THR HA H 33 4.455 4.455 4.364 0.091 19707 187 1 . 1 1 33 33 THR C C 33 172.714 172.714 174.867 -2.153 19707 188 1 . 1 1 33 33 THR CA C 33 60.032 60.032 62.547 -2.515 19707 189 1 . 1 1 33 33 THR CB C 33 68.287 68.287 69.964 -1.677 19707 190 1 . 1 1 33 33 THR H H 33 8.102 8.102 7.847 0.255 19707 191 1 . 1 1 34 34 GLY N N 34 110.320 110.320 110.789 -0.469 19707 192 1 . 1 1 34 34 GLY C C 34 170.505 170.505 173.633 -3.128 19707 193 1 . 1 1 34 34 GLY CA C 34 42.583 42.583 45.086 -2.503 19707 194 1 . 1 1 34 34 GLY H H 34 8.072 8.072 8.155 -0.083 19707 195 1 . 1 1 35 35 SER N N 35 112.944 112.944 114.580 -1.636 19707 196 1 . 1 1 35 35 SER HA H 35 4.385 4.385 4.801 -0.416 19707 197 1 . 1 1 35 35 SER C C 35 169.537 169.537 172.559 -3.022 19707 198 1 . 1 1 35 35 SER CA C 35 54.794 54.794 57.848 -3.054 19707 199 1 . 1 1 35 35 SER CB C 35 62.029 62.029 66.126 -4.097 19707 200 1 . 1 1 35 35 SER H H 35 7.719 7.719 7.610 0.109 19707 201 1 . 1 1 36 36 VAL N N 36 118.566 118.566 122.601 -4.035 19707 202 1 . 1 1 36 36 VAL HA H 36 4.033 4.033 4.207 -0.174 19707 203 1 . 1 1 36 36 VAL C C 36 169.876 169.876 174.105 -4.229 19707 204 1 . 1 1 36 36 VAL CA C 36 58.565 58.565 60.544 -1.979 19707 205 1 . 1 1 36 36 VAL CB C 36 30.952 30.952 33.549 -2.596 19707 206 1 . 1 1 36 36 VAL H H 36 8.490 8.490 8.426 0.065 19707 207 1 . 1 1 37 37 ASP N N 37 121.640 121.640 126.166 -4.526 19707 208 1 . 1 1 37 37 ASP HA H 37 4.802 4.802 4.894 -0.092 19707 209 1 . 1 1 37 37 ASP C C 37 172.806 172.806 176.277 -3.472 19707 210 1 . 1 1 37 37 ASP CA C 37 49.043 49.043 52.827 -3.784 19707 211 1 . 1 1 37 37 ASP CB C 37 40.206 40.206 43.778 -3.572 19707 212 1 . 1 1 37 37 ASP H H 37 7.195 7.195 8.215 -1.020 19707 213 1 . 1 1 38 38 GLU N N 38 120.018 120.018 121.075 -1.057 19707 214 1 . 1 1 38 38 GLU HA H 38 3.657 3.657 3.930 -0.273 19707 215 1 . 1 1 38 38 GLU C C 38 174.753 174.753 177.670 -2.917 19707 216 1 . 1 1 38 38 GLU CA C 38 57.492 57.492 60.341 -2.849 19707 217 1 . 1 1 38 38 GLU CB C 38 26.079 26.079 29.813 -3.734 19707 218 1 . 1 1 38 38 GLU H H 38 8.908 8.908 8.855 0.053 19707 219 1 . 1 1 39 39 ASP N N 39 118.668 118.668 117.290 1.378 19707 220 1 . 1 1 39 39 ASP HA H 39 4.246 4.246 4.468 -0.222 19707 221 1 . 1 1 39 39 ASP C C 39 175.393 175.393 177.673 -2.280 19707 222 1 . 1 1 39 39 ASP CA C 39 54.864 54.864 56.341 -1.477 19707 223 1 . 1 1 39 39 ASP CB C 39 36.970 36.970 40.411 -3.442 19707 224 1 . 1 1 39 39 ASP H H 39 8.242 8.242 8.662 -0.420 19707 225 1 . 1 1 40 40 PHE N N 40 119.851 119.851 118.876 0.975 19707 226 1 . 1 1 40 40 PHE HA H 40 4.204 4.204 4.436 -0.232 19707 227 1 . 1 1 40 40 PHE C C 40 174.929 174.929 176.031 -1.102 19707 228 1 . 1 1 40 40 PHE CA C 40 58.171 58.171 60.119 -1.948 19707 229 1 . 1 1 40 40 PHE CB C 40 36.833 36.833 40.021 -3.188 19707 230 1 . 1 1 40 40 PHE H H 40 8.037 8.037 7.814 0.223 19707 231 1 . 1 1 41 41 LEU N N 41 117.882 117.882 118.085 -0.203 19707 232 1 . 1 1 41 41 LEU HA H 41 3.522 3.522 4.181 -0.659 19707 233 1 . 1 1 41 41 LEU C C 41 175.938 175.938 178.763 -2.825 19707 234 1 . 1 1 41 41 LEU CA C 41 54.860 54.860 56.429 -1.569 19707 235 1 . 1 1 41 41 LEU CB C 41 39.231 39.231 42.594 -3.363 19707 236 1 . 1 1 41 41 LEU H H 41 7.816 7.816 7.721 0.095 19707 237 1 . 1 1 42 42 ARG N N 42 118.360 118.360 119.157 -0.797 19707 238 1 . 1 1 42 42 ARG HA H 42 3.740 3.740 4.009 -0.269 19707 239 1 . 1 1 42 42 ARG C C 42 175.435 175.435 177.123 -1.688 19707 240 1 . 1 1 42 42 ARG CA C 42 56.971 56.971 59.038 -2.067 19707 241 1 . 1 1 42 42 ARG CB C 42 27.264 27.264 29.853 -2.589 19707 242 1 . 1 1 42 42 ARG H H 42 8.540 8.540 8.119 0.421 19707 243 1 . 1 1 43 43 GLU N N 43 114.947 114.947 116.838 -1.891 19707 244 1 . 1 1 43 43 GLU HA H 43 4.050 4.050 4.268 -0.218 19707 245 1 . 1 1 43 43 GLU C C 43 174.518 174.518 177.463 -2.945 19707 246 1 . 1 1 43 43 GLU CA C 43 54.571 54.571 57.375 -2.804 19707 247 1 . 1 1 43 43 GLU CB C 43 26.041 26.041 29.116 -3.075 19707 248 1 . 1 1 43 43 GLU H H 43 7.223 7.223 8.208 -0.985 19707 249 1 . 1 1 44 44 GLN N N 44 114.109 114.109 117.299 -3.190 19707 250 1 . 1 1 44 44 GLN HA H 44 4.106 4.106 4.338 -0.232 19707 251 1 . 1 1 44 44 GLN C C 44 173.777 173.777 177.612 -3.835 19707 252 1 . 1 1 44 44 GLN CA C 44 52.181 52.181 55.787 -3.606 19707 253 1 . 1 1 44 44 GLN CB C 44 25.870 25.870 29.528 -3.658 19707 254 1 . 1 1 44 44 GLN H H 44 7.372 7.372 8.072 -0.700 19707 255 1 . 1 1 45 45 ILE N N 45 117.470 117.470 116.604 0.866 19707 256 1 . 1 1 45 45 ILE HA H 45 3.948 3.948 3.734 0.214 19707 257 1 . 1 1 45 45 ILE C C 45 172.305 172.305 177.103 -4.798 19707 258 1 . 1 1 45 45 ILE CA C 45 58.505 58.505 64.224 -5.719 19707 259 1 . 1 1 45 45 ILE CB C 45 35.700 35.700 37.745 -2.045 19707 260 1 . 1 1 45 45 ILE H H 45 7.235 7.235 7.444 -0.209 19707 261 1 . 1 1 46 46 ARG N N 46 122.996 122.996 115.144 7.852 19707 262 1 . 1 1 46 46 ARG HA H 46 4.190 4.190 3.986 0.204 19707 263 1 . 1 1 46 46 ARG C C 46 172.992 172.992 175.433 -2.441 19707 264 1 . 1 1 46 46 ARG CA C 46 53.761 53.761 58.129 -4.368 19707 265 1 . 1 1 46 46 ARG CB C 46 27.952 27.952 28.285 -0.333 19707 266 1 . 1 1 46 46 ARG H H 46 8.336 8.336 8.616 -0.281 19707 267 1 . 1 1 47 47 ASP N N 47 118.676 118.676 116.160 2.516 19707 268 1 . 1 1 47 47 ASP HA H 47 4.448 4.448 4.639 -0.190 19707 269 1 . 1 1 47 47 ASP C C 47 172.520 172.520 174.859 -2.339 19707 270 1 . 1 1 47 47 ASP CA C 47 51.890 51.890 54.354 -2.464 19707 271 1 . 1 1 47 47 ASP CB C 47 37.657 37.657 42.606 -4.949 19707 272 1 . 1 1 47 47 ASP H H 47 8.313 8.313 8.045 0.268 19707 273 1 . 1 1 48 48 ALA N N 48 120.922 120.922 122.859 -1.937 19707 274 1 . 1 1 48 48 ALA HA H 48 4.369 4.369 4.432 -0.063 19707 275 1 . 1 1 48 48 ALA C C 48 174.295 174.295 177.245 -2.950 19707 276 1 . 1 1 48 48 ALA CA C 48 49.637 49.637 51.962 -2.325 19707 277 1 . 1 1 48 48 ALA CB C 48 16.214 16.214 19.770 -3.556 19707 278 1 . 1 1 48 48 ALA H H 48 7.824 7.824 7.437 0.387 19707 279 1 . 1 1 49 49 ARG N N 49 118.644 118.644 120.995 -2.351 19707 280 1 . 1 1 49 49 ARG HA H 49 4.342 4.342 4.026 0.316 19707 281 1 . 1 1 49 49 ARG C C 49 172.504 172.504 176.282 -3.778 19707 282 1 . 1 1 49 49 ARG CA C 49 53.909 53.909 57.738 -3.829 19707 283 1 . 1 1 49 49 ARG CB C 49 28.343 28.343 30.666 -2.323 19707 284 1 . 1 1 49 49 ARG H H 49 7.911 7.911 8.521 -0.610 19707 285 1 . 1 1 50 50 TYR N N 50 119.470 119.470 114.695 4.775 19707 286 1 . 1 1 50 50 TYR HA H 50 5.291 5.291 5.016 0.275 19707 287 1 . 1 1 50 50 TYR C C 50 170.470 170.470 174.224 -3.754 19707 288 1 . 1 1 50 50 TYR CA C 50 53.268 53.268 55.150 -1.882 19707 289 1 . 1 1 50 50 TYR CB C 50 39.513 39.513 40.248 -0.735 19707 290 1 . 1 1 50 50 TYR H H 50 7.639 7.639 7.963 -0.324 19707 291 1 . 1 1 51 51 ALA N N 51 127.418 127.418 125.660 1.758 19707 292 1 . 1 1 51 51 ALA HA H 51 5.221 5.221 5.078 0.143 19707 293 1 . 1 1 51 51 ALA C C 51 171.328 171.328 175.492 -4.164 19707 294 1 . 1 1 51 51 ALA CA C 51 47.433 47.433 50.444 -3.011 19707 295 1 . 1 1 51 51 ALA CB C 51 20.312 20.312 21.540 -1.228 19707 296 1 . 1 1 51 51 ALA H H 51 8.222 8.222 8.721 -0.499 19707 297 1 . 1 1 52 52 VAL N N 52 117.832 117.832 121.481 -3.649 19707 298 1 . 1 1 52 52 VAL HA H 52 4.667 4.667 5.135 -0.468 19707 299 1 . 1 1 52 52 VAL C C 52 172.436 172.436 174.280 -1.844 19707 300 1 . 1 1 52 52 VAL CA C 52 57.757 57.757 61.034 -3.278 19707 301 1 . 1 1 52 52 VAL CB C 52 32.103 32.103 36.354 -4.251 19707 302 1 . 1 1 52 52 VAL H H 52 8.753 8.753 9.041 -0.288 19707 303 1 . 1 1 53 53 ILE N N 53 128.027 128.027 125.731 2.296 19707 304 1 . 1 1 53 53 ILE HA H 53 4.842 4.842 4.601 0.241 19707 305 1 . 1 1 53 53 ILE C C 53 172.110 172.110 174.310 -2.200 19707 306 1 . 1 1 53 53 ILE CA C 53 56.753 56.753 59.282 -2.529 19707 307 1 . 1 1 53 53 ILE CB C 53 37.159 37.159 40.938 -3.779 19707 308 1 . 1 1 53 53 ILE H H 53 9.261 9.261 8.993 0.268 19707 309 1 . 1 1 54 54 ARG N N 54 127.885 127.885 127.202 0.683 19707 310 1 . 1 1 54 54 ARG HA H 54 4.753 4.753 4.677 0.076 19707 311 1 . 1 1 54 54 ARG C C 54 172.285 172.285 174.450 -2.165 19707 312 1 . 1 1 54 54 ARG CA C 54 52.260 52.260 53.957 -1.697 19707 313 1 . 1 1 54 54 ARG CB C 54 27.892 27.892 30.703 -2.811 19707 314 1 . 1 1 54 54 ARG H H 54 8.686 8.686 8.751 -0.065 19707 315 1 . 1 1 55 55 ILE N N 55 129.907 129.907 123.942 5.965 19707 316 1 . 1 1 55 55 ILE HA H 55 4.153 4.153 4.351 -0.198 19707 317 1 . 1 1 55 55 ILE CA C 55 55.595 55.595 58.355 -2.760 19707 318 1 . 1 1 55 55 ILE CB C 55 37.613 37.613 39.051 -1.438 19707 319 1 . 1 1 55 55 ILE H H 55 9.292 9.292 8.273 1.019 19707 320 1 . 1 1 56 56 PRO HA H 56 4.192 4.192 4.368 -0.176 19707 321 1 . 1 1 56 56 PRO C C 56 174.787 174.787 177.773 -2.986 19707 322 1 . 1 1 56 56 PRO CA C 56 61.734 61.734 63.968 -2.234 19707 323 1 . 1 1 56 56 PRO CB C 56 28.913 28.913 31.777 -2.864 19707 324 1 . 1 1 57 57 GLY N N 57 111.828 111.828 111.253 0.575 19707 325 1 . 1 1 57 57 GLY C C 57 171.039 171.039 173.610 -2.571 19707 326 1 . 1 1 57 57 GLY CA C 57 42.817 42.817 44.899 -2.082 19707 327 1 . 1 1 57 57 GLY H H 57 8.708 8.708 8.808 -0.100 19707 328 1 . 1 1 58 58 GLN N N 58 118.457 118.457 119.817 -1.360 19707 329 1 . 1 1 58 58 GLN HA H 58 4.900 4.900 4.826 0.073 19707 330 1 . 1 1 58 58 GLN CA C 58 50.272 50.272 53.041 -2.769 19707 331 1 . 1 1 58 58 GLN CB C 58 27.154 27.154 29.869 -2.715 19707 332 1 . 1 1 58 58 GLN H H 58 7.909 7.909 7.574 0.335 19707 333 1 . 1 1 59 59 PRO HA H 59 4.436 4.436 4.432 0.004 19707 334 1 . 1 1 59 59 PRO C C 59 174.607 174.607 176.600 -1.993 19707 335 1 . 1 1 59 59 PRO CA C 59 60.055 60.055 62.836 -2.781 19707 336 1 . 1 1 59 59 PRO CB C 59 29.177 29.177 32.144 -2.967 19707 337 1 . 1 1 60 60 VAL N N 60 122.695 122.695 121.428 1.267 19707 338 1 . 1 1 60 60 VAL HA H 60 3.955 3.955 4.080 -0.125 19707 339 1 . 1 1 60 60 VAL C C 60 172.403 172.403 175.737 -3.334 19707 340 1 . 1 1 60 60 VAL CA C 60 60.895 60.895 62.744 -1.849 19707 341 1 . 1 1 60 60 VAL CB C 60 29.642 29.642 32.467 -2.825 19707 342 1 . 1 1 60 60 VAL H H 60 8.364 8.364 8.234 0.130 19707 343 1 . 1 1 61 61 VAL N N 61 126.097 126.097 128.216 -2.119 19707 344 1 . 1 1 61 61 VAL HA H 61 4.300 4.300 4.397 -0.097 19707 345 1 . 1 1 61 61 VAL C C 61 170.891 170.891 174.333 -3.442 19707 346 1 . 1 1 61 61 VAL CA C 61 58.814 58.814 61.250 -2.436 19707 347 1 . 1 1 61 61 VAL CB C 61 31.198 31.198 34.542 -3.344 19707 348 1 . 1 1 61 61 VAL H H 61 8.023 8.023 8.262 -0.239 19707 349 1 . 1 1 62 62 GLU N N 62 126.097 126.097 125.974 0.123 19707 350 1 . 1 1 62 62 GLU HA H 62 5.159 5.159 5.004 0.155 19707 351 1 . 1 1 62 62 GLU C C 62 172.252 172.252 175.337 -3.085 19707 352 1 . 1 1 62 62 GLU CA C 62 51.540 51.540 55.108 -3.568 19707 353 1 . 1 1 62 62 GLU CB C 62 30.300 30.300 32.559 -2.259 19707 354 1 . 1 1 62 62 GLU H H 62 8.591 8.591 8.497 0.094 19707 355 1 . 1 1 63 63 VAL N N 63 120.374 120.374 123.586 -3.212 19707 356 1 . 1 1 63 63 VAL HA H 63 4.393 4.393 4.260 0.133 19707 357 1 . 1 1 63 63 VAL C C 63 171.040 171.040 176.644 -5.604 19707 358 1 . 1 1 63 63 VAL CA C 63 57.833 57.833 61.676 -3.843 19707 359 1 . 1 1 63 63 VAL CB C 63 32.577 32.577 32.707 -0.130 19707 360 1 . 1 1 63 63 VAL H H 63 8.732 8.732 8.868 -0.136 19707 361 1 . 1 1 64 64 GLY N N 64 109.935 109.935 114.296 -4.361 19707 362 1 . 1 1 64 64 GLY C C 64 171.656 171.656 173.907 -2.251 19707 363 1 . 1 1 64 64 GLY CA C 64 41.177 41.177 46.099 -4.921 19707 364 1 . 1 1 64 64 GLY H H 64 8.259 8.259 8.477 -0.218 19707 365 1 . 1 1 65 65 THR N N 65 115.478 115.478 115.860 -0.382 19707 366 1 . 1 1 65 65 THR HA H 65 4.342 4.342 4.335 0.007 19707 367 1 . 1 1 65 65 THR C C 65 170.663 170.663 172.469 -1.806 19707 368 1 . 1 1 65 65 THR CA C 65 58.357 58.357 60.292 -1.935 19707 369 1 . 1 1 65 65 THR CB C 65 67.923 67.923 71.591 -3.668 19707 370 1 . 1 1 65 65 THR H H 65 8.123 8.123 7.643 0.480 19707 371 1 . 1 1 66 66 LYS N N 66 130.775 130.775 124.294 6.481 19707 372 1 . 1 1 66 66 LYS HA H 66 2.930 2.930 4.173 -1.243 19707 373 1 . 1 1 66 66 LYS CA C 66 52.190 52.190 54.639 -2.449 19707 374 1 . 1 1 66 66 LYS CB C 66 29.690 29.690 32.782 -3.092 19707 375 1 . 1 1 66 66 LYS H H 66 8.472 8.472 8.201 0.271 19707 376 1 . 1 1 67 67 PRO HA H 67 4.411 4.411 4.584 -0.173 19707 377 1 . 1 1 67 67 PRO C C 67 173.211 173.211 176.889 -3.678 19707 378 1 . 1 1 67 67 PRO CA C 67 59.566 59.566 62.380 -2.814 19707 379 1 . 1 1 67 67 PRO CB C 67 29.403 29.403 32.615 -3.212 19707 380 1 . 1 1 68 68 THR N N 68 111.983 111.983 114.279 -2.296 19707 381 1 . 1 1 68 68 THR HA H 68 4.277 4.277 4.272 0.005 19707 382 1 . 1 1 68 68 THR C C 68 171.720 171.720 175.591 -3.871 19707 383 1 . 1 1 68 68 THR CA C 68 58.193 58.193 62.799 -4.607 19707 384 1 . 1 1 68 68 THR CB C 68 67.723 67.723 69.281 -1.558 19707 385 1 . 1 1 68 68 THR H H 68 8.091 8.091 8.253 -0.162 19707 386 1 . 1 1 69 69 GLY N N 69 109.918 109.918 108.767 1.151 19707 387 1 . 1 1 69 69 GLY C C 69 170.783 170.783 174.270 -3.487 19707 388 1 . 1 1 69 69 GLY CA C 69 42.056 42.056 44.744 -2.688 19707 389 1 . 1 1 69 69 GLY H H 69 8.119 8.119 7.996 0.123 19707 390 1 . 1 1 70 70 ASP N N 70 123.294 123.294 124.331 -1.037 19707 391 1 . 1 1 70 70 ASP HA H 70 4.549 4.549 4.846 -0.297 19707 392 1 . 1 1 70 70 ASP C C 70 173.651 173.651 175.085 -1.434 19707 393 1 . 1 1 70 70 ASP CA C 70 51.861 51.861 54.594 -2.733 19707 394 1 . 1 1 70 70 ASP CB C 70 37.733 37.733 39.430 -1.697 19707 395 1 . 1 1 70 70 ASP H H 70 8.444 8.444 8.704 -0.260 19707 396 1 . 1 1 71 71 VAL N N 71 117.772 117.772 114.197 3.575 19707 397 1 . 1 1 71 71 VAL HA H 71 4.707 4.707 5.075 -0.368 19707 398 1 . 1 1 71 71 VAL C C 71 172.992 172.992 174.321 -1.329 19707 399 1 . 1 1 71 71 VAL CA C 71 57.376 57.376 59.304 -1.928 19707 400 1 . 1 1 71 71 VAL CB C 71 33.022 33.022 35.547 -2.525 19707 401 1 . 1 1 71 71 VAL H H 71 8.173 8.173 7.761 0.412 19707 402 1 . 1 1 72 72 LEU N N 72 123.435 123.435 122.860 0.575 19707 403 1 . 1 1 72 72 LEU HA H 72 4.636 4.636 4.573 0.063 19707 404 1 . 1 1 72 72 LEU C C 72 173.189 173.189 176.126 -2.937 19707 405 1 . 1 1 72 72 LEU CA C 72 51.207 51.207 54.353 -3.146 19707 406 1 . 1 1 72 72 LEU CB C 72 41.638 41.638 43.048 -1.410 19707 407 1 . 1 1 72 72 LEU H H 72 8.859 8.859 8.882 -0.023 19707 408 1 . 1 1 73 73 GLN N N 73 119.520 119.520 121.670 -2.150 19707 409 1 . 1 1 73 73 GLN HA H 73 5.345 5.345 5.136 0.209 19707 410 1 . 1 1 73 73 GLN C C 73 172.249 172.249 175.720 -3.471 19707 411 1 . 1 1 73 73 GLN CA C 73 51.333 51.333 54.561 -3.228 19707 412 1 . 1 1 73 73 GLN CB C 73 29.770 29.770 31.160 -1.390 19707 413 1 . 1 1 73 73 GLN H H 73 9.196 9.196 8.331 0.865 19707 414 1 . 1 1 74 74 GLY N N 74 113.513 113.513 111.825 1.688 19707 415 1 . 1 1 74 74 GLY C C 74 169.072 169.072 172.069 -2.997 19707 416 1 . 1 1 74 74 GLY CA C 74 41.297 41.297 43.962 -2.665 19707 417 1 . 1 1 74 74 GLY H H 74 9.373 9.373 9.098 0.275 19707 418 1 . 1 1 75 75 ARG N N 75 122.479 122.479 122.968 -0.489 19707 419 1 . 1 1 75 75 ARG HA H 75 5.502 5.502 5.365 0.137 19707 420 1 . 1 1 75 75 ARG C C 75 172.348 172.348 174.049 -1.701 19707 421 1 . 1 1 75 75 ARG CA C 75 51.758 51.758 55.655 -3.897 19707 422 1 . 1 1 75 75 ARG CB C 75 31.818 31.818 34.259 -2.441 19707 423 1 . 1 1 75 75 ARG H H 75 8.615 8.615 8.361 0.254 19707 424 1 . 1 1 76 76 ALA N N 76 122.346 122.346 127.052 -4.706 19707 425 1 . 1 1 76 76 ALA HA H 76 4.536 4.536 4.777 -0.241 19707 426 1 . 1 1 76 76 ALA C C 76 172.704 172.704 174.753 -2.049 19707 427 1 . 1 1 76 76 ALA CA C 76 49.027 49.027 51.535 -2.508 19707 428 1 . 1 1 76 76 ALA CB C 76 20.025 20.025 22.818 -2.793 19707 429 1 . 1 1 76 76 ALA H H 76 8.590 8.590 8.981 -0.391 19707 430 1 . 1 1 77 77 THR N N 77 116.961 116.961 116.341 0.620 19707 431 1 . 1 1 77 77 THR HA H 77 4.988 4.988 5.111 -0.123 19707 432 1 . 1 1 77 77 THR C C 77 172.800 172.800 174.819 -2.019 19707 433 1 . 1 1 77 77 THR CA C 77 58.344 58.344 61.192 -2.848 19707 434 1 . 1 1 77 77 THR CB C 77 67.712 67.712 70.593 -2.881 19707 435 1 . 1 1 77 77 THR H H 77 8.491 8.491 8.292 0.199 19707 436 1 . 1 1 78 78 GLY N N 78 111.103 111.103 112.761 -1.658 19707 437 1 . 1 1 78 78 GLY C C 78 172.567 172.567 174.651 -2.084 19707 438 1 . 1 1 78 78 GLY CA C 78 41.309 41.309 43.852 -2.543 19707 439 1 . 1 1 78 78 GLY H H 78 8.649 8.649 8.769 -0.120 19707 440 1 . 1 1 79 79 GLU N N 79 123.423 123.423 119.601 3.822 19707 441 1 . 1 1 79 79 GLU HA H 79 3.996 3.996 4.272 -0.276 19707 442 1 . 1 1 79 79 GLU C C 79 175.466 175.466 177.437 -1.971 19707 443 1 . 1 1 79 79 GLU CA C 79 55.459 55.459 58.173 -2.714 19707 444 1 . 1 1 79 79 GLU CB C 79 26.067 26.067 29.754 -3.687 19707 445 1 . 1 1 79 79 GLU H H 79 10.375 10.375 8.839 1.536 19707 446 1 . 1 1 80 80 GLU N N 80 113.846 113.846 117.438 -3.592 19707 447 1 . 1 1 80 80 GLU HA H 80 4.358 4.358 4.404 -0.046 19707 448 1 . 1 1 80 80 GLU C C 80 173.293 173.293 176.938 -3.645 19707 449 1 . 1 1 80 80 GLU CA C 80 51.776 51.776 55.959 -4.183 19707 450 1 . 1 1 80 80 GLU CB C 80 24.731 24.731 29.593 -4.862 19707 451 1 . 1 1 80 80 GLU H H 80 7.679 7.679 8.384 -0.705 19707 452 1 . 1 1 81 81 GLY N N 81 105.493 105.493 108.817 -3.324 19707 453 1 . 1 1 81 81 GLY C C 81 170.427 170.427 174.097 -3.670 19707 454 1 . 1 1 81 81 GLY CA C 81 42.612 42.612 45.171 -2.559 19707 455 1 . 1 1 81 81 GLY H H 81 7.476 7.476 7.751 -0.275 19707 456 1 . 1 1 82 82 GLU N N 82 122.160 122.160 119.271 2.889 19707 457 1 . 1 1 82 82 GLU HA H 82 4.954 4.954 4.397 0.556 19707 458 1 . 1 1 82 82 GLU C C 82 171.004 171.004 175.328 -4.324 19707 459 1 . 1 1 82 82 GLU CA C 82 51.321 51.321 55.417 -4.096 19707 460 1 . 1 1 82 82 GLU CB C 82 26.066 26.066 31.047 -4.981 19707 461 1 . 1 1 82 82 GLU H H 82 9.585 9.585 8.016 1.569 19707 462 1 . 1 1 83 83 THR N N 83 114.756 114.756 115.550 -0.794 19707 463 1 . 1 1 83 83 THR HA H 83 4.990 4.990 5.127 -0.137 19707 464 1 . 1 1 83 83 THR C C 83 170.909 170.909 173.244 -2.335 19707 465 1 . 1 1 83 83 THR CA C 83 57.957 57.957 61.954 -3.997 19707 466 1 . 1 1 83 83 THR CB C 83 68.271 68.271 71.490 -3.219 19707 467 1 . 1 1 83 83 THR H H 83 8.490 8.490 8.289 0.201 19707 468 1 . 1 1 84 84 VAL N N 84 122.639 122.639 125.820 -3.181 19707 469 1 . 1 1 84 84 VAL HA H 84 4.655 4.655 4.757 -0.102 19707 470 1 . 1 1 84 84 VAL C C 84 170.962 170.962 173.760 -2.798 19707 471 1 . 1 1 84 84 VAL CA C 84 58.297 58.297 61.065 -2.768 19707 472 1 . 1 1 84 84 VAL CB C 84 32.224 32.224 34.684 -2.459 19707 473 1 . 1 1 84 84 VAL H H 84 9.001 9.001 9.003 -0.002 19707 474 1 . 1 1 85 85 LEU N N 85 129.903 129.903 127.497 2.406 19707 475 1 . 1 1 85 85 LEU HA H 85 5.392 5.392 5.479 -0.087 19707 476 1 . 1 1 85 85 LEU C C 85 172.346 172.346 174.524 -2.178 19707 477 1 . 1 1 85 85 LEU CA C 85 50.797 50.797 53.247 -2.450 19707 478 1 . 1 1 85 85 LEU CB C 85 42.515 42.515 46.894 -4.379 19707 479 1 . 1 1 85 85 LEU H H 85 8.610 8.610 8.955 -0.345 19707 480 1 . 1 1 86 86 VAL N N 86 122.778 122.778 123.718 -0.940 19707 481 1 . 1 1 86 86 VAL HA H 86 5.041 5.041 4.911 0.130 19707 482 1 . 1 1 86 86 VAL C C 86 172.570 172.570 174.450 -1.880 19707 483 1 . 1 1 86 86 VAL CA C 86 57.200 57.200 60.898 -3.698 19707 484 1 . 1 1 86 86 VAL CB C 86 32.275 32.275 35.294 -3.019 19707 485 1 . 1 1 86 86 VAL H H 86 9.228 9.228 9.089 0.139 19707 486 1 . 1 1 87 87 GLU N N 87 120.437 120.437 126.185 -5.748 19707 487 1 . 1 1 87 87 GLU HA H 87 5.731 5.731 5.538 0.193 19707 488 1 . 1 1 87 87 GLU C C 87 172.267 172.267 175.003 -2.736 19707 489 1 . 1 1 87 87 GLU CA C 87 51.349 51.349 54.508 -3.159 19707 490 1 . 1 1 87 87 GLU CB C 87 31.124 31.124 33.867 -2.743 19707 491 1 . 1 1 87 87 GLU H H 87 8.851 8.851 9.244 -0.393 19707 492 1 . 1 1 88 88 GLU N N 88 118.525 118.525 121.422 -2.897 19707 493 1 . 1 1 88 88 GLU HA H 88 5.001 5.001 4.723 0.278 19707 494 1 . 1 1 88 88 GLU CA C 88 49.917 49.917 52.997 -3.080 19707 495 1 . 1 1 88 88 GLU CB C 88 29.947 29.947 32.157 -2.210 19707 496 1 . 1 1 88 88 GLU H H 88 8.380 8.380 8.499 -0.119 19707 497 1 . 1 1 89 89 PRO HA H 89 4.529 4.529 4.424 0.105 19707 498 1 . 1 1 89 89 PRO C C 89 172.774 172.774 176.720 -3.946 19707 499 1 . 1 1 89 89 PRO CA C 89 60.381 60.381 63.125 -2.744 19707 500 1 . 1 1 89 89 PRO CB C 89 29.334 29.334 32.144 -2.810 19707 stop_ save_