data_19610 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19610 _Entry.PDB_ID 2MH0 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 19610 _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 HA H 2 4.472 4.472 4.563 -0.091 19610 2 1 1 . 1 1 2 2 SER C C 2 174.628 174.628 173.944 0.684 19610 3 1 1 . 1 1 2 2 SER CA C 2 58.397 58.397 58.489 -0.092 19610 4 1 1 . 1 1 2 2 SER CB C 2 63.896 63.896 62.938 0.958 19610 5 1 1 . 1 1 3 3 MET N N 3 122.147 122.147 124.348 -2.201 19610 6 1 1 . 1 1 3 3 MET HA H 3 4.490 4.490 4.604 -0.114 19610 7 1 1 . 1 1 3 3 MET C C 3 175.934 175.934 175.135 0.799 19610 8 1 1 . 1 1 3 3 MET CA C 3 55.552 55.552 55.420 0.132 19610 9 1 1 . 1 1 3 3 MET CB C 3 32.645 32.645 34.526 -1.881 19610 10 1 1 . 1 1 3 3 MET H H 3 8.627 8.627 7.985 0.642 19610 11 1 1 . 1 1 4 4 ASN N N 4 119.930 119.930 122.485 -2.555 19610 12 1 1 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.950 -0.296 19610 13 1 1 . 1 1 4 4 ASN C C 4 174.695 174.695 174.510 0.185 19610 14 1 1 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.548 -0.311 19610 15 1 1 . 1 1 4 4 ASN CB C 4 38.768 38.768 40.090 -1.322 19610 16 1 1 . 1 1 4 4 ASN H H 4 8.497 8.497 8.560 -0.063 19610 17 1 1 . 1 1 5 5 GLN N N 5 121.523 121.523 125.025 -3.502 19610 18 1 1 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.544 0.049 19610 19 1 1 . 1 1 5 5 GLN C C 5 173.849 173.849 174.599 -0.750 19610 20 1 1 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.200 -0.476 19610 21 1 1 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.754 0.160 19610 22 1 1 . 1 1 5 5 GLN H H 5 8.322 8.322 8.505 -0.183 19610 23 1 1 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.432 -0.054 19610 24 1 1 . 1 1 6 6 PRO C C 6 176.816 176.816 176.339 0.477 19610 25 1 1 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.500 0.657 19610 26 1 1 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.191 -0.105 19610 27 1 1 . 1 1 7 7 GLN N N 7 121.005 121.005 118.142 2.863 19610 28 1 1 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.300 -0.055 19610 29 1 1 . 1 1 7 7 GLN C C 7 175.941 175.941 175.708 0.233 19610 30 1 1 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.310 0.474 19610 31 1 1 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.320 0.175 19610 32 1 1 . 1 1 7 7 GLN H H 7 8.576 8.576 8.198 0.378 19610 33 1 1 . 1 1 8 8 ARG N N 8 122.928 122.928 120.892 2.036 19610 34 1 1 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.232 0.055 19610 35 1 1 . 1 1 8 8 ARG C C 8 176.061 176.061 175.757 0.304 19610 36 1 1 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.481 -0.485 19610 37 1 1 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.878 0.938 19610 38 1 1 . 1 1 8 8 ARG H H 8 8.449 8.449 8.524 -0.075 19610 39 1 1 . 1 1 9 9 MET N N 9 122.430 122.430 123.187 -0.757 19610 40 1 1 . 1 1 9 9 MET HA H 9 4.450 4.450 4.526 -0.076 19610 41 1 1 . 1 1 9 9 MET C C 9 175.469 175.469 176.405 -0.936 19610 42 1 1 . 1 1 9 9 MET CA C 9 54.941 54.941 55.169 -0.228 19610 43 1 1 . 1 1 9 9 MET CB C 9 33.058 33.058 33.548 -0.490 19610 44 1 1 . 1 1 9 9 MET H H 9 8.471 8.471 8.311 0.160 19610 45 1 1 . 1 1 10 10 ALA N N 10 127.153 127.153 125.361 1.792 19610 46 1 1 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.446 0.095 19610 47 1 1 . 1 1 10 10 ALA C C 10 175.353 175.353 176.215 -0.862 19610 48 1 1 . 1 1 10 10 ALA CA C 10 50.487 50.487 51.028 -0.541 19610 49 1 1 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.296 -0.265 19610 50 1 1 . 1 1 10 10 ALA H H 10 8.398 8.398 8.333 0.065 19610 51 1 1 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.374 0.064 19610 52 1 1 . 1 1 11 11 PRO C C 11 176.896 176.896 176.850 0.046 19610 53 1 1 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.211 -1.356 19610 54 1 1 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.261 -0.240 19610 55 1 1 . 1 1 12 12 VAL N N 12 120.652 120.652 115.811 4.841 19610 56 1 1 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.174 -0.084 19610 57 1 1 . 1 1 12 12 VAL C C 12 176.825 176.825 175.359 1.466 19610 58 1 1 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.510 0.893 19610 59 1 1 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.810 -0.909 19610 60 1 1 . 1 1 12 12 VAL H H 12 8.373 8.373 7.565 0.808 19610 61 1 1 . 1 1 13 13 GLY N N 13 112.483 112.483 115.355 -2.872 19610 62 1 1 . 1 1 13 13 GLY C C 13 174.515 174.515 174.871 -0.356 19610 63 1 1 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.612 -0.284 19610 64 1 1 . 1 1 13 13 GLY H H 13 8.605 8.605 8.482 0.123 19610 65 1 1 . 1 1 14 14 THR N N 14 113.531 113.531 117.305 -3.774 19610 66 1 1 . 1 1 14 14 THR HA H 14 4.309 4.309 4.407 -0.098 19610 67 1 1 . 1 1 14 14 THR C C 14 174.742 174.742 175.314 -0.572 19610 68 1 1 . 1 1 14 14 THR CA C 14 62.130 62.130 63.940 -1.810 19610 69 1 1 . 1 1 14 14 THR CB C 14 69.981 69.981 68.532 1.448 19610 70 1 1 . 1 1 14 14 THR H H 14 8.164 8.164 8.335 -0.171 19610 71 1 1 . 1 1 15 15 ASP N N 15 122.439 122.439 121.046 1.393 19610 72 1 1 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.403 0.107 19610 73 1 1 . 1 1 15 15 ASP C C 15 177.216 177.216 178.296 -1.080 19610 74 1 1 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.643 -2.381 19610 75 1 1 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.743 -0.050 19610 76 1 1 . 1 1 15 15 ASP H H 15 8.537 8.537 8.602 -0.065 19610 77 1 1 . 1 1 16 16 LYS N N 16 122.807 122.807 118.259 4.548 19610 78 1 1 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.032 0.086 19610 79 1 1 . 1 1 16 16 LYS C C 16 177.430 177.430 179.215 -1.785 19610 80 1 1 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.880 -0.987 19610 81 1 1 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.878 0.661 19610 82 1 1 . 1 1 16 16 LYS H H 16 8.288 8.288 7.498 0.790 19610 83 1 1 . 1 1 17 17 GLU N N 17 119.492 119.492 119.438 0.054 19610 84 1 1 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.074 0.038 19610 85 1 1 . 1 1 17 17 GLU C C 17 178.007 178.007 179.118 -1.111 19610 86 1 1 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.322 -1.070 19610 87 1 1 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.614 0.033 19610 88 1 1 . 1 1 17 17 GLU H H 17 8.221 8.221 7.568 0.653 19610 89 1 1 . 1 1 18 18 LEU N N 18 119.493 119.493 117.048 2.445 19610 90 1 1 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.260 -0.113 19610 91 1 1 . 1 1 18 18 LEU C C 18 178.359 178.359 179.123 -0.764 19610 92 1 1 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.700 -1.278 19610 93 1 1 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.280 0.480 19610 94 1 1 . 1 1 18 18 LEU H H 18 7.998 7.998 7.898 0.100 19610 95 1 1 . 1 1 19 19 SER N N 19 114.728 114.728 115.360 -0.632 19610 96 1 1 . 1 1 19 19 SER HA H 19 4.113 4.113 4.206 -0.093 19610 97 1 1 . 1 1 19 19 SER C C 19 175.912 175.912 176.670 -0.758 19610 98 1 1 . 1 1 19 19 SER CA C 19 60.881 60.881 61.609 -0.728 19610 99 1 1 . 1 1 19 19 SER CB C 19 63.043 63.043 62.706 0.336 19610 100 1 1 . 1 1 19 19 SER H H 19 8.068 8.068 7.946 0.122 19610 101 1 1 . 1 1 20 20 ASP N N 20 121.206 121.206 122.359 -1.153 19610 102 1 1 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.233 0.215 19610 103 1 1 . 1 1 20 20 ASP C C 20 177.598 177.598 178.273 -0.675 19610 104 1 1 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.498 -1.503 19610 105 1 1 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.015 -0.476 19610 106 1 1 . 1 1 20 20 ASP H H 20 8.301 8.301 8.094 0.207 19610 107 1 1 . 1 1 21 21 LEU N N 21 119.944 119.944 118.669 1.275 19610 108 1 1 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.570 -0.428 19610 109 1 1 . 1 1 21 21 LEU C C 21 177.822 177.822 178.690 -0.868 19610 110 1 1 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.432 1.007 19610 111 1 1 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.169 1.083 19610 112 1 1 . 1 1 21 21 LEU H H 21 7.807 7.807 8.213 -0.406 19610 113 1 1 . 1 1 22 22 LEU N N 22 119.558 119.558 121.941 -2.383 19610 114 1 1 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.071 0.005 19610 115 1 1 . 1 1 22 22 LEU C C 22 177.131 177.131 178.185 -1.054 19610 116 1 1 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.812 -1.757 19610 117 1 1 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.657 0.187 19610 118 1 1 . 1 1 22 22 LEU H H 22 7.878 7.878 7.713 0.165 19610 119 1 1 . 1 1 23 23 ASP N N 23 119.509 119.509 119.965 -0.456 19610 120 1 1 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.260 0.204 19610 121 1 1 . 1 1 23 23 ASP C C 23 177.379 177.379 178.528 -1.149 19610 122 1 1 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.501 -2.574 19610 123 1 1 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.601 0.138 19610 124 1 1 . 1 1 23 23 ASP H H 23 7.990 7.990 7.788 0.202 19610 125 1 1 . 1 1 24 24 PHE N N 24 121.219 121.219 116.601 4.618 19610 126 1 1 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.325 0.141 19610 127 1 1 . 1 1 24 24 PHE C C 24 176.875 176.875 177.870 -0.995 19610 128 1 1 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.645 -0.416 19610 129 1 1 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.193 0.814 19610 130 1 1 . 1 1 24 24 PHE H H 24 8.204 8.204 7.850 0.354 19610 131 1 1 . 1 1 25 25 SER N N 25 115.500 115.500 116.158 -0.658 19610 132 1 1 . 1 1 25 25 SER HA H 25 4.108 4.108 4.710 -0.602 19610 133 1 1 . 1 1 25 25 SER C C 25 175.386 175.386 176.200 -0.814 19610 134 1 1 . 1 1 25 25 SER CA C 25 60.758 60.758 61.580 -0.822 19610 135 1 1 . 1 1 25 25 SER CB C 25 62.998 62.998 63.294 -0.296 19610 136 1 1 . 1 1 25 25 SER H H 25 8.326 8.326 7.790 0.536 19610 137 1 1 . 1 1 26 26 MET N N 26 119.723 119.723 118.208 1.515 19610 138 1 1 . 1 1 26 26 MET HA H 26 4.363 4.363 4.501 -0.138 19610 139 1 1 . 1 1 26 26 MET C C 26 176.450 176.450 177.613 -1.163 19610 140 1 1 . 1 1 26 26 MET CA C 26 55.949 55.949 57.071 -1.122 19610 141 1 1 . 1 1 26 26 MET CB C 26 31.868 31.868 32.445 -0.577 19610 142 1 1 . 1 1 26 26 MET H H 26 7.889 7.889 7.901 -0.012 19610 143 1 1 . 1 1 27 27 MET N N 27 117.872 117.872 119.062 -1.190 19610 144 1 1 . 1 1 27 27 MET HA H 27 4.186 4.186 4.271 -0.085 19610 145 1 1 . 1 1 27 27 MET C C 27 175.341 175.341 176.681 -1.340 19610 146 1 1 . 1 1 27 27 MET CA C 27 56.102 56.102 57.178 -1.076 19610 147 1 1 . 1 1 27 27 MET CB C 27 33.161 33.161 33.477 -0.316 19610 148 1 1 . 1 1 27 27 MET H H 27 7.656 7.656 7.416 0.240 19610 149 1 1 . 1 1 28 28 PHE N N 28 118.702 118.702 119.455 -0.753 19610 150 1 1 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.416 0.388 19610 151 1 1 . 1 1 28 28 PHE C C 28 173.132 173.132 175.048 -1.916 19610 152 1 1 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.351 -2.556 19610 153 1 1 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.476 0.253 19610 154 1 1 . 1 1 28 28 PHE H H 28 7.682 7.682 7.732 -0.050 19610 155 1 1 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.424 0.037 19610 156 1 1 . 1 1 29 29 PRO C C 29 176.360 176.360 176.347 0.013 19610 157 1 1 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.375 -0.555 19610 158 1 1 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.799 -0.218 19610 159 1 1 . 1 1 30 30 LEU N N 30 123.391 123.391 121.020 2.371 19610 160 1 1 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.537 0.002 19610 161 1 1 . 1 1 30 30 LEU C C 30 175.365 175.365 176.480 -1.115 19610 162 1 1 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.825 -0.914 19610 163 1 1 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.939 -0.266 19610 164 1 1 . 1 1 30 30 LEU H H 30 8.284 8.284 7.751 0.533 19610 165 1 1 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.523 -0.085 19610 166 1 1 . 1 1 31 31 PRO C C 31 176.688 176.688 175.609 1.079 19610 167 1 1 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.181 0.699 19610 168 1 1 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.051 1.992 19610 169 1 1 . 1 1 32 32 VAL N N 32 120.844 120.844 124.497 -3.653 19610 170 1 1 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.857 0.283 19610 171 1 1 . 1 1 32 32 VAL C C 32 176.579 176.579 176.442 0.137 19610 172 1 1 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.733 -0.492 19610 173 1 1 . 1 1 32 32 VAL CB C 32 32.809 32.809 30.339 2.470 19610 174 1 1 . 1 1 32 32 VAL H H 32 8.344 8.344 7.846 0.498 19610 175 1 1 . 1 1 33 33 THR N N 33 118.041 118.041 120.411 -2.370 19610 176 1 1 . 1 1 33 33 THR HA H 33 4.373 4.373 4.401 -0.028 19610 177 1 1 . 1 1 33 33 THR C C 33 174.172 174.172 174.642 -0.470 19610 178 1 1 . 1 1 33 33 THR CA C 33 61.407 61.407 62.159 -0.752 19610 179 1 1 . 1 1 33 33 THR CB C 33 69.891 69.891 67.811 2.080 19610 180 1 1 . 1 1 33 33 THR H H 33 8.326 8.326 8.330 -0.004 19610 181 1 1 . 1 1 34 34 ASN N N 34 121.367 121.367 123.132 -1.765 19610 182 1 1 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.868 -0.159 19610 183 1 1 . 1 1 34 34 ASN C C 34 175.639 175.639 175.069 0.570 19610 184 1 1 . 1 1 34 34 ASN CA C 34 53.218 53.218 52.681 0.537 19610 185 1 1 . 1 1 34 34 ASN CB C 34 38.957 38.957 39.017 -0.060 19610 186 1 1 . 1 1 34 34 ASN H H 34 8.526 8.526 7.938 0.588 19610 187 1 1 . 1 1 35 35 GLY N N 35 109.437 109.437 109.641 -0.204 19610 188 1 1 . 1 1 35 35 GLY C C 35 174.112 174.112 175.298 -1.186 19610 189 1 1 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.627 -0.257 19610 190 1 1 . 1 1 35 35 GLY H H 35 8.449 8.449 8.458 -0.009 19610 191 1 1 . 1 1 36 36 LYS N N 36 120.614 120.614 121.567 -0.953 19610 192 1 1 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.417 -0.114 19610 193 1 1 . 1 1 36 36 LYS C C 36 177.182 177.182 176.594 0.588 19610 194 1 1 . 1 1 36 36 LYS CA C 36 56.300 56.300 54.856 1.444 19610 195 1 1 . 1 1 36 36 LYS CB C 36 32.895 32.895 30.469 2.426 19610 196 1 1 . 1 1 36 36 LYS H H 36 8.261 8.261 8.086 0.175 19610 197 1 1 . 1 1 37 37 GLY N N 37 110.011 110.011 110.833 -0.822 19610 198 1 1 . 1 1 37 37 GLY C C 37 173.463 173.463 174.072 -0.609 19610 199 1 1 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.128 -0.006 19610 200 1 1 . 1 1 37 37 GLY H H 37 8.484 8.484 8.081 0.403 19610 201 1 1 . 1 1 38 38 ARG N N 38 121.698 121.698 121.699 -0.001 19610 202 1 1 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.068 0.551 19610 203 1 1 . 1 1 38 38 ARG C C 38 173.448 173.448 174.055 -0.607 19610 204 1 1 . 1 1 38 38 ARG CA C 38 53.702 53.702 55.663 -1.961 19610 205 1 1 . 1 1 38 38 ARG CB C 38 30.121 30.121 28.960 1.161 19610 206 1 1 . 1 1 38 38 ARG H H 38 8.105 8.105 8.065 0.040 19610 207 1 2 . 1 1 2 2 SER HA H 2 4.472 4.472 4.404 0.068 19610 208 1 2 . 1 1 2 2 SER C C 2 174.628 174.628 175.575 -0.947 19610 209 1 2 . 1 1 2 2 SER CA C 2 58.397 58.397 58.838 -0.441 19610 210 1 2 . 1 1 2 2 SER CB C 2 63.896 63.896 63.376 0.520 19610 211 1 2 . 1 1 3 3 MET N N 3 122.147 122.147 117.835 4.312 19610 212 1 2 . 1 1 3 3 MET HA H 3 4.490 4.490 4.175 0.315 19610 213 1 2 . 1 1 3 3 MET C C 3 175.934 175.934 175.356 0.578 19610 214 1 2 . 1 1 3 3 MET CA C 3 55.552 55.552 55.878 -0.326 19610 215 1 2 . 1 1 3 3 MET CB C 3 32.645 32.645 32.511 0.134 19610 216 1 2 . 1 1 3 3 MET H H 3 8.627 8.627 7.895 0.732 19610 217 1 2 . 1 1 4 4 ASN N N 4 119.930 119.930 118.182 1.748 19610 218 1 2 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.928 -0.274 19610 219 1 2 . 1 1 4 4 ASN C C 4 174.695 174.695 173.726 0.969 19610 220 1 2 . 1 1 4 4 ASN CA C 4 53.237 53.237 52.576 0.661 19610 221 1 2 . 1 1 4 4 ASN CB C 4 38.768 38.768 39.982 -1.214 19610 222 1 2 . 1 1 4 4 ASN H H 4 8.497 8.497 8.295 0.202 19610 223 1 2 . 1 1 5 5 GLN N N 5 121.523 121.523 122.286 -0.763 19610 224 1 2 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.477 0.116 19610 225 1 2 . 1 1 5 5 GLN C C 5 173.849 173.849 174.521 -0.672 19610 226 1 2 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.767 -1.043 19610 227 1 2 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.679 0.235 19610 228 1 2 . 1 1 5 5 GLN H H 5 8.322 8.322 8.486 -0.164 19610 229 1 2 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.378 -0.000 19610 230 1 2 . 1 1 6 6 PRO C C 6 176.816 176.816 176.562 0.254 19610 231 1 2 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.538 0.619 19610 232 1 2 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.220 -0.134 19610 233 1 2 . 1 1 7 7 GLN N N 7 121.005 121.005 118.593 2.412 19610 234 1 2 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.197 0.048 19610 235 1 2 . 1 1 7 7 GLN C C 7 175.941 175.941 176.079 -0.138 19610 236 1 2 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.706 0.079 19610 237 1 2 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.183 0.312 19610 238 1 2 . 1 1 7 7 GLN H H 7 8.576 8.576 8.303 0.273 19610 239 1 2 . 1 1 8 8 ARG N N 8 122.928 122.928 120.761 2.167 19610 240 1 2 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.174 0.113 19610 241 1 2 . 1 1 8 8 ARG C C 8 176.061 176.061 176.337 -0.276 19610 242 1 2 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.554 -0.558 19610 243 1 2 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.037 0.779 19610 244 1 2 . 1 1 8 8 ARG H H 8 8.449 8.449 8.462 -0.013 19610 245 1 2 . 1 1 9 9 MET N N 9 122.430 122.430 123.283 -0.853 19610 246 1 2 . 1 1 9 9 MET HA H 9 4.450 4.450 4.515 -0.065 19610 247 1 2 . 1 1 9 9 MET C C 9 175.469 175.469 176.730 -1.261 19610 248 1 2 . 1 1 9 9 MET CA C 9 54.941 54.941 55.150 -0.209 19610 249 1 2 . 1 1 9 9 MET CB C 9 33.058 33.058 32.774 0.284 19610 250 1 2 . 1 1 9 9 MET H H 9 8.471 8.471 8.289 0.182 19610 251 1 2 . 1 1 10 10 ALA N N 10 127.153 127.153 128.082 -0.929 19610 252 1 2 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.587 -0.046 19610 253 1 2 . 1 1 10 10 ALA C C 10 175.353 175.353 176.639 -1.286 19610 254 1 2 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.514 -0.027 19610 255 1 2 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.956 -0.925 19610 256 1 2 . 1 1 10 10 ALA H H 10 8.398 8.398 8.250 0.148 19610 257 1 2 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.454 -0.016 19610 258 1 2 . 1 1 11 11 PRO C C 11 176.896 176.896 176.417 0.479 19610 259 1 2 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.154 -1.299 19610 260 1 2 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.219 -0.199 19610 261 1 2 . 1 1 12 12 VAL N N 12 120.652 120.652 117.317 3.335 19610 262 1 2 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.203 -0.113 19610 263 1 2 . 1 1 12 12 VAL C C 12 176.825 176.825 174.847 1.978 19610 264 1 2 . 1 1 12 12 VAL CA C 12 62.403 62.403 62.091 0.312 19610 265 1 2 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.525 -1.624 19610 266 1 2 . 1 1 12 12 VAL H H 12 8.373 8.373 7.642 0.731 19610 267 1 2 . 1 1 13 13 GLY N N 13 112.483 112.483 111.112 1.371 19610 268 1 2 . 1 1 13 13 GLY C C 13 174.515 174.515 175.107 -0.592 19610 269 1 2 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.489 -0.161 19610 270 1 2 . 1 1 13 13 GLY H H 13 8.605 8.605 8.513 0.092 19610 271 1 2 . 1 1 14 14 THR N N 14 113.531 113.531 116.765 -3.234 19610 272 1 2 . 1 1 14 14 THR HA H 14 4.309 4.309 4.415 -0.106 19610 273 1 2 . 1 1 14 14 THR C C 14 174.742 174.742 175.314 -0.572 19610 274 1 2 . 1 1 14 14 THR CA C 14 62.130 62.130 63.300 -1.170 19610 275 1 2 . 1 1 14 14 THR CB C 14 69.981 69.981 68.976 1.005 19610 276 1 2 . 1 1 14 14 THR H H 14 8.164 8.164 8.104 0.060 19610 277 1 2 . 1 1 15 15 ASP N N 15 122.439 122.439 120.660 1.779 19610 278 1 2 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.436 0.074 19610 279 1 2 . 1 1 15 15 ASP C C 15 177.216 177.216 178.329 -1.113 19610 280 1 2 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.399 -2.137 19610 281 1 2 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.731 -0.038 19610 282 1 2 . 1 1 15 15 ASP H H 15 8.537 8.537 8.683 -0.146 19610 283 1 2 . 1 1 16 16 LYS N N 16 122.807 122.807 118.092 4.715 19610 284 1 2 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.154 -0.036 19610 285 1 2 . 1 1 16 16 LYS C C 16 177.430 177.430 179.159 -1.729 19610 286 1 2 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.400 -0.507 19610 287 1 2 . 1 1 16 16 LYS CB C 16 32.539 32.539 32.043 0.496 19610 288 1 2 . 1 1 16 16 LYS H H 16 8.288 8.288 7.447 0.841 19610 289 1 2 . 1 1 17 17 GLU N N 17 119.492 119.492 120.038 -0.546 19610 290 1 2 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.116 -0.004 19610 291 1 2 . 1 1 17 17 GLU C C 17 178.007 178.007 179.048 -1.041 19610 292 1 2 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.359 -1.107 19610 293 1 2 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.722 -0.075 19610 294 1 2 . 1 1 17 17 GLU H H 17 8.221 8.221 7.539 0.682 19610 295 1 2 . 1 1 18 18 LEU N N 18 119.493 119.493 116.712 2.781 19610 296 1 2 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.192 -0.046 19610 297 1 2 . 1 1 18 18 LEU C C 18 178.359 178.359 178.958 -0.599 19610 298 1 2 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.763 -1.341 19610 299 1 2 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.065 0.695 19610 300 1 2 . 1 1 18 18 LEU H H 18 7.998 7.998 8.106 -0.108 19610 301 1 2 . 1 1 19 19 SER N N 19 114.728 114.728 115.248 -0.520 19610 302 1 2 . 1 1 19 19 SER HA H 19 4.113 4.113 4.124 -0.011 19610 303 1 2 . 1 1 19 19 SER C C 19 175.912 175.912 176.613 -0.701 19610 304 1 2 . 1 1 19 19 SER CA C 19 60.881 60.881 61.831 -0.951 19610 305 1 2 . 1 1 19 19 SER CB C 19 63.043 63.043 62.828 0.215 19610 306 1 2 . 1 1 19 19 SER H H 19 8.068 8.068 8.006 0.062 19610 307 1 2 . 1 1 20 20 ASP N N 20 121.206 121.206 121.507 -0.301 19610 308 1 2 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.434 0.014 19610 309 1 2 . 1 1 20 20 ASP C C 20 177.598 177.598 178.314 -0.716 19610 310 1 2 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.546 -0.551 19610 311 1 2 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.063 -0.524 19610 312 1 2 . 1 1 20 20 ASP H H 20 8.301 8.301 7.716 0.585 19610 313 1 2 . 1 1 21 21 LEU N N 21 119.944 119.944 119.372 0.572 19610 314 1 2 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.566 -0.424 19610 315 1 2 . 1 1 21 21 LEU C C 21 177.822 177.822 177.970 -0.148 19610 316 1 2 . 1 1 21 21 LEU CA C 21 56.439 56.439 56.285 0.154 19610 317 1 2 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.677 0.575 19610 318 1 2 . 1 1 21 21 LEU H H 21 7.807 7.807 8.045 -0.238 19610 319 1 2 . 1 1 22 22 LEU N N 22 119.558 119.558 121.415 -1.857 19610 320 1 2 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.099 -0.023 19610 321 1 2 . 1 1 22 22 LEU C C 22 177.131 177.131 178.413 -1.282 19610 322 1 2 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.529 -1.474 19610 323 1 2 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.526 0.318 19610 324 1 2 . 1 1 22 22 LEU H H 22 7.878 7.878 7.793 0.085 19610 325 1 2 . 1 1 23 23 ASP N N 23 119.509 119.509 119.860 -0.351 19610 326 1 2 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.220 0.244 19610 327 1 2 . 1 1 23 23 ASP C C 23 177.379 177.379 178.326 -0.947 19610 328 1 2 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.571 -2.644 19610 329 1 2 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.507 0.232 19610 330 1 2 . 1 1 23 23 ASP H H 23 7.990 7.990 7.640 0.350 19610 331 1 2 . 1 1 24 24 PHE N N 24 121.219 121.219 117.431 3.788 19610 332 1 2 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.187 0.279 19610 333 1 2 . 1 1 24 24 PHE C C 24 176.875 176.875 177.705 -0.830 19610 334 1 2 . 1 1 24 24 PHE CA C 24 59.229 59.229 60.483 -1.254 19610 335 1 2 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.232 0.775 19610 336 1 2 . 1 1 24 24 PHE H H 24 8.204 8.204 7.295 0.909 19610 337 1 2 . 1 1 25 25 SER N N 25 115.500 115.500 116.162 -0.662 19610 338 1 2 . 1 1 25 25 SER HA H 25 4.108 4.108 4.531 -0.423 19610 339 1 2 . 1 1 25 25 SER C C 25 175.386 175.386 175.919 -0.533 19610 340 1 2 . 1 1 25 25 SER CA C 25 60.758 60.758 61.412 -0.654 19610 341 1 2 . 1 1 25 25 SER CB C 25 62.998 62.998 63.022 -0.024 19610 342 1 2 . 1 1 25 25 SER H H 25 8.326 8.326 7.999 0.327 19610 343 1 2 . 1 1 26 26 MET N N 26 119.723 119.723 116.897 2.826 19610 344 1 2 . 1 1 26 26 MET HA H 26 4.363 4.363 4.428 -0.065 19610 345 1 2 . 1 1 26 26 MET C C 26 176.450 176.450 177.801 -1.351 19610 346 1 2 . 1 1 26 26 MET CA C 26 55.949 55.949 56.878 -0.929 19610 347 1 2 . 1 1 26 26 MET CB C 26 31.868 31.868 32.550 -0.682 19610 348 1 2 . 1 1 26 26 MET H H 26 7.889 7.889 7.719 0.170 19610 349 1 2 . 1 1 27 27 MET N N 27 117.872 117.872 118.779 -0.907 19610 350 1 2 . 1 1 27 27 MET HA H 27 4.186 4.186 4.247 -0.061 19610 351 1 2 . 1 1 27 27 MET C C 27 175.341 175.341 176.819 -1.478 19610 352 1 2 . 1 1 27 27 MET CA C 27 56.102 56.102 57.654 -1.552 19610 353 1 2 . 1 1 27 27 MET CB C 27 33.161 33.161 33.163 -0.002 19610 354 1 2 . 1 1 27 27 MET H H 27 7.656 7.656 7.527 0.129 19610 355 1 2 . 1 1 28 28 PHE N N 28 118.702 118.702 119.181 -0.479 19610 356 1 2 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.417 0.387 19610 357 1 2 . 1 1 28 28 PHE C C 28 173.132 173.132 174.694 -1.562 19610 358 1 2 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.127 -2.332 19610 359 1 2 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.421 0.308 19610 360 1 2 . 1 1 28 28 PHE H H 28 7.682 7.682 7.689 -0.007 19610 361 1 2 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.545 -0.084 19610 362 1 2 . 1 1 29 29 PRO C C 29 176.360 176.360 175.968 0.392 19610 363 1 2 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.221 -0.401 19610 364 1 2 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.667 -0.086 19610 365 1 2 . 1 1 30 30 LEU N N 30 123.391 123.391 122.594 0.797 19610 366 1 2 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.633 -0.094 19610 367 1 2 . 1 1 30 30 LEU C C 30 175.365 175.365 176.194 -0.829 19610 368 1 2 . 1 1 30 30 LEU CA C 30 52.911 52.911 52.871 0.040 19610 369 1 2 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.827 -0.154 19610 370 1 2 . 1 1 30 30 LEU H H 30 8.284 8.284 7.641 0.643 19610 371 1 2 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.508 -0.070 19610 372 1 2 . 1 1 31 31 PRO C C 31 176.688 176.688 175.826 0.862 19610 373 1 2 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.538 0.343 19610 374 1 2 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.112 1.931 19610 375 1 2 . 1 1 32 32 VAL N N 32 120.844 120.844 126.065 -5.221 19610 376 1 2 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.004 0.136 19610 377 1 2 . 1 1 32 32 VAL C C 32 176.579 176.579 175.296 1.283 19610 378 1 2 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.747 -0.506 19610 379 1 2 . 1 1 32 32 VAL CB C 32 32.809 32.809 30.366 2.443 19610 380 1 2 . 1 1 32 32 VAL H H 32 8.344 8.344 7.914 0.430 19610 381 1 2 . 1 1 33 33 THR N N 33 118.041 118.041 119.964 -1.923 19610 382 1 2 . 1 1 33 33 THR HA H 33 4.373 4.373 4.648 -0.275 19610 383 1 2 . 1 1 33 33 THR C C 33 174.172 174.172 174.264 -0.092 19610 384 1 2 . 1 1 33 33 THR CA C 33 61.407 61.407 61.161 0.246 19610 385 1 2 . 1 1 33 33 THR CB C 33 69.891 69.891 70.052 -0.161 19610 386 1 2 . 1 1 33 33 THR H H 33 8.326 8.326 7.882 0.444 19610 387 1 2 . 1 1 34 34 ASN N N 34 121.367 121.367 122.588 -1.221 19610 388 1 2 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.703 0.006 19610 389 1 2 . 1 1 34 34 ASN C C 34 175.639 175.639 175.211 0.428 19610 390 1 2 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.817 -0.599 19610 391 1 2 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.837 0.120 19610 392 1 2 . 1 1 34 34 ASN H H 34 8.526 8.526 8.892 -0.366 19610 393 1 2 . 1 1 35 35 GLY N N 35 109.437 109.437 110.029 -0.592 19610 394 1 2 . 1 1 35 35 GLY C C 35 174.112 174.112 174.384 -0.272 19610 395 1 2 . 1 1 35 35 GLY CA C 35 45.370 45.370 44.857 0.513 19610 396 1 2 . 1 1 35 35 GLY H H 35 8.449 8.449 8.488 -0.039 19610 397 1 2 . 1 1 36 36 LYS N N 36 120.614 120.614 120.790 -0.176 19610 398 1 2 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.280 0.023 19610 399 1 2 . 1 1 36 36 LYS C C 36 177.182 177.182 176.294 0.888 19610 400 1 2 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.130 0.170 19610 401 1 2 . 1 1 36 36 LYS CB C 36 32.895 32.895 31.165 1.730 19610 402 1 2 . 1 1 36 36 LYS H H 36 8.261 8.261 8.221 0.040 19610 403 1 2 . 1 1 37 37 GLY N N 37 110.011 110.011 114.520 -4.509 19610 404 1 2 . 1 1 37 37 GLY C C 37 173.463 173.463 174.044 -0.581 19610 405 1 2 . 1 1 37 37 GLY CA C 37 45.122 45.122 44.950 0.172 19610 406 1 2 . 1 1 37 37 GLY H H 37 8.484 8.484 8.438 0.046 19610 407 1 2 . 1 1 38 38 ARG N N 38 121.698 121.698 121.944 -0.246 19610 408 1 2 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.650 -0.031 19610 409 1 2 . 1 1 38 38 ARG C C 38 173.448 173.448 174.592 -1.144 19610 410 1 2 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.892 -1.190 19610 411 1 2 . 1 1 38 38 ARG CB C 38 30.121 30.121 31.216 -1.095 19610 412 1 2 . 1 1 38 38 ARG H H 38 8.105 8.105 8.528 -0.423 19610 413 1 3 . 1 1 2 2 SER HA H 2 4.472 4.472 4.284 0.188 19610 414 1 3 . 1 1 2 2 SER C C 2 174.628 174.628 175.487 -0.859 19610 415 1 3 . 1 1 2 2 SER CA C 2 58.397 58.397 59.322 -0.924 19610 416 1 3 . 1 1 2 2 SER CB C 2 63.896 63.896 63.272 0.624 19610 417 1 3 . 1 1 3 3 MET N N 3 122.147 122.147 123.215 -1.068 19610 418 1 3 . 1 1 3 3 MET HA H 3 4.490 4.490 4.485 0.005 19610 419 1 3 . 1 1 3 3 MET C C 3 175.934 175.934 174.807 1.127 19610 420 1 3 . 1 1 3 3 MET CA C 3 55.552 55.552 54.884 0.668 19610 421 1 3 . 1 1 3 3 MET CB C 3 32.645 32.645 30.925 1.720 19610 422 1 3 . 1 1 3 3 MET H H 3 8.627 8.627 7.897 0.730 19610 423 1 3 . 1 1 4 4 ASN N N 4 119.930 119.930 122.743 -2.813 19610 424 1 3 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.813 -0.159 19610 425 1 3 . 1 1 4 4 ASN C C 4 174.695 174.695 174.023 0.672 19610 426 1 3 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.403 -0.166 19610 427 1 3 . 1 1 4 4 ASN CB C 4 38.768 38.768 40.229 -1.461 19610 428 1 3 . 1 1 4 4 ASN H H 4 8.497 8.497 7.985 0.512 19610 429 1 3 . 1 1 5 5 GLN N N 5 121.523 121.523 122.956 -1.433 19610 430 1 3 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.634 -0.041 19610 431 1 3 . 1 1 5 5 GLN C C 5 173.849 173.849 174.632 -0.783 19610 432 1 3 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.061 -0.337 19610 433 1 3 . 1 1 5 5 GLN CB C 5 28.914 28.914 29.212 -0.298 19610 434 1 3 . 1 1 5 5 GLN H H 5 8.322 8.322 8.507 -0.185 19610 435 1 3 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.424 -0.046 19610 436 1 3 . 1 1 6 6 PRO C C 6 176.816 176.816 176.471 0.345 19610 437 1 3 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.444 0.713 19610 438 1 3 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.180 -0.094 19610 439 1 3 . 1 1 7 7 GLN N N 7 121.005 121.005 120.330 0.675 19610 440 1 3 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.221 0.024 19610 441 1 3 . 1 1 7 7 GLN C C 7 175.941 175.941 176.215 -0.274 19610 442 1 3 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.877 -0.092 19610 443 1 3 . 1 1 7 7 GLN CB C 7 29.495 29.495 28.682 0.813 19610 444 1 3 . 1 1 7 7 GLN H H 7 8.576 8.576 8.365 0.211 19610 445 1 3 . 1 1 8 8 ARG N N 8 122.928 122.928 122.134 0.794 19610 446 1 3 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.210 0.077 19610 447 1 3 . 1 1 8 8 ARG C C 8 176.061 176.061 176.112 -0.051 19610 448 1 3 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.175 -0.179 19610 449 1 3 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.966 0.850 19610 450 1 3 . 1 1 8 8 ARG H H 8 8.449 8.449 8.328 0.121 19610 451 1 3 . 1 1 9 9 MET N N 9 122.430 122.430 122.505 -0.075 19610 452 1 3 . 1 1 9 9 MET HA H 9 4.450 4.450 4.549 -0.099 19610 453 1 3 . 1 1 9 9 MET C C 9 175.469 175.469 175.567 -0.098 19610 454 1 3 . 1 1 9 9 MET CA C 9 54.941 54.941 55.103 -0.162 19610 455 1 3 . 1 1 9 9 MET CB C 9 33.058 33.058 33.164 -0.106 19610 456 1 3 . 1 1 9 9 MET H H 9 8.471 8.471 8.104 0.367 19610 457 1 3 . 1 1 10 10 ALA N N 10 127.153 127.153 124.011 3.142 19610 458 1 3 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.615 -0.074 19610 459 1 3 . 1 1 10 10 ALA C C 10 175.353 175.353 176.427 -1.074 19610 460 1 3 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.301 0.186 19610 461 1 3 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.866 -0.835 19610 462 1 3 . 1 1 10 10 ALA H H 10 8.398 8.398 8.389 0.009 19610 463 1 3 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.372 0.066 19610 464 1 3 . 1 1 11 11 PRO C C 11 176.896 176.896 176.685 0.211 19610 465 1 3 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.595 -0.740 19610 466 1 3 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.268 -0.247 19610 467 1 3 . 1 1 12 12 VAL N N 12 120.652 120.652 116.947 3.705 19610 468 1 3 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.247 -0.157 19610 469 1 3 . 1 1 12 12 VAL C C 12 176.825 176.825 174.057 2.768 19610 470 1 3 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.520 0.883 19610 471 1 3 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.599 -1.698 19610 472 1 3 . 1 1 12 12 VAL H H 12 8.373 8.373 7.499 0.874 19610 473 1 3 . 1 1 13 13 GLY N N 13 112.483 112.483 114.163 -1.680 19610 474 1 3 . 1 1 13 13 GLY C C 13 174.515 174.515 174.797 -0.282 19610 475 1 3 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.660 -0.332 19610 476 1 3 . 1 1 13 13 GLY H H 13 8.605 8.605 8.428 0.177 19610 477 1 3 . 1 1 14 14 THR N N 14 113.531 113.531 117.018 -3.487 19610 478 1 3 . 1 1 14 14 THR HA H 14 4.309 4.309 4.197 0.112 19610 479 1 3 . 1 1 14 14 THR C C 14 174.742 174.742 175.694 -0.952 19610 480 1 3 . 1 1 14 14 THR CA C 14 62.130 62.130 64.673 -2.543 19610 481 1 3 . 1 1 14 14 THR CB C 14 69.981 69.981 68.763 1.218 19610 482 1 3 . 1 1 14 14 THR H H 14 8.164 8.164 8.093 0.071 19610 483 1 3 . 1 1 15 15 ASP N N 15 122.439 122.439 120.378 2.061 19610 484 1 3 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.406 0.104 19610 485 1 3 . 1 1 15 15 ASP C C 15 177.216 177.216 178.202 -0.986 19610 486 1 3 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.959 -2.697 19610 487 1 3 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.736 -0.043 19610 488 1 3 . 1 1 15 15 ASP H H 15 8.537 8.537 8.670 -0.133 19610 489 1 3 . 1 1 16 16 LYS N N 16 122.807 122.807 118.247 4.560 19610 490 1 3 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.107 0.011 19610 491 1 3 . 1 1 16 16 LYS C C 16 177.430 177.430 179.356 -1.926 19610 492 1 3 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.523 -0.630 19610 493 1 3 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.887 0.652 19610 494 1 3 . 1 1 16 16 LYS H H 16 8.288 8.288 7.508 0.780 19610 495 1 3 . 1 1 17 17 GLU N N 17 119.492 119.492 119.538 -0.046 19610 496 1 3 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.168 -0.056 19610 497 1 3 . 1 1 17 17 GLU C C 17 178.007 178.007 178.999 -0.992 19610 498 1 3 . 1 1 17 17 GLU CA C 17 58.252 58.252 58.987 -0.735 19610 499 1 3 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.579 0.068 19610 500 1 3 . 1 1 17 17 GLU H H 17 8.221 8.221 7.572 0.649 19610 501 1 3 . 1 1 18 18 LEU N N 18 119.493 119.493 117.447 2.046 19610 502 1 3 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.259 -0.112 19610 503 1 3 . 1 1 18 18 LEU C C 18 178.359 178.359 179.323 -0.964 19610 504 1 3 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.527 -1.105 19610 505 1 3 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.160 0.599 19610 506 1 3 . 1 1 18 18 LEU H H 18 7.998 7.998 8.094 -0.096 19610 507 1 3 . 1 1 19 19 SER N N 19 114.728 114.728 114.127 0.601 19610 508 1 3 . 1 1 19 19 SER HA H 19 4.113 4.113 4.123 -0.010 19610 509 1 3 . 1 1 19 19 SER C C 19 175.912 175.912 176.223 -0.311 19610 510 1 3 . 1 1 19 19 SER CA C 19 60.881 60.881 61.823 -0.942 19610 511 1 3 . 1 1 19 19 SER CB C 19 63.043 63.043 63.000 0.043 19610 512 1 3 . 1 1 19 19 SER H H 19 8.068 8.068 8.098 -0.030 19610 513 1 3 . 1 1 20 20 ASP N N 20 121.206 121.206 121.811 -0.605 19610 514 1 3 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.474 -0.026 19610 515 1 3 . 1 1 20 20 ASP C C 20 177.598 177.598 178.202 -0.604 19610 516 1 3 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.606 -0.611 19610 517 1 3 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.123 -0.584 19610 518 1 3 . 1 1 20 20 ASP H H 20 8.301 8.301 7.609 0.692 19610 519 1 3 . 1 1 21 21 LEU N N 21 119.944 119.944 119.487 0.457 19610 520 1 3 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.604 -0.462 19610 521 1 3 . 1 1 21 21 LEU C C 21 177.822 177.822 178.073 -0.251 19610 522 1 3 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.738 0.701 19610 523 1 3 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.380 0.872 19610 524 1 3 . 1 1 21 21 LEU H H 21 7.807 7.807 8.034 -0.227 19610 525 1 3 . 1 1 22 22 LEU N N 22 119.558 119.558 121.468 -1.910 19610 526 1 3 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.058 0.018 19610 527 1 3 . 1 1 22 22 LEU C C 22 177.131 177.131 177.844 -0.713 19610 528 1 3 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.089 -2.034 19610 529 1 3 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.501 0.343 19610 530 1 3 . 1 1 22 22 LEU H H 22 7.878 7.878 7.626 0.252 19610 531 1 3 . 1 1 23 23 ASP N N 23 119.509 119.509 118.670 0.839 19610 532 1 3 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.230 0.234 19610 533 1 3 . 1 1 23 23 ASP C C 23 177.379 177.379 177.965 -0.586 19610 534 1 3 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.437 -2.510 19610 535 1 3 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.255 0.484 19610 536 1 3 . 1 1 23 23 ASP H H 23 7.990 7.990 7.732 0.258 19610 537 1 3 . 1 1 24 24 PHE N N 24 121.219 121.219 116.941 4.278 19610 538 1 3 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.270 0.196 19610 539 1 3 . 1 1 24 24 PHE C C 24 176.875 176.875 177.776 -0.901 19610 540 1 3 . 1 1 24 24 PHE CA C 24 59.229 59.229 60.303 -1.073 19610 541 1 3 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.323 0.684 19610 542 1 3 . 1 1 24 24 PHE H H 24 8.204 8.204 7.274 0.930 19610 543 1 3 . 1 1 25 25 SER N N 25 115.500 115.500 115.759 -0.259 19610 544 1 3 . 1 1 25 25 SER HA H 25 4.108 4.108 4.595 -0.487 19610 545 1 3 . 1 1 25 25 SER C C 25 175.386 175.386 176.247 -0.861 19610 546 1 3 . 1 1 25 25 SER CA C 25 60.758 60.758 61.405 -0.647 19610 547 1 3 . 1 1 25 25 SER CB C 25 62.998 62.998 63.442 -0.444 19610 548 1 3 . 1 1 25 25 SER H H 25 8.326 8.326 8.100 0.226 19610 549 1 3 . 1 1 26 26 MET N N 26 119.723 119.723 115.803 3.920 19610 550 1 3 . 1 1 26 26 MET HA H 26 4.363 4.363 4.529 -0.166 19610 551 1 3 . 1 1 26 26 MET C C 26 176.450 176.450 177.646 -1.196 19610 552 1 3 . 1 1 26 26 MET CA C 26 55.949 55.949 57.390 -1.441 19610 553 1 3 . 1 1 26 26 MET CB C 26 31.868 31.868 32.996 -1.128 19610 554 1 3 . 1 1 26 26 MET H H 26 7.889 7.889 7.912 -0.023 19610 555 1 3 . 1 1 27 27 MET N N 27 117.872 117.872 119.114 -1.242 19610 556 1 3 . 1 1 27 27 MET HA H 27 4.186 4.186 4.252 -0.066 19610 557 1 3 . 1 1 27 27 MET C C 27 175.341 175.341 176.924 -1.583 19610 558 1 3 . 1 1 27 27 MET CA C 27 56.102 56.102 57.354 -1.252 19610 559 1 3 . 1 1 27 27 MET CB C 27 33.161 33.161 33.177 -0.016 19610 560 1 3 . 1 1 27 27 MET H H 27 7.656 7.656 7.416 0.240 19610 561 1 3 . 1 1 28 28 PHE N N 28 118.702 118.702 121.473 -2.771 19610 562 1 3 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.426 0.378 19610 563 1 3 . 1 1 28 28 PHE C C 28 173.132 173.132 175.124 -1.992 19610 564 1 3 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.379 -2.584 19610 565 1 3 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.337 0.393 19610 566 1 3 . 1 1 28 28 PHE H H 28 7.682 7.682 7.779 -0.097 19610 567 1 3 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.405 0.056 19610 568 1 3 . 1 1 29 29 PRO C C 29 176.360 176.360 176.484 -0.124 19610 569 1 3 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.299 -0.479 19610 570 1 3 . 1 1 29 29 PRO CB C 29 31.581 31.581 32.084 -0.503 19610 571 1 3 . 1 1 30 30 LEU N N 30 123.391 123.391 122.680 0.711 19610 572 1 3 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.385 0.154 19610 573 1 3 . 1 1 30 30 LEU C C 30 175.365 175.365 176.296 -0.931 19610 574 1 3 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.687 -0.776 19610 575 1 3 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.459 0.214 19610 576 1 3 . 1 1 30 30 LEU H H 30 8.284 8.284 7.690 0.594 19610 577 1 3 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.465 -0.027 19610 578 1 3 . 1 1 31 31 PRO C C 31 176.688 176.688 175.848 0.840 19610 579 1 3 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.591 0.289 19610 580 1 3 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.340 1.703 19610 581 1 3 . 1 1 32 32 VAL N N 32 120.844 120.844 121.399 -0.555 19610 582 1 3 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.968 0.172 19610 583 1 3 . 1 1 32 32 VAL C C 32 176.579 176.579 176.149 0.430 19610 584 1 3 . 1 1 32 32 VAL CA C 32 62.241 62.241 63.020 -0.779 19610 585 1 3 . 1 1 32 32 VAL CB C 32 32.809 32.809 32.691 0.118 19610 586 1 3 . 1 1 32 32 VAL H H 32 8.344 8.344 7.827 0.517 19610 587 1 3 . 1 1 33 33 THR N N 33 118.041 118.041 117.592 0.449 19610 588 1 3 . 1 1 33 33 THR HA H 33 4.373 4.373 4.568 -0.195 19610 589 1 3 . 1 1 33 33 THR C C 33 174.172 174.172 174.297 -0.125 19610 590 1 3 . 1 1 33 33 THR CA C 33 61.407 61.407 61.171 0.236 19610 591 1 3 . 1 1 33 33 THR CB C 33 69.891 69.891 68.945 0.946 19610 592 1 3 . 1 1 33 33 THR H H 33 8.326 8.326 7.991 0.335 19610 593 1 3 . 1 1 34 34 ASN N N 34 121.367 121.367 120.301 1.066 19610 594 1 3 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.721 -0.012 19610 595 1 3 . 1 1 34 34 ASN C C 34 175.639 175.639 175.653 -0.014 19610 596 1 3 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.190 0.028 19610 597 1 3 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.731 0.226 19610 598 1 3 . 1 1 34 34 ASN H H 34 8.526 8.526 8.180 0.346 19610 599 1 3 . 1 1 35 35 GLY N N 35 109.437 109.437 107.692 1.745 19610 600 1 3 . 1 1 35 35 GLY C C 35 174.112 174.112 174.507 -0.395 19610 601 1 3 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.087 0.283 19610 602 1 3 . 1 1 35 35 GLY H H 35 8.449 8.449 8.065 0.384 19610 603 1 3 . 1 1 36 36 LYS N N 36 120.614 120.614 121.295 -0.681 19610 604 1 3 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.302 0.001 19610 605 1 3 . 1 1 36 36 LYS C C 36 177.182 177.182 177.447 -0.265 19610 606 1 3 . 1 1 36 36 LYS CA C 36 56.300 56.300 55.815 0.485 19610 607 1 3 . 1 1 36 36 LYS CB C 36 32.895 32.895 31.235 1.660 19610 608 1 3 . 1 1 36 36 LYS H H 36 8.261 8.261 7.995 0.266 19610 609 1 3 . 1 1 37 37 GLY N N 37 110.011 110.011 111.838 -1.827 19610 610 1 3 . 1 1 37 37 GLY C C 37 173.463 173.463 173.794 -0.331 19610 611 1 3 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.818 -0.696 19610 612 1 3 . 1 1 37 37 GLY H H 37 8.484 8.484 8.508 -0.024 19610 613 1 3 . 1 1 38 38 ARG N N 38 121.698 121.698 118.982 2.716 19610 614 1 3 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.735 -0.116 19610 615 1 3 . 1 1 38 38 ARG C C 38 173.448 173.448 173.605 -0.157 19610 616 1 3 . 1 1 38 38 ARG CA C 38 53.702 53.702 53.423 0.279 19610 617 1 3 . 1 1 38 38 ARG CB C 38 30.121 30.121 29.842 0.279 19610 618 1 3 . 1 1 38 38 ARG H H 38 8.105 8.105 7.792 0.313 19610 619 1 4 . 1 1 2 2 SER HA H 2 4.472 4.472 4.760 -0.288 19610 620 1 4 . 1 1 2 2 SER C C 2 174.628 174.628 174.640 -0.012 19610 621 1 4 . 1 1 2 2 SER CA C 2 58.397 58.397 58.074 0.323 19610 622 1 4 . 1 1 2 2 SER CB C 2 63.896 63.896 64.505 -0.609 19610 623 1 4 . 1 1 3 3 MET N N 3 122.147 122.147 123.322 -1.175 19610 624 1 4 . 1 1 3 3 MET HA H 3 4.490 4.490 4.406 0.084 19610 625 1 4 . 1 1 3 3 MET C C 3 175.934 175.934 176.494 -0.560 19610 626 1 4 . 1 1 3 3 MET CA C 3 55.552 55.552 55.960 -0.408 19610 627 1 4 . 1 1 3 3 MET CB C 3 32.645 32.645 33.154 -0.509 19610 628 1 4 . 1 1 3 3 MET H H 3 8.627 8.627 8.374 0.253 19610 629 1 4 . 1 1 4 4 ASN N N 4 119.930 119.930 120.527 -0.597 19610 630 1 4 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.693 -0.039 19610 631 1 4 . 1 1 4 4 ASN C C 4 174.695 174.695 174.619 0.076 19610 632 1 4 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.195 0.042 19610 633 1 4 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.727 0.041 19610 634 1 4 . 1 1 4 4 ASN H H 4 8.497 8.497 8.214 0.283 19610 635 1 4 . 1 1 5 5 GLN N N 5 121.523 121.523 124.594 -3.071 19610 636 1 4 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.554 0.039 19610 637 1 4 . 1 1 5 5 GLN C C 5 173.849 173.849 174.351 -0.502 19610 638 1 4 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.861 -1.137 19610 639 1 4 . 1 1 5 5 GLN CB C 5 28.914 28.914 27.977 0.937 19610 640 1 4 . 1 1 5 5 GLN H H 5 8.322 8.322 8.463 -0.141 19610 641 1 4 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.654 -0.276 19610 642 1 4 . 1 1 6 6 PRO C C 6 176.816 176.816 176.247 0.569 19610 643 1 4 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.427 0.730 19610 644 1 4 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.473 -0.387 19610 645 1 4 . 1 1 7 7 GLN N N 7 121.005 121.005 117.931 3.074 19610 646 1 4 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.328 -0.083 19610 647 1 4 . 1 1 7 7 GLN C C 7 175.941 175.941 176.095 -0.154 19610 648 1 4 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.403 0.382 19610 649 1 4 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.374 0.121 19610 650 1 4 . 1 1 7 7 GLN H H 7 8.576 8.576 8.291 0.285 19610 651 1 4 . 1 1 8 8 ARG N N 8 122.928 122.928 121.559 1.369 19610 652 1 4 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.268 0.019 19610 653 1 4 . 1 1 8 8 ARG C C 8 176.061 176.061 176.288 -0.227 19610 654 1 4 . 1 1 8 8 ARG CA C 8 55.996 55.996 55.890 0.106 19610 655 1 4 . 1 1 8 8 ARG CB C 8 30.816 30.816 28.400 2.416 19610 656 1 4 . 1 1 8 8 ARG H H 8 8.449 8.449 8.566 -0.117 19610 657 1 4 . 1 1 9 9 MET N N 9 122.430 122.430 120.539 1.891 19610 658 1 4 . 1 1 9 9 MET HA H 9 4.450 4.450 4.498 -0.048 19610 659 1 4 . 1 1 9 9 MET C C 9 175.469 175.469 176.483 -1.014 19610 660 1 4 . 1 1 9 9 MET CA C 9 54.941 54.941 54.593 0.348 19610 661 1 4 . 1 1 9 9 MET CB C 9 33.058 33.058 32.215 0.843 19610 662 1 4 . 1 1 9 9 MET H H 9 8.471 8.471 8.254 0.217 19610 663 1 4 . 1 1 10 10 ALA N N 10 127.153 127.153 128.878 -1.725 19610 664 1 4 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.403 0.138 19610 665 1 4 . 1 1 10 10 ALA C C 10 175.353 175.353 176.849 -1.496 19610 666 1 4 . 1 1 10 10 ALA CA C 10 50.487 50.487 51.115 -0.628 19610 667 1 4 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.497 -0.466 19610 668 1 4 . 1 1 10 10 ALA H H 10 8.398 8.398 8.548 -0.150 19610 669 1 4 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.536 -0.098 19610 670 1 4 . 1 1 11 11 PRO C C 11 176.896 176.896 176.772 0.124 19610 671 1 4 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.136 -1.281 19610 672 1 4 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.089 -0.068 19610 673 1 4 . 1 1 12 12 VAL N N 12 120.652 120.652 116.812 3.840 19610 674 1 4 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.253 -0.163 19610 675 1 4 . 1 1 12 12 VAL C C 12 176.825 176.825 175.426 1.399 19610 676 1 4 . 1 1 12 12 VAL CA C 12 62.403 62.403 60.447 1.956 19610 677 1 4 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.385 -0.484 19610 678 1 4 . 1 1 12 12 VAL H H 12 8.373 8.373 7.506 0.867 19610 679 1 4 . 1 1 13 13 GLY N N 13 112.483 112.483 111.225 1.258 19610 680 1 4 . 1 1 13 13 GLY C C 13 174.515 174.515 175.391 -0.876 19610 681 1 4 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.360 -1.032 19610 682 1 4 . 1 1 13 13 GLY H H 13 8.605 8.605 8.386 0.219 19610 683 1 4 . 1 1 14 14 THR N N 14 113.531 113.531 116.427 -2.896 19610 684 1 4 . 1 1 14 14 THR HA H 14 4.309 4.309 4.119 0.190 19610 685 1 4 . 1 1 14 14 THR C C 14 174.742 174.742 175.136 -0.394 19610 686 1 4 . 1 1 14 14 THR CA C 14 62.130 62.130 65.483 -3.353 19610 687 1 4 . 1 1 14 14 THR CB C 14 69.981 69.981 68.713 1.268 19610 688 1 4 . 1 1 14 14 THR H H 14 8.164 8.164 7.982 0.182 19610 689 1 4 . 1 1 15 15 ASP N N 15 122.439 122.439 120.474 1.965 19610 690 1 4 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.464 0.046 19610 691 1 4 . 1 1 15 15 ASP C C 15 177.216 177.216 178.290 -1.074 19610 692 1 4 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.448 -2.186 19610 693 1 4 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.641 0.052 19610 694 1 4 . 1 1 15 15 ASP H H 15 8.537 8.537 8.579 -0.042 19610 695 1 4 . 1 1 16 16 LYS N N 16 122.807 122.807 117.950 4.857 19610 696 1 4 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.140 -0.022 19610 697 1 4 . 1 1 16 16 LYS C C 16 177.430 177.430 179.088 -1.658 19610 698 1 4 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.470 -0.577 19610 699 1 4 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.850 0.689 19610 700 1 4 . 1 1 16 16 LYS H H 16 8.288 8.288 7.427 0.861 19610 701 1 4 . 1 1 17 17 GLU N N 17 119.492 119.492 119.691 -0.199 19610 702 1 4 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.189 -0.077 19610 703 1 4 . 1 1 17 17 GLU C C 17 178.007 178.007 178.966 -0.959 19610 704 1 4 . 1 1 17 17 GLU CA C 17 58.252 58.252 58.853 -0.601 19610 705 1 4 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.421 0.226 19610 706 1 4 . 1 1 17 17 GLU H H 17 8.221 8.221 7.674 0.547 19610 707 1 4 . 1 1 18 18 LEU N N 18 119.493 119.493 117.665 1.828 19610 708 1 4 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.255 -0.108 19610 709 1 4 . 1 1 18 18 LEU C C 18 178.359 178.359 179.319 -0.960 19610 710 1 4 . 1 1 18 18 LEU CA C 18 56.422 56.422 58.006 -1.584 19610 711 1 4 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.124 0.636 19610 712 1 4 . 1 1 18 18 LEU H H 18 7.998 7.998 7.898 0.100 19610 713 1 4 . 1 1 19 19 SER N N 19 114.728 114.728 114.442 0.286 19610 714 1 4 . 1 1 19 19 SER HA H 19 4.113 4.113 4.174 -0.061 19610 715 1 4 . 1 1 19 19 SER C C 19 175.912 175.912 176.394 -0.482 19610 716 1 4 . 1 1 19 19 SER CA C 19 60.881 60.881 61.292 -0.411 19610 717 1 4 . 1 1 19 19 SER CB C 19 63.043 63.043 62.779 0.264 19610 718 1 4 . 1 1 19 19 SER H H 19 8.068 8.068 8.009 0.059 19610 719 1 4 . 1 1 20 20 ASP N N 20 121.206 121.206 121.288 -0.082 19610 720 1 4 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.496 -0.048 19610 721 1 4 . 1 1 20 20 ASP C C 20 177.598 177.598 178.193 -0.595 19610 722 1 4 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.590 -0.595 19610 723 1 4 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.102 -0.562 19610 724 1 4 . 1 1 20 20 ASP H H 20 8.301 8.301 7.344 0.957 19610 725 1 4 . 1 1 21 21 LEU N N 21 119.944 119.944 119.888 0.056 19610 726 1 4 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.484 -0.342 19610 727 1 4 . 1 1 21 21 LEU C C 21 177.822 177.822 178.079 -0.257 19610 728 1 4 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.937 0.502 19610 729 1 4 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.384 0.868 19610 730 1 4 . 1 1 21 21 LEU H H 21 7.807 7.807 8.188 -0.381 19610 731 1 4 . 1 1 22 22 LEU N N 22 119.558 119.558 121.250 -1.692 19610 732 1 4 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.933 0.143 19610 733 1 4 . 1 1 22 22 LEU C C 22 177.131 177.131 177.741 -0.610 19610 734 1 4 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.781 -2.725 19610 735 1 4 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.640 0.204 19610 736 1 4 . 1 1 22 22 LEU H H 22 7.878 7.878 7.415 0.463 19610 737 1 4 . 1 1 23 23 ASP N N 23 119.509 119.509 119.050 0.459 19610 738 1 4 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.212 0.252 19610 739 1 4 . 1 1 23 23 ASP C C 23 177.379 177.379 178.197 -0.818 19610 740 1 4 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.136 -2.209 19610 741 1 4 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.247 0.492 19610 742 1 4 . 1 1 23 23 ASP H H 23 7.990 7.990 7.802 0.188 19610 743 1 4 . 1 1 24 24 PHE N N 24 121.219 121.219 116.663 4.556 19610 744 1 4 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.363 0.103 19610 745 1 4 . 1 1 24 24 PHE C C 24 176.875 176.875 177.608 -0.733 19610 746 1 4 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.465 -0.236 19610 747 1 4 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.439 0.568 19610 748 1 4 . 1 1 24 24 PHE H H 24 8.204 8.204 7.224 0.980 19610 749 1 4 . 1 1 25 25 SER N N 25 115.500 115.500 116.508 -1.008 19610 750 1 4 . 1 1 25 25 SER HA H 25 4.108 4.108 4.727 -0.619 19610 751 1 4 . 1 1 25 25 SER C C 25 175.386 175.386 176.255 -0.869 19610 752 1 4 . 1 1 25 25 SER CA C 25 60.758 60.758 61.388 -0.630 19610 753 1 4 . 1 1 25 25 SER CB C 25 62.998 62.998 63.419 -0.421 19610 754 1 4 . 1 1 25 25 SER H H 25 8.326 8.326 7.895 0.431 19610 755 1 4 . 1 1 26 26 MET N N 26 119.723 119.723 117.743 1.980 19610 756 1 4 . 1 1 26 26 MET HA H 26 4.363 4.363 4.529 -0.166 19610 757 1 4 . 1 1 26 26 MET C C 26 176.450 176.450 177.351 -0.901 19610 758 1 4 . 1 1 26 26 MET CA C 26 55.949 55.949 56.933 -0.984 19610 759 1 4 . 1 1 26 26 MET CB C 26 31.868 31.868 32.375 -0.507 19610 760 1 4 . 1 1 26 26 MET H H 26 7.889 7.889 8.071 -0.182 19610 761 1 4 . 1 1 27 27 MET N N 27 117.872 117.872 119.282 -1.410 19610 762 1 4 . 1 1 27 27 MET HA H 27 4.186 4.186 4.321 -0.135 19610 763 1 4 . 1 1 27 27 MET C C 27 175.341 175.341 176.845 -1.504 19610 764 1 4 . 1 1 27 27 MET CA C 27 56.102 56.102 56.657 -0.555 19610 765 1 4 . 1 1 27 27 MET CB C 27 33.161 33.161 33.456 -0.295 19610 766 1 4 . 1 1 27 27 MET H H 27 7.656 7.656 7.364 0.292 19610 767 1 4 . 1 1 28 28 PHE N N 28 118.702 118.702 121.799 -3.097 19610 768 1 4 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.448 0.356 19610 769 1 4 . 1 1 28 28 PHE C C 28 173.132 173.132 175.142 -2.010 19610 770 1 4 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.168 -2.373 19610 771 1 4 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.519 0.210 19610 772 1 4 . 1 1 28 28 PHE H H 28 7.682 7.682 7.660 0.022 19610 773 1 4 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.512 -0.051 19610 774 1 4 . 1 1 29 29 PRO C C 29 176.360 176.360 176.191 0.169 19610 775 1 4 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.017 -0.198 19610 776 1 4 . 1 1 29 29 PRO CB C 29 31.581 31.581 32.098 -0.517 19610 777 1 4 . 1 1 30 30 LEU N N 30 123.391 123.391 122.061 1.330 19610 778 1 4 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.640 -0.101 19610 779 1 4 . 1 1 30 30 LEU C C 30 175.365 175.365 176.225 -0.860 19610 780 1 4 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.316 -0.405 19610 781 1 4 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.993 -0.320 19610 782 1 4 . 1 1 30 30 LEU H H 30 8.284 8.284 7.706 0.578 19610 783 1 4 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.443 -0.005 19610 784 1 4 . 1 1 31 31 PRO C C 31 176.688 176.688 175.856 0.832 19610 785 1 4 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.733 0.147 19610 786 1 4 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.212 1.831 19610 787 1 4 . 1 1 32 32 VAL N N 32 120.844 120.844 125.200 -4.356 19610 788 1 4 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.011 0.129 19610 789 1 4 . 1 1 32 32 VAL C C 32 176.579 176.579 175.843 0.736 19610 790 1 4 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.018 0.223 19610 791 1 4 . 1 1 32 32 VAL CB C 32 32.809 32.809 32.000 0.809 19610 792 1 4 . 1 1 32 32 VAL H H 32 8.344 8.344 7.904 0.440 19610 793 1 4 . 1 1 33 33 THR N N 33 118.041 118.041 122.714 -4.673 19610 794 1 4 . 1 1 33 33 THR HA H 33 4.373 4.373 4.499 -0.126 19610 795 1 4 . 1 1 33 33 THR C C 33 174.172 174.172 174.657 -0.485 19610 796 1 4 . 1 1 33 33 THR CA C 33 61.407 61.407 61.282 0.126 19610 797 1 4 . 1 1 33 33 THR CB C 33 69.891 69.891 67.682 2.209 19610 798 1 4 . 1 1 33 33 THR H H 33 8.326 8.326 8.216 0.110 19610 799 1 4 . 1 1 34 34 ASN N N 34 121.367 121.367 120.006 1.361 19610 800 1 4 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.820 -0.111 19610 801 1 4 . 1 1 34 34 ASN C C 34 175.639 175.639 175.543 0.096 19610 802 1 4 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.307 -0.089 19610 803 1 4 . 1 1 34 34 ASN CB C 34 38.957 38.957 40.052 -1.095 19610 804 1 4 . 1 1 34 34 ASN H H 34 8.526 8.526 7.816 0.710 19610 805 1 4 . 1 1 35 35 GLY N N 35 109.437 109.437 109.546 -0.109 19610 806 1 4 . 1 1 35 35 GLY C C 35 174.112 174.112 174.146 -0.034 19610 807 1 4 . 1 1 35 35 GLY CA C 35 45.370 45.370 44.895 0.475 19610 808 1 4 . 1 1 35 35 GLY H H 35 8.449 8.449 8.315 0.134 19610 809 1 4 . 1 1 36 36 LYS N N 36 120.614 120.614 121.175 -0.561 19610 810 1 4 . 1 1 36 36 LYS HA H 36 4.303 4.303 3.894 0.409 19610 811 1 4 . 1 1 36 36 LYS C C 36 177.182 177.182 176.543 0.639 19610 812 1 4 . 1 1 36 36 LYS CA C 36 56.300 56.300 57.138 -0.838 19610 813 1 4 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.069 0.826 19610 814 1 4 . 1 1 36 36 LYS H H 36 8.261 8.261 8.153 0.108 19610 815 1 4 . 1 1 37 37 GLY N N 37 110.011 110.011 105.158 4.853 19610 816 1 4 . 1 1 37 37 GLY C C 37 173.463 173.463 173.413 0.050 19610 817 1 4 . 1 1 37 37 GLY CA C 37 45.122 45.122 44.992 0.130 19610 818 1 4 . 1 1 37 37 GLY H H 37 8.484 8.484 8.171 0.313 19610 819 1 4 . 1 1 38 38 ARG N N 38 121.698 121.698 119.127 2.571 19610 820 1 4 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.635 -0.016 19610 821 1 4 . 1 1 38 38 ARG C C 38 173.448 173.448 172.971 0.477 19610 822 1 4 . 1 1 38 38 ARG CA C 38 53.702 53.702 53.601 0.101 19610 823 1 4 . 1 1 38 38 ARG CB C 38 30.121 30.121 30.375 -0.254 19610 824 1 4 . 1 1 38 38 ARG H H 38 8.105 8.105 7.551 0.554 19610 825 1 5 . 1 1 2 2 SER HA H 2 4.472 4.472 4.614 -0.142 19610 826 1 5 . 1 1 2 2 SER C C 2 174.628 174.628 174.477 0.151 19610 827 1 5 . 1 1 2 2 SER CA C 2 58.397 58.397 57.518 0.879 19610 828 1 5 . 1 1 2 2 SER CB C 2 63.896 63.896 64.714 -0.818 19610 829 1 5 . 1 1 3 3 MET N N 3 122.147 122.147 120.590 1.557 19610 830 1 5 . 1 1 3 3 MET HA H 3 4.490 4.490 4.423 0.067 19610 831 1 5 . 1 1 3 3 MET C C 3 175.934 175.934 176.301 -0.367 19610 832 1 5 . 1 1 3 3 MET CA C 3 55.552 55.552 55.955 -0.403 19610 833 1 5 . 1 1 3 3 MET CB C 3 32.645 32.645 32.810 -0.165 19610 834 1 5 . 1 1 3 3 MET H H 3 8.627 8.627 8.379 0.248 19610 835 1 5 . 1 1 4 4 ASN N N 4 119.930 119.930 118.504 1.426 19610 836 1 5 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.954 -0.300 19610 837 1 5 . 1 1 4 4 ASN C C 4 174.695 174.695 173.871 0.824 19610 838 1 5 . 1 1 4 4 ASN CA C 4 53.237 53.237 52.950 0.287 19610 839 1 5 . 1 1 4 4 ASN CB C 4 38.768 38.768 40.551 -1.783 19610 840 1 5 . 1 1 4 4 ASN H H 4 8.497 8.497 7.881 0.616 19610 841 1 5 . 1 1 5 5 GLN N N 5 121.523 121.523 123.250 -1.727 19610 842 1 5 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.539 0.054 19610 843 1 5 . 1 1 5 5 GLN C C 5 173.849 173.849 174.652 -0.803 19610 844 1 5 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.120 -0.396 19610 845 1 5 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.070 0.844 19610 846 1 5 . 1 1 5 5 GLN H H 5 8.322 8.322 8.338 -0.016 19610 847 1 5 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.362 0.016 19610 848 1 5 . 1 1 6 6 PRO C C 6 176.816 176.816 176.477 0.339 19610 849 1 5 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.571 0.586 19610 850 1 5 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.095 -0.009 19610 851 1 5 . 1 1 7 7 GLN N N 7 121.005 121.005 118.244 2.761 19610 852 1 5 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.150 0.095 19610 853 1 5 . 1 1 7 7 GLN C C 7 175.941 175.941 175.802 0.139 19610 854 1 5 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.779 0.006 19610 855 1 5 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.149 0.346 19610 856 1 5 . 1 1 7 7 GLN H H 7 8.576 8.576 8.244 0.332 19610 857 1 5 . 1 1 8 8 ARG N N 8 122.928 122.928 122.766 0.162 19610 858 1 5 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.183 0.104 19610 859 1 5 . 1 1 8 8 ARG C C 8 176.061 176.061 176.171 -0.110 19610 860 1 5 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.271 -0.275 19610 861 1 5 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.108 0.708 19610 862 1 5 . 1 1 8 8 ARG H H 8 8.449 8.449 8.486 -0.037 19610 863 1 5 . 1 1 9 9 MET N N 9 122.430 122.430 119.694 2.736 19610 864 1 5 . 1 1 9 9 MET HA H 9 4.450 4.450 4.609 -0.159 19610 865 1 5 . 1 1 9 9 MET C C 9 175.469 175.469 176.015 -0.546 19610 866 1 5 . 1 1 9 9 MET CA C 9 54.941 54.941 55.670 -0.729 19610 867 1 5 . 1 1 9 9 MET CB C 9 33.058 33.058 32.987 0.071 19610 868 1 5 . 1 1 9 9 MET H H 9 8.471 8.471 8.072 0.399 19610 869 1 5 . 1 1 10 10 ALA N N 10 127.153 127.153 126.534 0.619 19610 870 1 5 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.571 -0.030 19610 871 1 5 . 1 1 10 10 ALA C C 10 175.353 175.353 176.715 -1.362 19610 872 1 5 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.354 0.133 19610 873 1 5 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.673 -0.642 19610 874 1 5 . 1 1 10 10 ALA H H 10 8.398 8.398 8.330 0.068 19610 875 1 5 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.339 0.099 19610 876 1 5 . 1 1 11 11 PRO C C 11 176.896 176.896 176.917 -0.021 19610 877 1 5 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.601 -0.746 19610 878 1 5 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.238 -0.217 19610 879 1 5 . 1 1 12 12 VAL N N 12 120.652 120.652 117.440 3.212 19610 880 1 5 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.298 -0.208 19610 881 1 5 . 1 1 12 12 VAL C C 12 176.825 176.825 174.954 1.871 19610 882 1 5 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.625 0.778 19610 883 1 5 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.270 -0.369 19610 884 1 5 . 1 1 12 12 VAL H H 12 8.373 8.373 7.701 0.672 19610 885 1 5 . 1 1 13 13 GLY N N 13 112.483 112.483 113.606 -1.123 19610 886 1 5 . 1 1 13 13 GLY C C 13 174.515 174.515 175.084 -0.569 19610 887 1 5 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.003 -0.675 19610 888 1 5 . 1 1 13 13 GLY H H 13 8.605 8.605 7.996 0.609 19610 889 1 5 . 1 1 14 14 THR N N 14 113.531 113.531 117.525 -3.994 19610 890 1 5 . 1 1 14 14 THR HA H 14 4.309 4.309 4.248 0.061 19610 891 1 5 . 1 1 14 14 THR C C 14 174.742 174.742 175.587 -0.845 19610 892 1 5 . 1 1 14 14 THR CA C 14 62.130 62.130 65.483 -3.353 19610 893 1 5 . 1 1 14 14 THR CB C 14 69.981 69.981 68.524 1.457 19610 894 1 5 . 1 1 14 14 THR H H 14 8.164 8.164 8.285 -0.121 19610 895 1 5 . 1 1 15 15 ASP N N 15 122.439 122.439 120.051 2.388 19610 896 1 5 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.484 0.026 19610 897 1 5 . 1 1 15 15 ASP C C 15 177.216 177.216 177.998 -0.782 19610 898 1 5 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.285 -2.023 19610 899 1 5 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.652 0.041 19610 900 1 5 . 1 1 15 15 ASP H H 15 8.537 8.537 8.595 -0.058 19610 901 1 5 . 1 1 16 16 LYS N N 16 122.807 122.807 118.469 4.338 19610 902 1 5 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.217 -0.099 19610 903 1 5 . 1 1 16 16 LYS C C 16 177.430 177.430 178.988 -1.558 19610 904 1 5 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.062 -0.169 19610 905 1 5 . 1 1 16 16 LYS CB C 16 32.539 32.539 32.073 0.466 19610 906 1 5 . 1 1 16 16 LYS H H 16 8.288 8.288 7.668 0.620 19610 907 1 5 . 1 1 17 17 GLU N N 17 119.492 119.492 120.310 -0.818 19610 908 1 5 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.060 0.052 19610 909 1 5 . 1 1 17 17 GLU C C 17 178.007 178.007 179.121 -1.114 19610 910 1 5 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.488 -1.236 19610 911 1 5 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.726 -0.079 19610 912 1 5 . 1 1 17 17 GLU H H 17 8.221 8.221 7.686 0.535 19610 913 1 5 . 1 1 18 18 LEU N N 18 119.493 119.493 116.625 2.868 19610 914 1 5 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.091 0.056 19610 915 1 5 . 1 1 18 18 LEU C C 18 178.359 178.359 178.888 -0.529 19610 916 1 5 . 1 1 18 18 LEU CA C 18 56.422 56.422 58.216 -1.794 19610 917 1 5 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.093 0.667 19610 918 1 5 . 1 1 18 18 LEU H H 18 7.998 7.998 8.097 -0.099 19610 919 1 5 . 1 1 19 19 SER N N 19 114.728 114.728 114.899 -0.171 19610 920 1 5 . 1 1 19 19 SER HA H 19 4.113 4.113 4.170 -0.057 19610 921 1 5 . 1 1 19 19 SER C C 19 175.912 175.912 176.576 -0.664 19610 922 1 5 . 1 1 19 19 SER CA C 19 60.881 60.881 61.562 -0.681 19610 923 1 5 . 1 1 19 19 SER CB C 19 63.043 63.043 62.718 0.325 19610 924 1 5 . 1 1 19 19 SER H H 19 8.068 8.068 7.684 0.384 19610 925 1 5 . 1 1 20 20 ASP N N 20 121.206 121.206 121.874 -0.668 19610 926 1 5 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.298 0.150 19610 927 1 5 . 1 1 20 20 ASP C C 20 177.598 177.598 178.476 -0.878 19610 928 1 5 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.167 -1.172 19610 929 1 5 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.865 -0.326 19610 930 1 5 . 1 1 20 20 ASP H H 20 8.301 8.301 7.969 0.332 19610 931 1 5 . 1 1 21 21 LEU N N 21 119.944 119.944 119.546 0.398 19610 932 1 5 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.504 -0.362 19610 933 1 5 . 1 1 21 21 LEU C C 21 177.822 177.822 178.207 -0.385 19610 934 1 5 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.306 1.133 19610 935 1 5 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.335 0.917 19610 936 1 5 . 1 1 21 21 LEU H H 21 7.807 7.807 7.787 0.020 19610 937 1 5 . 1 1 22 22 LEU N N 22 119.558 119.558 122.306 -2.748 19610 938 1 5 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.945 0.131 19610 939 1 5 . 1 1 22 22 LEU C C 22 177.131 177.131 178.081 -0.950 19610 940 1 5 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.388 -2.333 19610 941 1 5 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.757 0.087 19610 942 1 5 . 1 1 22 22 LEU H H 22 7.878 7.878 8.102 -0.225 19610 943 1 5 . 1 1 23 23 ASP N N 23 119.509 119.509 119.406 0.103 19610 944 1 5 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.228 0.236 19610 945 1 5 . 1 1 23 23 ASP C C 23 177.379 177.379 178.374 -0.995 19610 946 1 5 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.478 -2.551 19610 947 1 5 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.551 0.188 19610 948 1 5 . 1 1 23 23 ASP H H 23 7.990 7.990 7.833 0.157 19610 949 1 5 . 1 1 24 24 PHE N N 24 121.219 121.219 116.915 4.304 19610 950 1 5 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.365 0.101 19610 951 1 5 . 1 1 24 24 PHE C C 24 176.875 176.875 177.220 -0.345 19610 952 1 5 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.335 -0.106 19610 953 1 5 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.410 0.597 19610 954 1 5 . 1 1 24 24 PHE H H 24 8.204 8.204 7.295 0.909 19610 955 1 5 . 1 1 25 25 SER N N 25 115.500 115.500 117.094 -1.594 19610 956 1 5 . 1 1 25 25 SER HA H 25 4.108 4.108 4.698 -0.590 19610 957 1 5 . 1 1 25 25 SER C C 25 175.386 175.386 176.147 -0.761 19610 958 1 5 . 1 1 25 25 SER CA C 25 60.758 60.758 61.740 -0.982 19610 959 1 5 . 1 1 25 25 SER CB C 25 62.998 62.998 63.021 -0.023 19610 960 1 5 . 1 1 25 25 SER H H 25 8.326 8.326 7.998 0.328 19610 961 1 5 . 1 1 26 26 MET N N 26 119.723 119.723 117.561 2.162 19610 962 1 5 . 1 1 26 26 MET HA H 26 4.363 4.363 4.473 -0.110 19610 963 1 5 . 1 1 26 26 MET C C 26 176.450 176.450 177.111 -0.661 19610 964 1 5 . 1 1 26 26 MET CA C 26 55.949 55.949 57.002 -1.053 19610 965 1 5 . 1 1 26 26 MET CB C 26 31.868 31.868 32.294 -0.426 19610 966 1 5 . 1 1 26 26 MET H H 26 7.889 7.889 7.835 0.054 19610 967 1 5 . 1 1 27 27 MET N N 27 117.872 117.872 118.604 -0.732 19610 968 1 5 . 1 1 27 27 MET HA H 27 4.186 4.186 4.340 -0.154 19610 969 1 5 . 1 1 27 27 MET C C 27 175.341 175.341 176.734 -1.393 19610 970 1 5 . 1 1 27 27 MET CA C 27 56.102 56.102 57.001 -0.899 19610 971 1 5 . 1 1 27 27 MET CB C 27 33.161 33.161 33.360 -0.199 19610 972 1 5 . 1 1 27 27 MET H H 27 7.656 7.656 7.382 0.274 19610 973 1 5 . 1 1 28 28 PHE N N 28 118.702 118.702 121.576 -2.874 19610 974 1 5 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.450 0.354 19610 975 1 5 . 1 1 28 28 PHE C C 28 173.132 173.132 175.141 -2.009 19610 976 1 5 . 1 1 28 28 PHE CA C 28 54.795 54.795 56.998 -2.203 19610 977 1 5 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.410 0.319 19610 978 1 5 . 1 1 28 28 PHE H H 28 7.682 7.682 7.662 0.020 19610 979 1 5 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.430 0.031 19610 980 1 5 . 1 1 29 29 PRO C C 29 176.360 176.360 176.400 -0.040 19610 981 1 5 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.117 -0.297 19610 982 1 5 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.973 -0.392 19610 983 1 5 . 1 1 30 30 LEU N N 30 123.391 123.391 121.815 1.576 19610 984 1 5 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.499 0.040 19610 985 1 5 . 1 1 30 30 LEU C C 30 175.365 175.365 175.980 -0.615 19610 986 1 5 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.663 -0.752 19610 987 1 5 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.950 -0.277 19610 988 1 5 . 1 1 30 30 LEU H H 30 8.284 8.284 7.707 0.577 19610 989 1 5 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.426 0.012 19610 990 1 5 . 1 1 31 31 PRO C C 31 176.688 176.688 175.977 0.711 19610 991 1 5 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.362 0.518 19610 992 1 5 . 1 1 31 31 PRO CB C 31 32.043 32.043 31.000 1.043 19610 993 1 5 . 1 1 32 32 VAL N N 32 120.844 120.844 126.189 -5.345 19610 994 1 5 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.973 0.167 19610 995 1 5 . 1 1 32 32 VAL C C 32 176.579 176.579 176.321 0.258 19610 996 1 5 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.633 -0.392 19610 997 1 5 . 1 1 32 32 VAL CB C 32 32.809 32.809 31.871 0.938 19610 998 1 5 . 1 1 32 32 VAL H H 32 8.344 8.344 8.092 0.252 19610 999 1 5 . 1 1 33 33 THR N N 33 118.041 118.041 120.610 -2.569 19610 1000 1 5 . 1 1 33 33 THR HA H 33 4.373 4.373 4.408 -0.035 19610 1001 1 5 . 1 1 33 33 THR C C 33 174.172 174.172 175.339 -1.167 19610 1002 1 5 . 1 1 33 33 THR CA C 33 61.407 61.407 62.924 -1.517 19610 1003 1 5 . 1 1 33 33 THR CB C 33 69.891 69.891 68.774 1.117 19610 1004 1 5 . 1 1 33 33 THR H H 33 8.326 8.326 8.253 0.073 19610 1005 1 5 . 1 1 34 34 ASN N N 34 121.367 121.367 119.450 1.917 19610 1006 1 5 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.650 0.059 19610 1007 1 5 . 1 1 34 34 ASN C C 34 175.639 175.639 175.674 -0.035 19610 1008 1 5 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.504 -0.286 19610 1009 1 5 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.516 0.442 19610 1010 1 5 . 1 1 34 34 ASN H H 34 8.526 8.526 8.035 0.491 19610 1011 1 5 . 1 1 35 35 GLY N N 35 109.437 109.437 109.491 -0.054 19610 1012 1 5 . 1 1 35 35 GLY C C 35 174.112 174.112 174.286 -0.174 19610 1013 1 5 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.219 0.150 19610 1014 1 5 . 1 1 35 35 GLY H H 35 8.449 8.449 7.858 0.591 19610 1015 1 5 . 1 1 36 36 LYS N N 36 120.614 120.614 121.615 -1.001 19610 1016 1 5 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.321 -0.018 19610 1017 1 5 . 1 1 36 36 LYS C C 36 177.182 177.182 176.642 0.540 19610 1018 1 5 . 1 1 36 36 LYS CA C 36 56.300 56.300 55.974 0.326 19610 1019 1 5 . 1 1 36 36 LYS CB C 36 32.895 32.895 31.063 1.832 19610 1020 1 5 . 1 1 36 36 LYS H H 36 8.261 8.261 8.323 -0.062 19610 1021 1 5 . 1 1 37 37 GLY N N 37 110.011 110.011 114.239 -4.228 19610 1022 1 5 . 1 1 37 37 GLY C C 37 173.463 173.463 174.165 -0.702 19610 1023 1 5 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.414 -0.292 19610 1024 1 5 . 1 1 37 37 GLY H H 37 8.484 8.484 8.871 -0.387 19610 1025 1 5 . 1 1 38 38 ARG N N 38 121.698 121.698 120.875 0.823 19610 1026 1 5 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.701 -0.082 19610 1027 1 5 . 1 1 38 38 ARG C C 38 173.448 173.448 173.921 -0.473 19610 1028 1 5 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.227 -0.525 19610 1029 1 5 . 1 1 38 38 ARG CB C 38 30.121 30.121 30.524 -0.403 19610 1030 1 5 . 1 1 38 38 ARG H H 38 8.105 8.105 8.153 -0.048 19610 1031 1 6 . 1 1 2 2 SER HA H 2 4.472 4.472 4.579 -0.107 19610 1032 1 6 . 1 1 2 2 SER C C 2 174.628 174.628 174.777 -0.149 19610 1033 1 6 . 1 1 2 2 SER CA C 2 58.397 58.397 57.923 0.474 19610 1034 1 6 . 1 1 2 2 SER CB C 2 63.896 63.896 63.694 0.202 19610 1035 1 6 . 1 1 3 3 MET N N 3 122.147 122.147 124.792 -2.645 19610 1036 1 6 . 1 1 3 3 MET HA H 3 4.490 4.490 4.372 0.118 19610 1037 1 6 . 1 1 3 3 MET C C 3 175.934 175.934 176.399 -0.465 19610 1038 1 6 . 1 1 3 3 MET CA C 3 55.552 55.552 54.619 0.933 19610 1039 1 6 . 1 1 3 3 MET CB C 3 32.645 32.645 32.006 0.639 19610 1040 1 6 . 1 1 3 3 MET H H 3 8.627 8.627 8.640 -0.013 19610 1041 1 6 . 1 1 4 4 ASN N N 4 119.930 119.930 124.439 -4.509 19610 1042 1 6 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.665 -0.011 19610 1043 1 6 . 1 1 4 4 ASN C C 4 174.695 174.695 174.616 0.079 19610 1044 1 6 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.214 0.023 19610 1045 1 6 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.288 0.481 19610 1046 1 6 . 1 1 4 4 ASN H H 4 8.497 8.497 8.731 -0.234 19610 1047 1 6 . 1 1 5 5 GLN N N 5 121.523 121.523 123.610 -2.087 19610 1048 1 6 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.698 -0.105 19610 1049 1 6 . 1 1 5 5 GLN C C 5 173.849 173.849 174.081 -0.232 19610 1050 1 6 . 1 1 5 5 GLN CA C 5 53.724 53.724 53.417 0.307 19610 1051 1 6 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.797 0.117 19610 1052 1 6 . 1 1 5 5 GLN H H 5 8.322 8.322 7.805 0.517 19610 1053 1 6 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.425 -0.047 19610 1054 1 6 . 1 1 6 6 PRO C C 6 176.816 176.816 176.810 0.006 19610 1055 1 6 . 1 1 6 6 PRO CA C 6 63.157 63.157 63.220 -0.063 19610 1056 1 6 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.010 0.076 19610 1057 1 6 . 1 1 7 7 GLN N N 7 121.005 121.005 122.845 -1.840 19610 1058 1 6 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.308 -0.063 19610 1059 1 6 . 1 1 7 7 GLN C C 7 175.941 175.941 175.749 0.192 19610 1060 1 6 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.660 0.125 19610 1061 1 6 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.377 0.118 19610 1062 1 6 . 1 1 7 7 GLN H H 7 8.576 8.576 8.392 0.184 19610 1063 1 6 . 1 1 8 8 ARG N N 8 122.928 122.928 122.444 0.484 19610 1064 1 6 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.405 -0.118 19610 1065 1 6 . 1 1 8 8 ARG C C 8 176.061 176.061 176.718 -0.657 19610 1066 1 6 . 1 1 8 8 ARG CA C 8 55.996 55.996 55.209 0.787 19610 1067 1 6 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.663 0.153 19610 1068 1 6 . 1 1 8 8 ARG H H 8 8.449 8.449 8.602 -0.153 19610 1069 1 6 . 1 1 9 9 MET N N 9 122.430 122.430 118.996 3.434 19610 1070 1 6 . 1 1 9 9 MET HA H 9 4.450 4.450 4.524 -0.074 19610 1071 1 6 . 1 1 9 9 MET C C 9 175.469 175.469 175.505 -0.036 19610 1072 1 6 . 1 1 9 9 MET CA C 9 54.941 54.941 55.893 -0.952 19610 1073 1 6 . 1 1 9 9 MET CB C 9 33.058 33.058 32.950 0.108 19610 1074 1 6 . 1 1 9 9 MET H H 9 8.471 8.471 8.286 0.185 19610 1075 1 6 . 1 1 10 10 ALA N N 10 127.153 127.153 125.776 1.377 19610 1076 1 6 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.686 -0.145 19610 1077 1 6 . 1 1 10 10 ALA C C 10 175.353 175.353 176.162 -0.809 19610 1078 1 6 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.424 0.063 19610 1079 1 6 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.982 -0.951 19610 1080 1 6 . 1 1 10 10 ALA H H 10 8.398 8.398 8.324 0.074 19610 1081 1 6 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.306 0.132 19610 1082 1 6 . 1 1 11 11 PRO C C 11 176.896 176.896 176.473 0.423 19610 1083 1 6 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.675 -1.820 19610 1084 1 6 . 1 1 11 11 PRO CB C 11 32.021 32.021 31.888 0.133 19610 1085 1 6 . 1 1 12 12 VAL N N 12 120.652 120.652 112.934 7.718 19610 1086 1 6 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.409 -0.319 19610 1087 1 6 . 1 1 12 12 VAL C C 12 176.825 176.825 174.828 1.997 19610 1088 1 6 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.066 1.337 19610 1089 1 6 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.696 -1.795 19610 1090 1 6 . 1 1 12 12 VAL H H 12 8.373 8.373 7.466 0.907 19610 1091 1 6 . 1 1 13 13 GLY N N 13 112.483 112.483 108.917 3.566 19610 1092 1 6 . 1 1 13 13 GLY C C 13 174.515 174.515 175.516 -1.001 19610 1093 1 6 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.828 -0.500 19610 1094 1 6 . 1 1 13 13 GLY H H 13 8.605 8.605 8.575 0.030 19610 1095 1 6 . 1 1 14 14 THR N N 14 113.531 113.531 115.587 -2.056 19610 1096 1 6 . 1 1 14 14 THR HA H 14 4.309 4.309 4.076 0.233 19610 1097 1 6 . 1 1 14 14 THR C C 14 174.742 174.742 175.719 -0.977 19610 1098 1 6 . 1 1 14 14 THR CA C 14 62.130 62.130 64.933 -2.803 19610 1099 1 6 . 1 1 14 14 THR CB C 14 69.981 69.981 69.031 0.950 19610 1100 1 6 . 1 1 14 14 THR H H 14 8.164 8.164 8.035 0.129 19610 1101 1 6 . 1 1 15 15 ASP N N 15 122.439 122.439 119.862 2.577 19610 1102 1 6 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.450 0.060 19610 1103 1 6 . 1 1 15 15 ASP C C 15 177.216 177.216 178.366 -1.150 19610 1104 1 6 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.282 -2.020 19610 1105 1 6 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.700 -0.007 19610 1106 1 6 . 1 1 15 15 ASP H H 15 8.537 8.537 8.671 -0.134 19610 1107 1 6 . 1 1 16 16 LYS N N 16 122.807 122.807 118.917 3.890 19610 1108 1 6 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.129 -0.011 19610 1109 1 6 . 1 1 16 16 LYS C C 16 177.430 177.430 179.127 -1.697 19610 1110 1 6 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.443 -0.549 19610 1111 1 6 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.958 0.581 19610 1112 1 6 . 1 1 16 16 LYS H H 16 8.288 8.288 7.563 0.725 19610 1113 1 6 . 1 1 17 17 GLU N N 17 119.492 119.492 119.461 0.031 19610 1114 1 6 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.122 -0.010 19610 1115 1 6 . 1 1 17 17 GLU C C 17 178.007 178.007 179.268 -1.261 19610 1116 1 6 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.083 -0.831 19610 1117 1 6 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.451 0.196 19610 1118 1 6 . 1 1 17 17 GLU H H 17 8.221 8.221 7.788 0.433 19610 1119 1 6 . 1 1 18 18 LEU N N 18 119.493 119.493 116.171 3.322 19610 1120 1 6 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.187 -0.040 19610 1121 1 6 . 1 1 18 18 LEU C C 18 178.359 178.359 178.887 -0.528 19610 1122 1 6 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.723 -1.301 19610 1123 1 6 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.014 0.746 19610 1124 1 6 . 1 1 18 18 LEU H H 18 7.998 7.998 8.145 -0.147 19610 1125 1 6 . 1 1 19 19 SER N N 19 114.728 114.728 115.716 -0.988 19610 1126 1 6 . 1 1 19 19 SER HA H 19 4.113 4.113 4.101 0.012 19610 1127 1 6 . 1 1 19 19 SER C C 19 175.912 175.912 176.189 -0.277 19610 1128 1 6 . 1 1 19 19 SER CA C 19 60.881 60.881 61.878 -0.997 19610 1129 1 6 . 1 1 19 19 SER CB C 19 63.043 63.043 62.636 0.406 19610 1130 1 6 . 1 1 19 19 SER H H 19 8.068 8.068 7.732 0.336 19610 1131 1 6 . 1 1 20 20 ASP N N 20 121.206 121.206 122.003 -0.797 19610 1132 1 6 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.289 0.159 19610 1133 1 6 . 1 1 20 20 ASP C C 20 177.598 177.598 178.581 -0.983 19610 1134 1 6 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.205 -1.210 19610 1135 1 6 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.739 -0.200 19610 1136 1 6 . 1 1 20 20 ASP H H 20 8.301 8.301 7.861 0.440 19610 1137 1 6 . 1 1 21 21 LEU N N 21 119.944 119.944 119.289 0.655 19610 1138 1 6 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.602 -0.460 19610 1139 1 6 . 1 1 21 21 LEU C C 21 177.822 177.822 178.621 -0.799 19610 1140 1 6 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.498 0.941 19610 1141 1 6 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.216 1.036 19610 1142 1 6 . 1 1 21 21 LEU H H 21 7.807 7.807 7.784 0.023 19610 1143 1 6 . 1 1 22 22 LEU N N 22 119.558 119.558 122.282 -2.724 19610 1144 1 6 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.996 0.080 19610 1145 1 6 . 1 1 22 22 LEU C C 22 177.131 177.131 177.975 -0.844 19610 1146 1 6 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.182 -2.127 19610 1147 1 6 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.772 0.072 19610 1148 1 6 . 1 1 22 22 LEU H H 22 7.878 7.878 7.892 -0.014 19610 1149 1 6 . 1 1 23 23 ASP N N 23 119.509 119.509 119.764 -0.255 19610 1150 1 6 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.192 0.272 19610 1151 1 6 . 1 1 23 23 ASP C C 23 177.379 177.379 178.318 -0.939 19610 1152 1 6 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.396 -2.469 19610 1153 1 6 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.480 0.259 19610 1154 1 6 . 1 1 23 23 ASP H H 23 7.990 7.990 7.696 0.294 19610 1155 1 6 . 1 1 24 24 PHE N N 24 121.219 121.219 117.167 4.052 19610 1156 1 6 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.282 0.184 19610 1157 1 6 . 1 1 24 24 PHE C C 24 176.875 176.875 177.391 -0.516 19610 1158 1 6 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.960 -0.731 19610 1159 1 6 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.382 0.625 19610 1160 1 6 . 1 1 24 24 PHE H H 24 8.204 8.204 7.272 0.932 19610 1161 1 6 . 1 1 25 25 SER N N 25 115.500 115.500 116.461 -0.961 19610 1162 1 6 . 1 1 25 25 SER HA H 25 4.108 4.108 4.631 -0.523 19610 1163 1 6 . 1 1 25 25 SER C C 25 175.386 175.386 176.048 -0.662 19610 1164 1 6 . 1 1 25 25 SER CA C 25 60.758 60.758 61.134 -0.376 19610 1165 1 6 . 1 1 25 25 SER CB C 25 62.998 62.998 63.156 -0.158 19610 1166 1 6 . 1 1 25 25 SER H H 25 8.326 8.326 8.035 0.291 19610 1167 1 6 . 1 1 26 26 MET N N 26 119.723 119.723 117.304 2.419 19610 1168 1 6 . 1 1 26 26 MET HA H 26 4.363 4.363 4.476 -0.113 19610 1169 1 6 . 1 1 26 26 MET C C 26 176.450 176.450 177.430 -0.980 19610 1170 1 6 . 1 1 26 26 MET CA C 26 55.949 55.949 56.736 -0.787 19610 1171 1 6 . 1 1 26 26 MET CB C 26 31.868 31.868 32.539 -0.672 19610 1172 1 6 . 1 1 26 26 MET H H 26 7.889 7.889 7.893 -0.004 19610 1173 1 6 . 1 1 27 27 MET N N 27 117.872 117.872 119.125 -1.253 19610 1174 1 6 . 1 1 27 27 MET HA H 27 4.186 4.186 4.237 -0.051 19610 1175 1 6 . 1 1 27 27 MET C C 27 175.341 175.341 176.680 -1.339 19610 1176 1 6 . 1 1 27 27 MET CA C 27 56.102 56.102 57.208 -1.105 19610 1177 1 6 . 1 1 27 27 MET CB C 27 33.161 33.161 33.460 -0.299 19610 1178 1 6 . 1 1 27 27 MET H H 27 7.656 7.656 7.292 0.364 19610 1179 1 6 . 1 1 28 28 PHE N N 28 118.702 118.702 119.673 -0.971 19610 1180 1 6 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.408 0.396 19610 1181 1 6 . 1 1 28 28 PHE C C 28 173.132 173.132 175.065 -1.933 19610 1182 1 6 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.198 -2.403 19610 1183 1 6 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.459 0.270 19610 1184 1 6 . 1 1 28 28 PHE H H 28 7.682 7.682 7.646 0.036 19610 1185 1 6 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.434 0.027 19610 1186 1 6 . 1 1 29 29 PRO C C 29 176.360 176.360 176.334 0.026 19610 1187 1 6 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.252 -0.432 19610 1188 1 6 . 1 1 29 29 PRO CB C 29 31.581 31.581 32.070 -0.489 19610 1189 1 6 . 1 1 30 30 LEU N N 30 123.391 123.391 121.640 1.751 19610 1190 1 6 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.505 0.034 19610 1191 1 6 . 1 1 30 30 LEU C C 30 175.365 175.365 175.901 -0.536 19610 1192 1 6 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.575 -0.664 19610 1193 1 6 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.931 -0.258 19610 1194 1 6 . 1 1 30 30 LEU H H 30 8.284 8.284 7.732 0.552 19610 1195 1 6 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.376 0.062 19610 1196 1 6 . 1 1 31 31 PRO C C 31 176.688 176.688 175.905 0.783 19610 1197 1 6 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.556 0.324 19610 1198 1 6 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.929 1.114 19610 1199 1 6 . 1 1 32 32 VAL N N 32 120.844 120.844 125.334 -4.490 19610 1200 1 6 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.082 0.058 19610 1201 1 6 . 1 1 32 32 VAL C C 32 176.579 176.579 175.972 0.607 19610 1202 1 6 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.090 0.151 19610 1203 1 6 . 1 1 32 32 VAL CB C 32 32.809 32.809 32.561 0.248 19610 1204 1 6 . 1 1 32 32 VAL H H 32 8.344 8.344 8.041 0.303 19610 1205 1 6 . 1 1 33 33 THR N N 33 118.041 118.041 122.114 -4.073 19610 1206 1 6 . 1 1 33 33 THR HA H 33 4.373 4.373 4.439 -0.066 19610 1207 1 6 . 1 1 33 33 THR C C 33 174.172 174.172 174.658 -0.486 19610 1208 1 6 . 1 1 33 33 THR CA C 33 61.407 61.407 61.596 -0.189 19610 1209 1 6 . 1 1 33 33 THR CB C 33 69.891 69.891 67.931 1.960 19610 1210 1 6 . 1 1 33 33 THR H H 33 8.326 8.326 8.517 -0.191 19610 1211 1 6 . 1 1 34 34 ASN N N 34 121.367 121.367 117.457 3.910 19610 1212 1 6 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.412 0.297 19610 1213 1 6 . 1 1 34 34 ASN C C 34 175.639 175.639 174.642 0.997 19610 1214 1 6 . 1 1 34 34 ASN CA C 34 53.218 53.218 54.166 -0.948 19610 1215 1 6 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.745 1.212 19610 1216 1 6 . 1 1 34 34 ASN H H 34 8.526 8.526 8.273 0.253 19610 1217 1 6 . 1 1 35 35 GLY N N 35 109.437 109.437 107.977 1.460 19610 1218 1 6 . 1 1 35 35 GLY C C 35 174.112 174.112 174.039 0.073 19610 1219 1 6 . 1 1 35 35 GLY CA C 35 45.370 45.370 44.928 0.442 19610 1220 1 6 . 1 1 35 35 GLY H H 35 8.449 8.449 8.000 0.449 19610 1221 1 6 . 1 1 36 36 LYS N N 36 120.614 120.614 122.954 -2.340 19610 1222 1 6 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.247 0.057 19610 1223 1 6 . 1 1 36 36 LYS C C 36 177.182 177.182 176.084 1.098 19610 1224 1 6 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.729 -0.429 19610 1225 1 6 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.819 0.076 19610 1226 1 6 . 1 1 36 36 LYS H H 36 8.261 8.261 8.075 0.186 19610 1227 1 6 . 1 1 37 37 GLY N N 37 110.011 110.011 112.652 -2.641 19610 1228 1 6 . 1 1 37 37 GLY C C 37 173.463 173.463 173.899 -0.436 19610 1229 1 6 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.343 -0.220 19610 1230 1 6 . 1 1 37 37 GLY H H 37 8.484 8.484 8.446 0.038 19610 1231 1 6 . 1 1 38 38 ARG N N 38 121.698 121.698 120.596 1.102 19610 1232 1 6 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.247 0.372 19610 1233 1 6 . 1 1 38 38 ARG C C 38 173.448 173.448 174.383 -0.935 19610 1234 1 6 . 1 1 38 38 ARG CA C 38 53.702 53.702 55.693 -1.991 19610 1235 1 6 . 1 1 38 38 ARG CB C 38 30.121 30.121 27.961 2.160 19610 1236 1 6 . 1 1 38 38 ARG H H 38 8.105 8.105 8.677 -0.572 19610 1237 1 7 . 1 1 2 2 SER HA H 2 4.472 4.472 4.469 0.003 19610 1238 1 7 . 1 1 2 2 SER C C 2 174.628 174.628 174.625 0.003 19610 1239 1 7 . 1 1 2 2 SER CA C 2 58.397 58.397 58.315 0.082 19610 1240 1 7 . 1 1 2 2 SER CB C 2 63.896 63.896 63.958 -0.062 19610 1241 1 7 . 1 1 3 3 MET N N 3 122.147 122.147 122.358 -0.211 19610 1242 1 7 . 1 1 3 3 MET HA H 3 4.490 4.490 4.476 0.014 19610 1243 1 7 . 1 1 3 3 MET C C 3 175.934 175.934 175.653 0.281 19610 1244 1 7 . 1 1 3 3 MET CA C 3 55.552 55.552 53.924 1.628 19610 1245 1 7 . 1 1 3 3 MET CB C 3 32.645 32.645 32.058 0.587 19610 1246 1 7 . 1 1 3 3 MET H H 3 8.627 8.627 8.562 0.065 19610 1247 1 7 . 1 1 4 4 ASN N N 4 119.930 119.930 120.947 -1.017 19610 1248 1 7 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.696 -0.042 19610 1249 1 7 . 1 1 4 4 ASN C C 4 174.695 174.695 174.550 0.145 19610 1250 1 7 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.246 -0.009 19610 1251 1 7 . 1 1 4 4 ASN CB C 4 38.768 38.768 37.125 1.643 19610 1252 1 7 . 1 1 4 4 ASN H H 4 8.497 8.497 8.175 0.322 19610 1253 1 7 . 1 1 5 5 GLN N N 5 121.523 121.523 123.779 -2.256 19610 1254 1 7 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.611 -0.018 19610 1255 1 7 . 1 1 5 5 GLN C C 5 173.849 173.849 174.631 -0.782 19610 1256 1 7 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.199 -0.475 19610 1257 1 7 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.502 0.412 19610 1258 1 7 . 1 1 5 5 GLN H H 5 8.322 8.322 8.125 0.197 19610 1259 1 7 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.436 -0.058 19610 1260 1 7 . 1 1 6 6 PRO C C 6 176.816 176.816 176.472 0.344 19610 1261 1 7 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.545 0.612 19610 1262 1 7 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.263 -0.177 19610 1263 1 7 . 1 1 7 7 GLN N N 7 121.005 121.005 118.803 2.202 19610 1264 1 7 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.308 -0.063 19610 1265 1 7 . 1 1 7 7 GLN C C 7 175.941 175.941 176.102 -0.161 19610 1266 1 7 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.350 0.435 19610 1267 1 7 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.340 0.155 19610 1268 1 7 . 1 1 7 7 GLN H H 7 8.576 8.576 8.344 0.232 19610 1269 1 7 . 1 1 8 8 ARG N N 8 122.928 122.928 121.079 1.849 19610 1270 1 7 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.173 0.114 19610 1271 1 7 . 1 1 8 8 ARG C C 8 176.061 176.061 176.159 -0.098 19610 1272 1 7 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.829 -0.833 19610 1273 1 7 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.316 1.500 19610 1274 1 7 . 1 1 8 8 ARG H H 8 8.449 8.449 8.520 -0.071 19610 1275 1 7 . 1 1 9 9 MET N N 9 122.430 122.430 123.049 -0.619 19610 1276 1 7 . 1 1 9 9 MET HA H 9 4.450 4.450 4.767 -0.317 19610 1277 1 7 . 1 1 9 9 MET C C 9 175.469 175.469 176.131 -0.662 19610 1278 1 7 . 1 1 9 9 MET CA C 9 54.941 54.941 54.645 0.296 19610 1279 1 7 . 1 1 9 9 MET CB C 9 33.058 33.058 34.253 -1.195 19610 1280 1 7 . 1 1 9 9 MET H H 9 8.471 8.471 8.335 0.136 19610 1281 1 7 . 1 1 10 10 ALA N N 10 127.153 127.153 124.688 2.465 19610 1282 1 7 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.731 -0.190 19610 1283 1 7 . 1 1 10 10 ALA C C 10 175.353 175.353 176.888 -1.535 19610 1284 1 7 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.517 -0.030 19610 1285 1 7 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.413 -0.382 19610 1286 1 7 . 1 1 10 10 ALA H H 10 8.398 8.398 8.337 0.061 19610 1287 1 7 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.436 0.002 19610 1288 1 7 . 1 1 11 11 PRO C C 11 176.896 176.896 176.668 0.228 19610 1289 1 7 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.796 -0.941 19610 1290 1 7 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.222 -0.202 19610 1291 1 7 . 1 1 12 12 VAL N N 12 120.652 120.652 118.679 1.973 19610 1292 1 7 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.244 -0.154 19610 1293 1 7 . 1 1 12 12 VAL C C 12 176.825 176.825 175.782 1.043 19610 1294 1 7 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.065 1.338 19610 1295 1 7 . 1 1 12 12 VAL CB C 12 32.901 32.901 32.993 -0.092 19610 1296 1 7 . 1 1 12 12 VAL H H 12 8.373 8.373 7.417 0.956 19610 1297 1 7 . 1 1 13 13 GLY N N 13 112.483 112.483 114.514 -2.031 19610 1298 1 7 . 1 1 13 13 GLY C C 13 174.515 174.515 175.284 -0.769 19610 1299 1 7 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.574 -0.246 19610 1300 1 7 . 1 1 13 13 GLY H H 13 8.605 8.605 8.402 0.203 19610 1301 1 7 . 1 1 14 14 THR N N 14 113.531 113.531 118.031 -4.500 19610 1302 1 7 . 1 1 14 14 THR HA H 14 4.309 4.309 4.326 -0.017 19610 1303 1 7 . 1 1 14 14 THR C C 14 174.742 174.742 175.324 -0.582 19610 1304 1 7 . 1 1 14 14 THR CA C 14 62.130 62.130 64.686 -2.556 19610 1305 1 7 . 1 1 14 14 THR CB C 14 69.981 69.981 68.424 1.557 19610 1306 1 7 . 1 1 14 14 THR H H 14 8.164 8.164 8.301 -0.137 19610 1307 1 7 . 1 1 15 15 ASP N N 15 122.439 122.439 120.534 1.905 19610 1308 1 7 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.367 0.143 19610 1309 1 7 . 1 1 15 15 ASP C C 15 177.216 177.216 178.083 -0.867 19610 1310 1 7 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.683 -2.421 19610 1311 1 7 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.735 -0.042 19610 1312 1 7 . 1 1 15 15 ASP H H 15 8.537 8.537 8.716 -0.179 19610 1313 1 7 . 1 1 16 16 LYS N N 16 122.807 122.807 118.069 4.738 19610 1314 1 7 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.157 -0.039 19610 1315 1 7 . 1 1 16 16 LYS C C 16 177.430 177.430 179.314 -1.884 19610 1316 1 7 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.193 -0.300 19610 1317 1 7 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.993 0.546 19610 1318 1 7 . 1 1 16 16 LYS H H 16 8.288 8.288 7.560 0.728 19610 1319 1 7 . 1 1 17 17 GLU N N 17 119.492 119.492 120.280 -0.788 19610 1320 1 7 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.101 0.011 19610 1321 1 7 . 1 1 17 17 GLU C C 17 178.007 178.007 178.943 -0.936 19610 1322 1 7 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.407 -1.155 19610 1323 1 7 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.719 -0.072 19610 1324 1 7 . 1 1 17 17 GLU H H 17 8.221 8.221 7.542 0.679 19610 1325 1 7 . 1 1 18 18 LEU N N 18 119.493 119.493 117.894 1.599 19610 1326 1 7 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.128 0.019 19610 1327 1 7 . 1 1 18 18 LEU C C 18 178.359 178.359 179.188 -0.829 19610 1328 1 7 . 1 1 18 18 LEU CA C 18 56.422 56.422 58.101 -1.679 19610 1329 1 7 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.273 0.487 19610 1330 1 7 . 1 1 18 18 LEU H H 18 7.998 7.998 7.879 0.119 19610 1331 1 7 . 1 1 19 19 SER N N 19 114.728 114.728 114.280 0.448 19610 1332 1 7 . 1 1 19 19 SER HA H 19 4.113 4.113 4.121 -0.008 19610 1333 1 7 . 1 1 19 19 SER C C 19 175.912 175.912 176.329 -0.417 19610 1334 1 7 . 1 1 19 19 SER CA C 19 60.881 60.881 61.542 -0.661 19610 1335 1 7 . 1 1 19 19 SER CB C 19 63.043 63.043 62.786 0.257 19610 1336 1 7 . 1 1 19 19 SER H H 19 8.068 8.068 8.009 0.059 19610 1337 1 7 . 1 1 20 20 ASP N N 20 121.206 121.206 121.753 -0.547 19610 1338 1 7 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.437 0.011 19610 1339 1 7 . 1 1 20 20 ASP C C 20 177.598 177.598 178.351 -0.753 19610 1340 1 7 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.759 -0.764 19610 1341 1 7 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.097 -0.558 19610 1342 1 7 . 1 1 20 20 ASP H H 20 8.301 8.301 7.581 0.720 19610 1343 1 7 . 1 1 21 21 LEU N N 21 119.944 119.944 119.325 0.619 19610 1344 1 7 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.541 -0.399 19610 1345 1 7 . 1 1 21 21 LEU C C 21 177.822 177.822 178.239 -0.417 19610 1346 1 7 . 1 1 21 21 LEU CA C 21 56.439 56.439 56.059 0.380 19610 1347 1 7 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.469 0.783 19610 1348 1 7 . 1 1 21 21 LEU H H 21 7.807 7.807 8.080 -0.273 19610 1349 1 7 . 1 1 22 22 LEU N N 22 119.558 119.558 121.730 -2.172 19610 1350 1 7 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.976 0.100 19610 1351 1 7 . 1 1 22 22 LEU C C 22 177.131 177.131 178.145 -1.014 19610 1352 1 7 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.062 -2.007 19610 1353 1 7 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.519 0.325 19610 1354 1 7 . 1 1 22 22 LEU H H 22 7.878 7.878 7.837 0.041 19610 1355 1 7 . 1 1 23 23 ASP N N 23 119.509 119.509 119.498 0.011 19610 1356 1 7 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.211 0.253 19610 1357 1 7 . 1 1 23 23 ASP C C 23 177.379 177.379 178.371 -0.992 19610 1358 1 7 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.438 -2.511 19610 1359 1 7 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.472 0.267 19610 1360 1 7 . 1 1 23 23 ASP H H 23 7.990 7.990 7.648 0.342 19610 1361 1 7 . 1 1 24 24 PHE N N 24 121.219 121.219 116.761 4.458 19610 1362 1 7 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.218 0.248 19610 1363 1 7 . 1 1 24 24 PHE C C 24 176.875 176.875 177.831 -0.956 19610 1364 1 7 . 1 1 24 24 PHE CA C 24 59.229 59.229 60.114 -0.885 19610 1365 1 7 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.214 0.793 19610 1366 1 7 . 1 1 24 24 PHE H H 24 8.204 8.204 7.244 0.960 19610 1367 1 7 . 1 1 25 25 SER N N 25 115.500 115.500 116.130 -0.630 19610 1368 1 7 . 1 1 25 25 SER HA H 25 4.108 4.108 4.669 -0.561 19610 1369 1 7 . 1 1 25 25 SER C C 25 175.386 175.386 176.676 -1.290 19610 1370 1 7 . 1 1 25 25 SER CA C 25 60.758 60.758 61.849 -1.091 19610 1371 1 7 . 1 1 25 25 SER CB C 25 62.998 62.998 63.237 -0.239 19610 1372 1 7 . 1 1 25 25 SER H H 25 8.326 8.326 8.036 0.290 19610 1373 1 7 . 1 1 26 26 MET N N 26 119.723 119.723 119.102 0.621 19610 1374 1 7 . 1 1 26 26 MET HA H 26 4.363 4.363 4.509 -0.146 19610 1375 1 7 . 1 1 26 26 MET C C 26 176.450 176.450 177.557 -1.107 19610 1376 1 7 . 1 1 26 26 MET CA C 26 55.949 55.949 57.210 -1.261 19610 1377 1 7 . 1 1 26 26 MET CB C 26 31.868 31.868 32.291 -0.423 19610 1378 1 7 . 1 1 26 26 MET H H 26 7.889 7.889 8.036 -0.147 19610 1379 1 7 . 1 1 27 27 MET N N 27 117.872 117.872 119.679 -1.807 19610 1380 1 7 . 1 1 27 27 MET HA H 27 4.186 4.186 4.237 -0.051 19610 1381 1 7 . 1 1 27 27 MET C C 27 175.341 175.341 176.645 -1.304 19610 1382 1 7 . 1 1 27 27 MET CA C 27 56.102 56.102 57.266 -1.164 19610 1383 1 7 . 1 1 27 27 MET CB C 27 33.161 33.161 33.340 -0.179 19610 1384 1 7 . 1 1 27 27 MET H H 27 7.656 7.656 7.414 0.242 19610 1385 1 7 . 1 1 28 28 PHE N N 28 118.702 118.702 119.284 -0.582 19610 1386 1 7 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.450 0.354 19610 1387 1 7 . 1 1 28 28 PHE C C 28 173.132 173.132 175.136 -2.004 19610 1388 1 7 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.000 -2.205 19610 1389 1 7 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.247 0.482 19610 1390 1 7 . 1 1 28 28 PHE H H 28 7.682 7.682 7.684 -0.002 19610 1391 1 7 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.411 0.050 19610 1392 1 7 . 1 1 29 29 PRO C C 29 176.360 176.360 176.218 0.142 19610 1393 1 7 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.311 -0.491 19610 1394 1 7 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.813 -0.232 19610 1395 1 7 . 1 1 30 30 LEU N N 30 123.391 123.391 121.321 2.070 19610 1396 1 7 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.514 0.025 19610 1397 1 7 . 1 1 30 30 LEU C C 30 175.365 175.365 176.257 -0.892 19610 1398 1 7 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.716 -0.805 19610 1399 1 7 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.904 -0.231 19610 1400 1 7 . 1 1 30 30 LEU H H 30 8.284 8.284 7.742 0.542 19610 1401 1 7 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.421 0.017 19610 1402 1 7 . 1 1 31 31 PRO C C 31 176.688 176.688 175.795 0.893 19610 1403 1 7 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.472 0.408 19610 1404 1 7 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.250 1.793 19610 1405 1 7 . 1 1 32 32 VAL N N 32 120.844 120.844 124.667 -3.823 19610 1406 1 7 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.960 0.180 19610 1407 1 7 . 1 1 32 32 VAL C C 32 176.579 176.579 176.645 -0.066 19610 1408 1 7 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.576 -0.335 19610 1409 1 7 . 1 1 32 32 VAL CB C 32 32.809 32.809 32.798 0.011 19610 1410 1 7 . 1 1 32 32 VAL H H 32 8.344 8.344 7.950 0.394 19610 1411 1 7 . 1 1 33 33 THR N N 33 118.041 118.041 122.554 -4.513 19610 1412 1 7 . 1 1 33 33 THR HA H 33 4.373 4.373 4.180 0.193 19610 1413 1 7 . 1 1 33 33 THR C C 33 174.172 174.172 175.097 -0.925 19610 1414 1 7 . 1 1 33 33 THR CA C 33 61.407 61.407 64.113 -2.706 19610 1415 1 7 . 1 1 33 33 THR CB C 33 69.891 69.891 69.273 0.618 19610 1416 1 7 . 1 1 33 33 THR H H 33 8.326 8.326 8.566 -0.240 19610 1417 1 7 . 1 1 34 34 ASN N N 34 121.367 121.367 116.167 5.200 19610 1418 1 7 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.675 0.034 19610 1419 1 7 . 1 1 34 34 ASN C C 34 175.639 175.639 174.741 0.898 19610 1420 1 7 . 1 1 34 34 ASN CA C 34 53.218 53.218 52.833 0.385 19610 1421 1 7 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.792 0.165 19610 1422 1 7 . 1 1 34 34 ASN H H 34 8.526 8.526 7.915 0.611 19610 1423 1 7 . 1 1 35 35 GLY N N 35 109.437 109.437 110.072 -0.635 19610 1424 1 7 . 1 1 35 35 GLY C C 35 174.112 174.112 174.679 -0.567 19610 1425 1 7 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.558 -0.188 19610 1426 1 7 . 1 1 35 35 GLY H H 35 8.449 8.449 8.298 0.151 19610 1427 1 7 . 1 1 36 36 LYS N N 36 120.614 120.614 124.033 -3.419 19610 1428 1 7 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.267 0.036 19610 1429 1 7 . 1 1 36 36 LYS C C 36 177.182 177.182 176.562 0.620 19610 1430 1 7 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.284 0.016 19610 1431 1 7 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.082 0.813 19610 1432 1 7 . 1 1 36 36 LYS H H 36 8.261 8.261 7.983 0.278 19610 1433 1 7 . 1 1 37 37 GLY N N 37 110.011 110.011 112.598 -2.587 19610 1434 1 7 . 1 1 37 37 GLY C C 37 173.463 173.463 174.282 -0.819 19610 1435 1 7 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.413 -0.291 19610 1436 1 7 . 1 1 37 37 GLY H H 37 8.484 8.484 8.681 -0.197 19610 1437 1 7 . 1 1 38 38 ARG N N 38 121.698 121.698 123.319 -1.621 19610 1438 1 7 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.841 -0.222 19610 1439 1 7 . 1 1 38 38 ARG C C 38 173.448 173.448 174.243 -0.795 19610 1440 1 7 . 1 1 38 38 ARG CA C 38 53.702 53.702 53.639 0.063 19610 1441 1 7 . 1 1 38 38 ARG CB C 38 30.121 30.121 30.077 0.044 19610 1442 1 7 . 1 1 38 38 ARG H H 38 8.105 8.105 7.957 0.148 19610 1443 1 8 . 1 1 2 2 SER HA H 2 4.472 4.472 4.772 -0.300 19610 1444 1 8 . 1 1 2 2 SER C C 2 174.628 174.628 174.035 0.593 19610 1445 1 8 . 1 1 2 2 SER CA C 2 58.397 58.397 58.912 -0.515 19610 1446 1 8 . 1 1 2 2 SER CB C 2 63.896 63.896 62.546 1.350 19610 1447 1 8 . 1 1 3 3 MET N N 3 122.147 122.147 120.403 1.744 19610 1448 1 8 . 1 1 3 3 MET HA H 3 4.490 4.490 4.457 0.033 19610 1449 1 8 . 1 1 3 3 MET C C 3 175.934 175.934 175.697 0.237 19610 1450 1 8 . 1 1 3 3 MET CA C 3 55.552 55.552 55.782 -0.230 19610 1451 1 8 . 1 1 3 3 MET CB C 3 32.645 32.645 34.223 -1.578 19610 1452 1 8 . 1 1 3 3 MET H H 3 8.627 8.627 8.077 0.550 19610 1453 1 8 . 1 1 4 4 ASN N N 4 119.930 119.930 119.032 0.898 19610 1454 1 8 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.406 0.248 19610 1455 1 8 . 1 1 4 4 ASN C C 4 174.695 174.695 174.336 0.359 19610 1456 1 8 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.871 -0.634 19610 1457 1 8 . 1 1 4 4 ASN CB C 4 38.768 38.768 37.434 1.334 19610 1458 1 8 . 1 1 4 4 ASN H H 4 8.497 8.497 8.402 0.095 19610 1459 1 8 . 1 1 5 5 GLN N N 5 121.523 121.523 121.842 -0.319 19610 1460 1 8 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.499 0.094 19610 1461 1 8 . 1 1 5 5 GLN C C 5 173.849 173.849 174.592 -0.743 19610 1462 1 8 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.830 -1.106 19610 1463 1 8 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.725 0.189 19610 1464 1 8 . 1 1 5 5 GLN H H 5 8.322 8.322 8.228 0.094 19610 1465 1 8 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.455 -0.078 19610 1466 1 8 . 1 1 6 6 PRO C C 6 176.816 176.816 176.567 0.249 19610 1467 1 8 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.633 0.524 19610 1468 1 8 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.356 -0.270 19610 1469 1 8 . 1 1 7 7 GLN N N 7 121.005 121.005 118.629 2.376 19610 1470 1 8 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.228 0.017 19610 1471 1 8 . 1 1 7 7 GLN C C 7 175.941 175.941 175.767 0.174 19610 1472 1 8 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.455 0.330 19610 1473 1 8 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.321 0.174 19610 1474 1 8 . 1 1 7 7 GLN H H 7 8.576 8.576 8.235 0.341 19610 1475 1 8 . 1 1 8 8 ARG N N 8 122.928 122.928 120.265 2.663 19610 1476 1 8 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.225 0.062 19610 1477 1 8 . 1 1 8 8 ARG C C 8 176.061 176.061 175.959 0.102 19610 1478 1 8 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.008 -0.012 19610 1479 1 8 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.734 1.082 19610 1480 1 8 . 1 1 8 8 ARG H H 8 8.449 8.449 8.575 -0.126 19610 1481 1 8 . 1 1 9 9 MET N N 9 122.430 122.430 122.745 -0.315 19610 1482 1 8 . 1 1 9 9 MET HA H 9 4.450 4.450 4.404 0.046 19610 1483 1 8 . 1 1 9 9 MET C C 9 175.469 175.469 176.580 -1.111 19610 1484 1 8 . 1 1 9 9 MET CA C 9 54.941 54.941 54.972 -0.031 19610 1485 1 8 . 1 1 9 9 MET CB C 9 33.058 33.058 32.127 0.931 19610 1486 1 8 . 1 1 9 9 MET H H 9 8.471 8.471 8.302 0.169 19610 1487 1 8 . 1 1 10 10 ALA N N 10 127.153 127.153 129.160 -2.007 19610 1488 1 8 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.452 0.089 19610 1489 1 8 . 1 1 10 10 ALA C C 10 175.353 175.353 176.648 -1.295 19610 1490 1 8 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.565 -0.078 19610 1491 1 8 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.785 -0.754 19610 1492 1 8 . 1 1 10 10 ALA H H 10 8.398 8.398 8.285 0.113 19610 1493 1 8 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.308 0.130 19610 1494 1 8 . 1 1 11 11 PRO C C 11 176.896 176.896 176.801 0.095 19610 1495 1 8 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.879 -1.024 19610 1496 1 8 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.139 -0.118 19610 1497 1 8 . 1 1 12 12 VAL N N 12 120.652 120.652 115.776 4.876 19610 1498 1 8 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.239 -0.149 19610 1499 1 8 . 1 1 12 12 VAL C C 12 176.825 176.825 174.606 2.219 19610 1500 1 8 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.428 0.975 19610 1501 1 8 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.296 -1.395 19610 1502 1 8 . 1 1 12 12 VAL H H 12 8.373 8.373 7.498 0.875 19610 1503 1 8 . 1 1 13 13 GLY N N 13 112.483 112.483 114.593 -2.110 19610 1504 1 8 . 1 1 13 13 GLY C C 13 174.515 174.515 174.676 -0.161 19610 1505 1 8 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.556 -1.228 19610 1506 1 8 . 1 1 13 13 GLY H H 13 8.605 8.605 8.431 0.174 19610 1507 1 8 . 1 1 14 14 THR N N 14 113.531 113.531 117.440 -3.909 19610 1508 1 8 . 1 1 14 14 THR HA H 14 4.309 4.309 3.990 0.319 19610 1509 1 8 . 1 1 14 14 THR C C 14 174.742 174.742 175.731 -0.989 19610 1510 1 8 . 1 1 14 14 THR CA C 14 62.130 62.130 64.927 -2.797 19610 1511 1 8 . 1 1 14 14 THR CB C 14 69.981 69.981 68.768 1.213 19610 1512 1 8 . 1 1 14 14 THR H H 14 8.164 8.164 8.112 0.052 19610 1513 1 8 . 1 1 15 15 ASP N N 15 122.439 122.439 119.264 3.175 19610 1514 1 8 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.395 0.115 19610 1515 1 8 . 1 1 15 15 ASP C C 15 177.216 177.216 178.456 -1.240 19610 1516 1 8 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.764 -2.502 19610 1517 1 8 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.715 -0.022 19610 1518 1 8 . 1 1 15 15 ASP H H 15 8.537 8.537 8.699 -0.162 19610 1519 1 8 . 1 1 16 16 LYS N N 16 122.807 122.807 118.447 4.360 19610 1520 1 8 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.075 0.043 19610 1521 1 8 . 1 1 16 16 LYS C C 16 177.430 177.430 179.247 -1.817 19610 1522 1 8 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.681 -0.788 19610 1523 1 8 . 1 1 16 16 LYS CB C 16 32.539 32.539 32.045 0.494 19610 1524 1 8 . 1 1 16 16 LYS H H 16 8.288 8.288 7.638 0.650 19610 1525 1 8 . 1 1 17 17 GLU N N 17 119.492 119.492 119.112 0.380 19610 1526 1 8 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.202 -0.090 19610 1527 1 8 . 1 1 17 17 GLU C C 17 178.007 178.007 179.083 -1.076 19610 1528 1 8 . 1 1 17 17 GLU CA C 17 58.252 58.252 58.632 -0.380 19610 1529 1 8 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.562 0.085 19610 1530 1 8 . 1 1 17 17 GLU H H 17 8.221 8.221 7.450 0.771 19610 1531 1 8 . 1 1 18 18 LEU N N 18 119.493 119.493 117.738 1.755 19610 1532 1 8 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.287 -0.140 19610 1533 1 8 . 1 1 18 18 LEU C C 18 178.359 178.359 179.357 -0.998 19610 1534 1 8 . 1 1 18 18 LEU CA C 18 56.422 56.422 58.001 -1.579 19610 1535 1 8 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.177 0.583 19610 1536 1 8 . 1 1 18 18 LEU H H 18 7.998 7.998 8.242 -0.244 19610 1537 1 8 . 1 1 19 19 SER N N 19 114.728 114.728 114.520 0.208 19610 1538 1 8 . 1 1 19 19 SER HA H 19 4.113 4.113 4.153 -0.040 19610 1539 1 8 . 1 1 19 19 SER C C 19 175.912 175.912 176.225 -0.313 19610 1540 1 8 . 1 1 19 19 SER CA C 19 60.881 60.881 61.466 -0.585 19610 1541 1 8 . 1 1 19 19 SER CB C 19 63.043 63.043 62.642 0.401 19610 1542 1 8 . 1 1 19 19 SER H H 19 8.068 8.068 7.897 0.171 19610 1543 1 8 . 1 1 20 20 ASP N N 20 121.206 121.206 121.834 -0.628 19610 1544 1 8 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.462 -0.014 19610 1545 1 8 . 1 1 20 20 ASP C C 20 177.598 177.598 178.291 -0.693 19610 1546 1 8 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.358 -0.362 19610 1547 1 8 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.184 -0.645 19610 1548 1 8 . 1 1 20 20 ASP H H 20 8.301 8.301 7.577 0.724 19610 1549 1 8 . 1 1 21 21 LEU N N 21 119.944 119.944 119.790 0.154 19610 1550 1 8 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.453 -0.311 19610 1551 1 8 . 1 1 21 21 LEU C C 21 177.822 177.822 178.353 -0.531 19610 1552 1 8 . 1 1 21 21 LEU CA C 21 56.439 56.439 56.687 -0.248 19610 1553 1 8 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.367 0.884 19610 1554 1 8 . 1 1 21 21 LEU H H 21 7.807 7.807 8.088 -0.281 19610 1555 1 8 . 1 1 22 22 LEU N N 22 119.558 119.558 121.346 -1.788 19610 1556 1 8 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.994 0.082 19610 1557 1 8 . 1 1 22 22 LEU C C 22 177.131 177.131 177.928 -0.797 19610 1558 1 8 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.117 -2.062 19610 1559 1 8 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.504 0.340 19610 1560 1 8 . 1 1 22 22 LEU H H 22 7.878 7.878 7.971 -0.093 19610 1561 1 8 . 1 1 23 23 ASP N N 23 119.509 119.509 119.415 0.094 19610 1562 1 8 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.218 0.246 19610 1563 1 8 . 1 1 23 23 ASP C C 23 177.379 177.379 178.503 -1.124 19610 1564 1 8 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.463 -2.536 19610 1565 1 8 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.561 0.178 19610 1566 1 8 . 1 1 23 23 ASP H H 23 7.990 7.990 7.519 0.471 19610 1567 1 8 . 1 1 24 24 PHE N N 24 121.219 121.219 117.617 3.602 19610 1568 1 8 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.168 0.298 19610 1569 1 8 . 1 1 24 24 PHE C C 24 176.875 176.875 178.022 -1.147 19610 1570 1 8 . 1 1 24 24 PHE CA C 24 59.229 59.229 60.023 -0.794 19610 1571 1 8 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.056 0.951 19610 1572 1 8 . 1 1 24 24 PHE H H 24 8.204 8.204 7.485 0.719 19610 1573 1 8 . 1 1 25 25 SER N N 25 115.500 115.500 115.963 -0.463 19610 1574 1 8 . 1 1 25 25 SER HA H 25 4.108 4.108 4.652 -0.544 19610 1575 1 8 . 1 1 25 25 SER C C 25 175.386 175.386 176.117 -0.731 19610 1576 1 8 . 1 1 25 25 SER CA C 25 60.758 60.758 61.582 -0.824 19610 1577 1 8 . 1 1 25 25 SER CB C 25 62.998 62.998 63.286 -0.288 19610 1578 1 8 . 1 1 25 25 SER H H 25 8.326 8.326 8.014 0.312 19610 1579 1 8 . 1 1 26 26 MET N N 26 119.723 119.723 117.058 2.665 19610 1580 1 8 . 1 1 26 26 MET HA H 26 4.363 4.363 4.670 -0.307 19610 1581 1 8 . 1 1 26 26 MET C C 26 176.450 176.450 177.249 -0.799 19610 1582 1 8 . 1 1 26 26 MET CA C 26 55.949 55.949 56.416 -0.467 19610 1583 1 8 . 1 1 26 26 MET CB C 26 31.868 31.868 32.792 -0.924 19610 1584 1 8 . 1 1 26 26 MET H H 26 7.889 7.889 7.818 0.071 19610 1585 1 8 . 1 1 27 27 MET N N 27 117.872 117.872 118.999 -1.127 19610 1586 1 8 . 1 1 27 27 MET HA H 27 4.186 4.186 4.308 -0.122 19610 1587 1 8 . 1 1 27 27 MET C C 27 175.341 175.341 176.798 -1.457 19610 1588 1 8 . 1 1 27 27 MET CA C 27 56.102 56.102 57.269 -1.167 19610 1589 1 8 . 1 1 27 27 MET CB C 27 33.161 33.161 33.395 -0.234 19610 1590 1 8 . 1 1 27 27 MET H H 27 7.656 7.656 7.539 0.117 19610 1591 1 8 . 1 1 28 28 PHE N N 28 118.702 118.702 121.620 -2.918 19610 1592 1 8 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.446 0.358 19610 1593 1 8 . 1 1 28 28 PHE C C 28 173.132 173.132 175.137 -2.005 19610 1594 1 8 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.060 -2.265 19610 1595 1 8 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.266 0.463 19610 1596 1 8 . 1 1 28 28 PHE H H 28 7.682 7.682 7.773 -0.091 19610 1597 1 8 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.377 0.084 19610 1598 1 8 . 1 1 29 29 PRO C C 29 176.360 176.360 176.500 -0.140 19610 1599 1 8 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.372 -0.552 19610 1600 1 8 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.991 -0.410 19610 1601 1 8 . 1 1 30 30 LEU N N 30 123.391 123.391 121.193 2.198 19610 1602 1 8 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.522 0.017 19610 1603 1 8 . 1 1 30 30 LEU C C 30 175.365 175.365 176.160 -0.795 19610 1604 1 8 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.640 -0.729 19610 1605 1 8 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.818 -0.145 19610 1606 1 8 . 1 1 30 30 LEU H H 30 8.284 8.284 7.721 0.563 19610 1607 1 8 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.486 -0.048 19610 1608 1 8 . 1 1 31 31 PRO C C 31 176.688 176.688 175.852 0.836 19610 1609 1 8 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.228 0.652 19610 1610 1 8 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.593 1.450 19610 1611 1 8 . 1 1 32 32 VAL N N 32 120.844 120.844 125.736 -4.892 19610 1612 1 8 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.926 0.214 19610 1613 1 8 . 1 1 32 32 VAL C C 32 176.579 176.579 175.877 0.702 19610 1614 1 8 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.555 -0.314 19610 1615 1 8 . 1 1 32 32 VAL CB C 32 32.809 32.809 32.275 0.534 19610 1616 1 8 . 1 1 32 32 VAL H H 32 8.344 8.344 7.938 0.406 19610 1617 1 8 . 1 1 33 33 THR N N 33 118.041 118.041 123.072 -5.031 19610 1618 1 8 . 1 1 33 33 THR HA H 33 4.373 4.373 4.339 0.034 19610 1619 1 8 . 1 1 33 33 THR C C 33 174.172 174.172 174.608 -0.436 19610 1620 1 8 . 1 1 33 33 THR CA C 33 61.407 61.407 61.895 -0.488 19610 1621 1 8 . 1 1 33 33 THR CB C 33 69.891 69.891 67.267 2.624 19610 1622 1 8 . 1 1 33 33 THR H H 33 8.326 8.326 8.208 0.118 19610 1623 1 8 . 1 1 34 34 ASN N N 34 121.367 121.367 118.536 2.831 19610 1624 1 8 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.390 0.319 19610 1625 1 8 . 1 1 34 34 ASN C C 34 175.639 175.639 176.029 -0.390 19610 1626 1 8 . 1 1 34 34 ASN CA C 34 53.218 53.218 54.479 -1.261 19610 1627 1 8 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.228 1.729 19610 1628 1 8 . 1 1 34 34 ASN H H 34 8.526 8.526 8.265 0.261 19610 1629 1 8 . 1 1 35 35 GLY N N 35 109.437 109.437 107.136 2.301 19610 1630 1 8 . 1 1 35 35 GLY C C 35 174.112 174.112 174.680 -0.568 19610 1631 1 8 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.776 -0.406 19610 1632 1 8 . 1 1 35 35 GLY H H 35 8.449 8.449 8.089 0.360 19610 1633 1 8 . 1 1 36 36 LYS N N 36 120.614 120.614 120.916 -0.302 19610 1634 1 8 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.508 -0.205 19610 1635 1 8 . 1 1 36 36 LYS C C 36 177.182 177.182 175.856 1.326 19610 1636 1 8 . 1 1 36 36 LYS CA C 36 56.300 56.300 55.130 1.170 19610 1637 1 8 . 1 1 36 36 LYS CB C 36 32.895 32.895 34.787 -1.892 19610 1638 1 8 . 1 1 36 36 LYS H H 36 8.261 8.261 7.516 0.745 19610 1639 1 8 . 1 1 37 37 GLY N N 37 110.011 110.011 110.715 -0.704 19610 1640 1 8 . 1 1 37 37 GLY C C 37 173.463 173.463 174.408 -0.945 19610 1641 1 8 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.260 -0.138 19610 1642 1 8 . 1 1 37 37 GLY H H 37 8.484 8.484 8.575 -0.091 19610 1643 1 8 . 1 1 38 38 ARG N N 38 121.698 121.698 121.822 -0.124 19610 1644 1 8 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.124 0.495 19610 1645 1 8 . 1 1 38 38 ARG C C 38 173.448 173.448 174.565 -1.117 19610 1646 1 8 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.903 -1.200 19610 1647 1 8 . 1 1 38 38 ARG CB C 38 30.121 30.121 27.089 3.032 19610 1648 1 8 . 1 1 38 38 ARG H H 38 8.105 8.105 8.081 0.024 19610 1649 1 9 . 1 1 2 2 SER HA H 2 4.472 4.472 4.431 0.041 19610 1650 1 9 . 1 1 2 2 SER C C 2 174.628 174.628 174.604 0.024 19610 1651 1 9 . 1 1 2 2 SER CA C 2 58.397 58.397 58.559 -0.162 19610 1652 1 9 . 1 1 2 2 SER CB C 2 63.896 63.896 64.415 -0.519 19610 1653 1 9 . 1 1 3 3 MET N N 3 122.147 122.147 120.534 1.613 19610 1654 1 9 . 1 1 3 3 MET HA H 3 4.490 4.490 4.226 0.264 19610 1655 1 9 . 1 1 3 3 MET C C 3 175.934 175.934 175.150 0.784 19610 1656 1 9 . 1 1 3 3 MET CA C 3 55.552 55.552 55.173 0.379 19610 1657 1 9 . 1 1 3 3 MET CB C 3 32.645 32.645 30.960 1.685 19610 1658 1 9 . 1 1 3 3 MET H H 3 8.627 8.627 8.429 0.198 19610 1659 1 9 . 1 1 4 4 ASN N N 4 119.930 119.930 120.510 -0.580 19610 1660 1 9 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.815 -0.161 19610 1661 1 9 . 1 1 4 4 ASN C C 4 174.695 174.695 174.931 -0.236 19610 1662 1 9 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.042 0.195 19610 1663 1 9 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.056 0.713 19610 1664 1 9 . 1 1 4 4 ASN H H 4 8.497 8.497 8.290 0.207 19610 1665 1 9 . 1 1 5 5 GLN N N 5 121.523 121.523 121.909 -0.386 19610 1666 1 9 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.587 0.006 19610 1667 1 9 . 1 1 5 5 GLN C C 5 173.849 173.849 174.453 -0.604 19610 1668 1 9 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.146 -0.422 19610 1669 1 9 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.473 0.441 19610 1670 1 9 . 1 1 5 5 GLN H H 5 8.322 8.322 7.711 0.611 19610 1671 1 9 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.390 -0.012 19610 1672 1 9 . 1 1 6 6 PRO C C 6 176.816 176.816 176.646 0.170 19610 1673 1 9 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.671 0.486 19610 1674 1 9 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.399 -0.313 19610 1675 1 9 . 1 1 7 7 GLN N N 7 121.005 121.005 120.537 0.468 19610 1676 1 9 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.060 0.185 19610 1677 1 9 . 1 1 7 7 GLN C C 7 175.941 175.941 176.240 -0.299 19610 1678 1 9 . 1 1 7 7 GLN CA C 7 55.785 55.785 56.521 -0.736 19610 1679 1 9 . 1 1 7 7 GLN CB C 7 29.495 29.495 28.644 0.851 19610 1680 1 9 . 1 1 7 7 GLN H H 7 8.576 8.576 8.422 0.154 19610 1681 1 9 . 1 1 8 8 ARG N N 8 122.928 122.928 124.521 -1.593 19610 1682 1 9 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.207 0.080 19610 1683 1 9 . 1 1 8 8 ARG C C 8 176.061 176.061 176.621 -0.560 19610 1684 1 9 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.253 -0.257 19610 1685 1 9 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.555 0.261 19610 1686 1 9 . 1 1 8 8 ARG H H 8 8.449 8.449 8.483 -0.034 19610 1687 1 9 . 1 1 9 9 MET N N 9 122.430 122.430 122.749 -0.319 19610 1688 1 9 . 1 1 9 9 MET HA H 9 4.450 4.450 4.405 0.045 19610 1689 1 9 . 1 1 9 9 MET C C 9 175.469 175.469 176.844 -1.375 19610 1690 1 9 . 1 1 9 9 MET CA C 9 54.941 54.941 55.355 -0.414 19610 1691 1 9 . 1 1 9 9 MET CB C 9 33.058 33.058 33.054 0.004 19610 1692 1 9 . 1 1 9 9 MET H H 9 8.471 8.471 8.226 0.245 19610 1693 1 9 . 1 1 10 10 ALA N N 10 127.153 127.153 127.462 -0.309 19610 1694 1 9 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.372 0.169 19610 1695 1 9 . 1 1 10 10 ALA C C 10 175.353 175.353 177.104 -1.751 19610 1696 1 9 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.988 -0.501 19610 1697 1 9 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.671 -0.640 19610 1698 1 9 . 1 1 10 10 ALA H H 10 8.398 8.398 8.264 0.134 19610 1699 1 9 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.381 0.057 19610 1700 1 9 . 1 1 11 11 PRO C C 11 176.896 176.896 176.736 0.160 19610 1701 1 9 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.766 -0.911 19610 1702 1 9 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.266 -0.245 19610 1703 1 9 . 1 1 12 12 VAL N N 12 120.652 120.652 117.194 3.458 19610 1704 1 9 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.214 -0.124 19610 1705 1 9 . 1 1 12 12 VAL C C 12 176.825 176.825 174.393 2.432 19610 1706 1 9 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.160 1.243 19610 1707 1 9 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.067 -1.166 19610 1708 1 9 . 1 1 12 12 VAL H H 12 8.373 8.373 7.502 0.871 19610 1709 1 9 . 1 1 13 13 GLY N N 13 112.483 112.483 112.616 -0.133 19610 1710 1 9 . 1 1 13 13 GLY C C 13 174.515 174.515 175.078 -0.563 19610 1711 1 9 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.385 -1.057 19610 1712 1 9 . 1 1 13 13 GLY H H 13 8.605 8.605 8.212 0.393 19610 1713 1 9 . 1 1 14 14 THR N N 14 113.531 113.531 117.060 -3.529 19610 1714 1 9 . 1 1 14 14 THR HA H 14 4.309 4.309 4.222 0.087 19610 1715 1 9 . 1 1 14 14 THR C C 14 174.742 174.742 175.803 -1.061 19610 1716 1 9 . 1 1 14 14 THR CA C 14 62.130 62.130 64.511 -2.381 19610 1717 1 9 . 1 1 14 14 THR CB C 14 69.981 69.981 68.828 1.153 19610 1718 1 9 . 1 1 14 14 THR H H 14 8.164 8.164 8.085 0.079 19610 1719 1 9 . 1 1 15 15 ASP N N 15 122.439 122.439 120.074 2.365 19610 1720 1 9 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.420 0.090 19610 1721 1 9 . 1 1 15 15 ASP C C 15 177.216 177.216 178.300 -1.084 19610 1722 1 9 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.871 -2.609 19610 1723 1 9 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.862 -0.169 19610 1724 1 9 . 1 1 15 15 ASP H H 15 8.537 8.537 8.691 -0.154 19610 1725 1 9 . 1 1 16 16 LYS N N 16 122.807 122.807 118.965 3.842 19610 1726 1 9 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.075 0.043 19610 1727 1 9 . 1 1 16 16 LYS C C 16 177.430 177.430 179.161 -1.731 19610 1728 1 9 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.626 -0.733 19610 1729 1 9 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.925 0.614 19610 1730 1 9 . 1 1 16 16 LYS H H 16 8.288 8.288 7.502 0.786 19610 1731 1 9 . 1 1 17 17 GLU N N 17 119.492 119.492 119.169 0.323 19610 1732 1 9 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.132 -0.020 19610 1733 1 9 . 1 1 17 17 GLU C C 17 178.007 178.007 179.321 -1.314 19610 1734 1 9 . 1 1 17 17 GLU CA C 17 58.252 58.252 58.846 -0.594 19610 1735 1 9 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.309 0.338 19610 1736 1 9 . 1 1 17 17 GLU H H 17 8.221 8.221 7.734 0.487 19610 1737 1 9 . 1 1 18 18 LEU N N 18 119.493 119.493 117.043 2.450 19610 1738 1 9 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.213 -0.066 19610 1739 1 9 . 1 1 18 18 LEU C C 18 178.359 178.359 179.099 -0.740 19610 1740 1 9 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.804 -1.382 19610 1741 1 9 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.161 0.599 19610 1742 1 9 . 1 1 18 18 LEU H H 18 7.998 7.998 8.019 -0.021 19610 1743 1 9 . 1 1 19 19 SER N N 19 114.728 114.728 115.587 -0.859 19610 1744 1 9 . 1 1 19 19 SER HA H 19 4.113 4.113 4.090 0.023 19610 1745 1 9 . 1 1 19 19 SER C C 19 175.912 175.912 176.658 -0.746 19610 1746 1 9 . 1 1 19 19 SER CA C 19 60.881 60.881 61.875 -0.994 19610 1747 1 9 . 1 1 19 19 SER CB C 19 63.043 63.043 62.791 0.251 19610 1748 1 9 . 1 1 19 19 SER H H 19 8.068 8.068 7.822 0.246 19610 1749 1 9 . 1 1 20 20 ASP N N 20 121.206 121.206 122.054 -0.848 19610 1750 1 9 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.249 0.199 19610 1751 1 9 . 1 1 20 20 ASP C C 20 177.598 177.598 178.420 -0.822 19610 1752 1 9 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.345 -1.350 19610 1753 1 9 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.813 -0.274 19610 1754 1 9 . 1 1 20 20 ASP H H 20 8.301 8.301 7.940 0.361 19610 1755 1 9 . 1 1 21 21 LEU N N 21 119.944 119.944 118.399 1.545 19610 1756 1 9 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.628 -0.486 19610 1757 1 9 . 1 1 21 21 LEU C C 21 177.822 177.822 178.485 -0.663 19610 1758 1 9 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.241 1.198 19610 1759 1 9 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.091 1.161 19610 1760 1 9 . 1 1 21 21 LEU H H 21 7.807 7.807 7.852 -0.045 19610 1761 1 9 . 1 1 22 22 LEU N N 22 119.558 119.558 121.482 -1.924 19610 1762 1 9 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.162 -0.086 19610 1763 1 9 . 1 1 22 22 LEU C C 22 177.131 177.131 178.235 -1.104 19610 1764 1 9 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.568 -1.513 19610 1765 1 9 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.995 -0.151 19610 1766 1 9 . 1 1 22 22 LEU H H 22 7.878 7.878 7.780 0.098 19610 1767 1 9 . 1 1 23 23 ASP N N 23 119.509 119.509 120.164 -0.655 19610 1768 1 9 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.248 0.216 19610 1769 1 9 . 1 1 23 23 ASP C C 23 177.379 177.379 178.534 -1.155 19610 1770 1 9 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.536 -2.609 19610 1771 1 9 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.647 0.092 19610 1772 1 9 . 1 1 23 23 ASP H H 23 7.990 7.990 7.704 0.286 19610 1773 1 9 . 1 1 24 24 PHE N N 24 121.219 121.219 117.604 3.615 19610 1774 1 9 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.357 0.109 19610 1775 1 9 . 1 1 24 24 PHE C C 24 176.875 176.875 177.812 -0.937 19610 1776 1 9 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.676 -0.447 19610 1777 1 9 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.489 0.518 19610 1778 1 9 . 1 1 24 24 PHE H H 24 8.204 8.204 7.798 0.406 19610 1779 1 9 . 1 1 25 25 SER N N 25 115.500 115.500 116.518 -1.018 19610 1780 1 9 . 1 1 25 25 SER HA H 25 4.108 4.108 4.653 -0.545 19610 1781 1 9 . 1 1 25 25 SER C C 25 175.386 175.386 176.177 -0.791 19610 1782 1 9 . 1 1 25 25 SER CA C 25 60.758 60.758 61.491 -0.733 19610 1783 1 9 . 1 1 25 25 SER CB C 25 62.998 62.998 63.169 -0.170 19610 1784 1 9 . 1 1 25 25 SER H H 25 8.326 8.326 7.672 0.654 19610 1785 1 9 . 1 1 26 26 MET N N 26 119.723 119.723 117.197 2.526 19610 1786 1 9 . 1 1 26 26 MET HA H 26 4.363 4.363 4.574 -0.211 19610 1787 1 9 . 1 1 26 26 MET C C 26 176.450 176.450 177.432 -0.982 19610 1788 1 9 . 1 1 26 26 MET CA C 26 55.949 55.949 56.747 -0.798 19610 1789 1 9 . 1 1 26 26 MET CB C 26 31.868 31.868 32.334 -0.466 19610 1790 1 9 . 1 1 26 26 MET H H 26 7.889 7.889 7.917 -0.028 19610 1791 1 9 . 1 1 27 27 MET N N 27 117.872 117.872 118.971 -1.099 19610 1792 1 9 . 1 1 27 27 MET HA H 27 4.186 4.186 4.363 -0.177 19610 1793 1 9 . 1 1 27 27 MET C C 27 175.341 175.341 176.614 -1.273 19610 1794 1 9 . 1 1 27 27 MET CA C 27 56.102 56.102 55.975 0.127 19610 1795 1 9 . 1 1 27 27 MET CB C 27 33.161 33.161 33.055 0.106 19610 1796 1 9 . 1 1 27 27 MET H H 27 7.656 7.656 7.469 0.187 19610 1797 1 9 . 1 1 28 28 PHE N N 28 118.702 118.702 121.916 -3.214 19610 1798 1 9 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.439 0.365 19610 1799 1 9 . 1 1 28 28 PHE C C 28 173.132 173.132 175.200 -2.068 19610 1800 1 9 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.412 -2.617 19610 1801 1 9 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.431 0.298 19610 1802 1 9 . 1 1 28 28 PHE H H 28 7.682 7.682 7.778 -0.096 19610 1803 1 9 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.525 -0.064 19610 1804 1 9 . 1 1 29 29 PRO C C 29 176.360 176.360 176.170 0.190 19610 1805 1 9 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.170 -0.350 19610 1806 1 9 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.936 -0.355 19610 1807 1 9 . 1 1 30 30 LEU N N 30 123.391 123.391 122.908 0.483 19610 1808 1 9 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.636 -0.097 19610 1809 1 9 . 1 1 30 30 LEU C C 30 175.365 175.365 175.932 -0.567 19610 1810 1 9 . 1 1 30 30 LEU CA C 30 52.911 52.911 52.701 0.210 19610 1811 1 9 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.989 -0.316 19610 1812 1 9 . 1 1 30 30 LEU H H 30 8.284 8.284 7.633 0.651 19610 1813 1 9 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.501 -0.063 19610 1814 1 9 . 1 1 31 31 PRO C C 31 176.688 176.688 176.086 0.602 19610 1815 1 9 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.453 0.427 19610 1816 1 9 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.381 1.663 19610 1817 1 9 . 1 1 32 32 VAL N N 32 120.844 120.844 126.430 -5.586 19610 1818 1 9 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.023 0.117 19610 1819 1 9 . 1 1 32 32 VAL C C 32 176.579 176.579 176.205 0.374 19610 1820 1 9 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.435 -0.195 19610 1821 1 9 . 1 1 32 32 VAL CB C 32 32.809 32.809 30.865 1.944 19610 1822 1 9 . 1 1 32 32 VAL H H 32 8.344 8.344 7.922 0.422 19610 1823 1 9 . 1 1 33 33 THR N N 33 118.041 118.041 118.881 -0.840 19610 1824 1 9 . 1 1 33 33 THR HA H 33 4.373 4.373 4.852 -0.479 19610 1825 1 9 . 1 1 33 33 THR C C 33 174.172 174.172 174.906 -0.734 19610 1826 1 9 . 1 1 33 33 THR CA C 33 61.407 61.407 60.588 0.819 19610 1827 1 9 . 1 1 33 33 THR CB C 33 69.891 69.891 68.269 1.622 19610 1828 1 9 . 1 1 33 33 THR H H 33 8.326 8.326 8.159 0.167 19610 1829 1 9 . 1 1 34 34 ASN N N 34 121.367 121.367 121.027 0.340 19610 1830 1 9 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.903 -0.194 19610 1831 1 9 . 1 1 34 34 ASN C C 34 175.639 175.639 175.436 0.203 19610 1832 1 9 . 1 1 34 34 ASN CA C 34 53.218 53.218 52.615 0.603 19610 1833 1 9 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.362 0.595 19610 1834 1 9 . 1 1 34 34 ASN H H 34 8.526 8.526 7.691 0.835 19610 1835 1 9 . 1 1 35 35 GLY N N 35 109.437 109.437 107.857 1.580 19610 1836 1 9 . 1 1 35 35 GLY C C 35 174.112 174.112 174.057 0.055 19610 1837 1 9 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.079 0.291 19610 1838 1 9 . 1 1 35 35 GLY H H 35 8.449 8.449 7.987 0.462 19610 1839 1 9 . 1 1 36 36 LYS N N 36 120.614 120.614 121.279 -0.665 19610 1840 1 9 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.772 -0.469 19610 1841 1 9 . 1 1 36 36 LYS C C 36 177.182 177.182 176.697 0.485 19610 1842 1 9 . 1 1 36 36 LYS CA C 36 56.300 56.300 54.333 1.967 19610 1843 1 9 . 1 1 36 36 LYS CB C 36 32.895 32.895 33.980 -1.085 19610 1844 1 9 . 1 1 36 36 LYS H H 36 8.261 8.261 7.740 0.521 19610 1845 1 9 . 1 1 37 37 GLY N N 37 110.011 110.011 107.380 2.631 19610 1846 1 9 . 1 1 37 37 GLY C C 37 173.463 173.463 173.440 0.023 19610 1847 1 9 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.700 -0.578 19610 1848 1 9 . 1 1 37 37 GLY H H 37 8.484 8.484 8.622 -0.138 19610 1849 1 9 . 1 1 38 38 ARG N N 38 121.698 121.698 120.216 1.482 19610 1850 1 9 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.852 -0.233 19610 1851 1 9 . 1 1 38 38 ARG C C 38 173.448 173.448 174.174 -0.726 19610 1852 1 9 . 1 1 38 38 ARG CA C 38 53.702 53.702 53.187 0.515 19610 1853 1 9 . 1 1 38 38 ARG CB C 38 30.121 30.121 30.749 -0.628 19610 1854 1 9 . 1 1 38 38 ARG H H 38 8.105 8.105 8.052 0.053 19610 1855 1 10 . 1 1 2 2 SER HA H 2 4.472 4.472 4.187 0.285 19610 1856 1 10 . 1 1 2 2 SER C C 2 174.628 174.628 174.847 -0.219 19610 1857 1 10 . 1 1 2 2 SER CA C 2 58.397 58.397 58.139 0.258 19610 1858 1 10 . 1 1 2 2 SER CB C 2 63.896 63.896 62.910 0.986 19610 1859 1 10 . 1 1 3 3 MET N N 3 122.147 122.147 119.018 3.129 19610 1860 1 10 . 1 1 3 3 MET HA H 3 4.490 4.490 4.205 0.285 19610 1861 1 10 . 1 1 3 3 MET C C 3 175.934 175.934 176.206 -0.272 19610 1862 1 10 . 1 1 3 3 MET CA C 3 55.552 55.552 56.681 -1.129 19610 1863 1 10 . 1 1 3 3 MET CB C 3 32.645 32.645 32.764 -0.119 19610 1864 1 10 . 1 1 3 3 MET H H 3 8.627 8.627 8.069 0.558 19610 1865 1 10 . 1 1 4 4 ASN N N 4 119.930 119.930 117.554 2.376 19610 1866 1 10 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.910 -0.256 19610 1867 1 10 . 1 1 4 4 ASN C C 4 174.695 174.695 174.064 0.631 19610 1868 1 10 . 1 1 4 4 ASN CA C 4 53.237 53.237 52.315 0.922 19610 1869 1 10 . 1 1 4 4 ASN CB C 4 38.768 38.768 39.126 -0.358 19610 1870 1 10 . 1 1 4 4 ASN H H 4 8.497 8.497 7.966 0.531 19610 1871 1 10 . 1 1 5 5 GLN N N 5 121.523 121.523 122.059 -0.536 19610 1872 1 10 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.778 -0.185 19610 1873 1 10 . 1 1 5 5 GLN C C 5 173.849 173.849 174.593 -0.744 19610 1874 1 10 . 1 1 5 5 GLN CA C 5 53.724 53.724 53.806 -0.082 19610 1875 1 10 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.228 0.686 19610 1876 1 10 . 1 1 5 5 GLN H H 5 8.322 8.322 8.444 -0.122 19610 1877 1 10 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.409 -0.031 19610 1878 1 10 . 1 1 6 6 PRO C C 6 176.816 176.816 176.518 0.298 19610 1879 1 10 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.564 0.593 19610 1880 1 10 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.097 -0.011 19610 1881 1 10 . 1 1 7 7 GLN N N 7 121.005 121.005 117.938 3.067 19610 1882 1 10 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.173 0.072 19610 1883 1 10 . 1 1 7 7 GLN C C 7 175.941 175.941 175.744 0.197 19610 1884 1 10 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.658 0.127 19610 1885 1 10 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.179 0.316 19610 1886 1 10 . 1 1 7 7 GLN H H 7 8.576 8.576 8.233 0.343 19610 1887 1 10 . 1 1 8 8 ARG N N 8 122.928 122.928 121.235 1.693 19610 1888 1 10 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.188 0.099 19610 1889 1 10 . 1 1 8 8 ARG C C 8 176.061 176.061 176.525 -0.464 19610 1890 1 10 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.437 -0.441 19610 1891 1 10 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.371 1.445 19610 1892 1 10 . 1 1 8 8 ARG H H 8 8.449 8.449 8.556 -0.107 19610 1893 1 10 . 1 1 9 9 MET N N 9 122.430 122.430 123.774 -1.344 19610 1894 1 10 . 1 1 9 9 MET HA H 9 4.450 4.450 4.334 0.116 19610 1895 1 10 . 1 1 9 9 MET C C 9 175.469 175.469 176.357 -0.888 19610 1896 1 10 . 1 1 9 9 MET CA C 9 54.941 54.941 55.337 -0.396 19610 1897 1 10 . 1 1 9 9 MET CB C 9 33.058 33.058 33.118 -0.060 19610 1898 1 10 . 1 1 9 9 MET H H 9 8.471 8.471 8.237 0.234 19610 1899 1 10 . 1 1 10 10 ALA N N 10 127.153 127.153 127.825 -0.672 19610 1900 1 10 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.370 0.171 19610 1901 1 10 . 1 1 10 10 ALA C C 10 175.353 175.353 176.697 -1.344 19610 1902 1 10 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.950 -0.463 19610 1903 1 10 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.638 -0.607 19610 1904 1 10 . 1 1 10 10 ALA H H 10 8.398 8.398 8.307 0.091 19610 1905 1 10 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.329 0.109 19610 1906 1 10 . 1 1 11 11 PRO C C 11 176.896 176.896 176.747 0.149 19610 1907 1 10 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.863 -1.008 19610 1908 1 10 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.148 -0.127 19610 1909 1 10 . 1 1 12 12 VAL N N 12 120.652 120.652 116.292 4.360 19610 1910 1 10 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.277 -0.187 19610 1911 1 10 . 1 1 12 12 VAL C C 12 176.825 176.825 174.628 2.197 19610 1912 1 10 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.011 1.391 19610 1913 1 10 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.839 -0.938 19610 1914 1 10 . 1 1 12 12 VAL H H 12 8.373 8.373 7.595 0.778 19610 1915 1 10 . 1 1 13 13 GLY N N 13 112.483 112.483 111.435 1.048 19610 1916 1 10 . 1 1 13 13 GLY C C 13 174.515 174.515 174.911 -0.396 19610 1917 1 10 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.692 -0.364 19610 1918 1 10 . 1 1 13 13 GLY H H 13 8.605 8.605 7.952 0.653 19610 1919 1 10 . 1 1 14 14 THR N N 14 113.531 113.531 116.937 -3.406 19610 1920 1 10 . 1 1 14 14 THR HA H 14 4.309 4.309 4.478 -0.169 19610 1921 1 10 . 1 1 14 14 THR C C 14 174.742 174.742 175.322 -0.580 19610 1922 1 10 . 1 1 14 14 THR CA C 14 62.130 62.130 62.885 -0.755 19610 1923 1 10 . 1 1 14 14 THR CB C 14 69.981 69.981 68.917 1.064 19610 1924 1 10 . 1 1 14 14 THR H H 14 8.164 8.164 8.107 0.057 19610 1925 1 10 . 1 1 15 15 ASP N N 15 122.439 122.439 121.084 1.355 19610 1926 1 10 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.385 0.125 19610 1927 1 10 . 1 1 15 15 ASP C C 15 177.216 177.216 178.239 -1.023 19610 1928 1 10 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.586 -2.324 19610 1929 1 10 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.766 -0.073 19610 1930 1 10 . 1 1 15 15 ASP H H 15 8.537 8.537 8.665 -0.128 19610 1931 1 10 . 1 1 16 16 LYS N N 16 122.807 122.807 118.008 4.799 19610 1932 1 10 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.128 -0.010 19610 1933 1 10 . 1 1 16 16 LYS C C 16 177.430 177.430 179.208 -1.778 19610 1934 1 10 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.453 -0.560 19610 1935 1 10 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.995 0.544 19610 1936 1 10 . 1 1 16 16 LYS H H 16 8.288 8.288 7.673 0.615 19610 1937 1 10 . 1 1 17 17 GLU N N 17 119.492 119.492 119.579 -0.087 19610 1938 1 10 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.110 0.002 19610 1939 1 10 . 1 1 17 17 GLU C C 17 178.007 178.007 179.064 -1.057 19610 1940 1 10 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.225 -0.973 19610 1941 1 10 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.691 -0.044 19610 1942 1 10 . 1 1 17 17 GLU H H 17 8.221 8.221 7.632 0.589 19610 1943 1 10 . 1 1 18 18 LEU N N 18 119.493 119.493 117.362 2.131 19610 1944 1 10 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.284 -0.137 19610 1945 1 10 . 1 1 18 18 LEU C C 18 178.359 178.359 179.039 -0.680 19610 1946 1 10 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.772 -1.350 19610 1947 1 10 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.313 0.447 19610 1948 1 10 . 1 1 18 18 LEU H H 18 7.998 7.998 8.051 -0.053 19610 1949 1 10 . 1 1 19 19 SER N N 19 114.728 114.728 114.029 0.699 19610 1950 1 10 . 1 1 19 19 SER HA H 19 4.113 4.113 4.167 -0.054 19610 1951 1 10 . 1 1 19 19 SER C C 19 175.912 175.912 175.924 -0.012 19610 1952 1 10 . 1 1 19 19 SER CA C 19 60.881 60.881 61.319 -0.438 19610 1953 1 10 . 1 1 19 19 SER CB C 19 63.043 63.043 62.979 0.064 19610 1954 1 10 . 1 1 19 19 SER H H 19 8.068 8.068 7.941 0.127 19610 1955 1 10 . 1 1 20 20 ASP N N 20 121.206 121.206 120.843 0.363 19610 1956 1 10 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.550 -0.102 19610 1957 1 10 . 1 1 20 20 ASP C C 20 177.598 177.598 178.111 -0.513 19610 1958 1 10 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.345 -0.350 19610 1959 1 10 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.360 -0.821 19610 1960 1 10 . 1 1 20 20 ASP H H 20 8.301 8.301 7.575 0.726 19610 1961 1 10 . 1 1 21 21 LEU N N 21 119.944 119.944 119.974 -0.030 19610 1962 1 10 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.431 -0.289 19610 1963 1 10 . 1 1 21 21 LEU C C 21 177.822 177.822 177.983 -0.161 19610 1964 1 10 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.941 0.498 19610 1965 1 10 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.424 0.828 19610 1966 1 10 . 1 1 21 21 LEU H H 21 7.807 7.807 8.210 -0.403 19610 1967 1 10 . 1 1 22 22 LEU N N 22 119.558 119.558 120.820 -1.262 19610 1968 1 10 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.007 0.069 19610 1969 1 10 . 1 1 22 22 LEU C C 22 177.131 177.131 178.143 -1.012 19610 1970 1 10 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.994 -1.939 19610 1971 1 10 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.591 0.253 19610 1972 1 10 . 1 1 22 22 LEU H H 22 7.878 7.878 7.660 0.218 19610 1973 1 10 . 1 1 23 23 ASP N N 23 119.509 119.509 119.465 0.044 19610 1974 1 10 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.250 0.214 19610 1975 1 10 . 1 1 23 23 ASP C C 23 177.379 177.379 178.313 -0.934 19610 1976 1 10 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.275 -2.348 19610 1977 1 10 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.383 0.356 19610 1978 1 10 . 1 1 23 23 ASP H H 23 7.990 7.990 7.533 0.457 19610 1979 1 10 . 1 1 24 24 PHE N N 24 121.219 121.219 117.430 3.789 19610 1980 1 10 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.345 0.121 19610 1981 1 10 . 1 1 24 24 PHE C C 24 176.875 176.875 177.671 -0.796 19610 1982 1 10 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.464 -0.235 19610 1983 1 10 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.438 0.569 19610 1984 1 10 . 1 1 24 24 PHE H H 24 8.204 8.204 7.245 0.959 19610 1985 1 10 . 1 1 25 25 SER N N 25 115.500 115.500 116.658 -1.158 19610 1986 1 10 . 1 1 25 25 SER HA H 25 4.108 4.108 4.682 -0.574 19610 1987 1 10 . 1 1 25 25 SER C C 25 175.386 175.386 176.240 -0.854 19610 1988 1 10 . 1 1 25 25 SER CA C 25 60.758 60.758 61.551 -0.793 19610 1989 1 10 . 1 1 25 25 SER CB C 25 62.998 62.998 63.333 -0.335 19610 1990 1 10 . 1 1 25 25 SER H H 25 8.326 8.326 7.912 0.414 19610 1991 1 10 . 1 1 26 26 MET N N 26 119.723 119.723 116.910 2.813 19610 1992 1 10 . 1 1 26 26 MET HA H 26 4.363 4.363 4.577 -0.214 19610 1993 1 10 . 1 1 26 26 MET C C 26 176.450 176.450 177.411 -0.961 19610 1994 1 10 . 1 1 26 26 MET CA C 26 55.949 55.949 56.705 -0.756 19610 1995 1 10 . 1 1 26 26 MET CB C 26 31.868 31.868 32.435 -0.567 19610 1996 1 10 . 1 1 26 26 MET H H 26 7.889 7.889 7.893 -0.004 19610 1997 1 10 . 1 1 27 27 MET N N 27 117.872 117.872 118.799 -0.927 19610 1998 1 10 . 1 1 27 27 MET HA H 27 4.186 4.186 4.374 -0.188 19610 1999 1 10 . 1 1 27 27 MET C C 27 175.341 175.341 176.552 -1.211 19610 2000 1 10 . 1 1 27 27 MET CA C 27 56.102 56.102 55.845 0.257 19610 2001 1 10 . 1 1 27 27 MET CB C 27 33.161 33.161 33.138 0.023 19610 2002 1 10 . 1 1 27 27 MET H H 27 7.656 7.656 7.456 0.200 19610 2003 1 10 . 1 1 28 28 PHE N N 28 118.702 118.702 122.129 -3.427 19610 2004 1 10 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.441 0.363 19610 2005 1 10 . 1 1 28 28 PHE C C 28 173.132 173.132 175.233 -2.101 19610 2006 1 10 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.304 -2.509 19610 2007 1 10 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.428 0.301 19610 2008 1 10 . 1 1 28 28 PHE H H 28 7.682 7.682 7.766 -0.084 19610 2009 1 10 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.500 -0.039 19610 2010 1 10 . 1 1 29 29 PRO C C 29 176.360 176.360 176.263 0.097 19610 2011 1 10 . 1 1 29 29 PRO CA C 29 62.820 62.820 62.898 -0.078 19610 2012 1 10 . 1 1 29 29 PRO CB C 29 31.581 31.581 32.036 -0.455 19610 2013 1 10 . 1 1 30 30 LEU N N 30 123.391 123.391 122.059 1.332 19610 2014 1 10 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.553 -0.014 19610 2015 1 10 . 1 1 30 30 LEU C C 30 175.365 175.365 176.934 -1.569 19610 2016 1 10 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.664 -0.753 19610 2017 1 10 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.852 -0.179 19610 2018 1 10 . 1 1 30 30 LEU H H 30 8.284 8.284 7.723 0.561 19610 2019 1 10 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.470 -0.032 19610 2020 1 10 . 1 1 31 31 PRO C C 31 176.688 176.688 175.615 1.073 19610 2021 1 10 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.540 0.340 19610 2022 1 10 . 1 1 31 31 PRO CB C 31 32.043 32.043 29.636 2.407 19610 2023 1 10 . 1 1 32 32 VAL N N 32 120.844 120.844 124.329 -3.485 19610 2024 1 10 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.009 0.131 19610 2025 1 10 . 1 1 32 32 VAL C C 32 176.579 176.579 176.784 -0.205 19610 2026 1 10 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.760 -0.519 19610 2027 1 10 . 1 1 32 32 VAL CB C 32 32.809 32.809 30.437 2.372 19610 2028 1 10 . 1 1 32 32 VAL H H 32 8.344 8.344 7.994 0.350 19610 2029 1 10 . 1 1 33 33 THR N N 33 118.041 118.041 120.230 -2.189 19610 2030 1 10 . 1 1 33 33 THR HA H 33 4.373 4.373 4.259 0.114 19610 2031 1 10 . 1 1 33 33 THR C C 33 174.172 174.172 175.069 -0.897 19610 2032 1 10 . 1 1 33 33 THR CA C 33 61.407 61.407 61.887 -0.480 19610 2033 1 10 . 1 1 33 33 THR CB C 33 69.891 69.891 69.438 0.453 19610 2034 1 10 . 1 1 33 33 THR H H 33 8.326 8.326 8.147 0.179 19610 2035 1 10 . 1 1 34 34 ASN N N 34 121.367 121.367 119.022 2.345 19610 2036 1 10 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.519 0.190 19610 2037 1 10 . 1 1 34 34 ASN C C 34 175.639 175.639 175.363 0.276 19610 2038 1 10 . 1 1 34 34 ASN CA C 34 53.218 53.218 52.655 0.563 19610 2039 1 10 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.319 0.638 19610 2040 1 10 . 1 1 34 34 ASN H H 34 8.526 8.526 8.520 0.006 19610 2041 1 10 . 1 1 35 35 GLY N N 35 109.437 109.437 107.454 1.983 19610 2042 1 10 . 1 1 35 35 GLY C C 35 174.112 174.112 173.862 0.250 19610 2043 1 10 . 1 1 35 35 GLY CA C 35 45.370 45.370 44.967 0.404 19610 2044 1 10 . 1 1 35 35 GLY H H 35 8.449 8.449 8.661 -0.212 19610 2045 1 10 . 1 1 36 36 LYS N N 36 120.614 120.614 121.495 -0.881 19610 2046 1 10 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.483 -0.180 19610 2047 1 10 . 1 1 36 36 LYS C C 36 177.182 177.182 177.199 -0.017 19610 2048 1 10 . 1 1 36 36 LYS CA C 36 56.300 56.300 55.857 0.443 19610 2049 1 10 . 1 1 36 36 LYS CB C 36 32.895 32.895 33.206 -0.311 19610 2050 1 10 . 1 1 36 36 LYS H H 36 8.261 8.261 7.999 0.262 19610 2051 1 10 . 1 1 37 37 GLY N N 37 110.011 110.011 110.403 -0.392 19610 2052 1 10 . 1 1 37 37 GLY C C 37 173.463 173.463 174.208 -0.745 19610 2053 1 10 . 1 1 37 37 GLY CA C 37 45.122 45.122 44.836 0.286 19610 2054 1 10 . 1 1 37 37 GLY H H 37 8.484 8.484 8.333 0.151 19610 2055 1 10 . 1 1 38 38 ARG N N 38 121.698 121.698 120.372 1.326 19610 2056 1 10 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.088 0.531 19610 2057 1 10 . 1 1 38 38 ARG C C 38 173.448 173.448 174.468 -1.020 19610 2058 1 10 . 1 1 38 38 ARG CA C 38 53.702 53.702 55.879 -2.177 19610 2059 1 10 . 1 1 38 38 ARG CB C 38 30.121 30.121 27.789 2.332 19610 2060 1 10 . 1 1 38 38 ARG H H 38 8.105 8.105 7.959 0.146 19610 2061 1 11 . 1 1 2 2 SER HA H 2 4.472 4.472 4.508 -0.036 19610 2062 1 11 . 1 1 2 2 SER C C 2 174.628 174.628 174.258 0.370 19610 2063 1 11 . 1 1 2 2 SER CA C 2 58.397 58.397 58.297 0.100 19610 2064 1 11 . 1 1 2 2 SER CB C 2 63.896 63.896 63.397 0.499 19610 2065 1 11 . 1 1 3 3 MET N N 3 122.147 122.147 126.842 -4.695 19610 2066 1 11 . 1 1 3 3 MET HA H 3 4.490 4.490 4.433 0.057 19610 2067 1 11 . 1 1 3 3 MET C C 3 175.934 175.934 174.920 1.014 19610 2068 1 11 . 1 1 3 3 MET CA C 3 55.552 55.552 54.669 0.883 19610 2069 1 11 . 1 1 3 3 MET CB C 3 32.645 32.645 30.605 2.039 19610 2070 1 11 . 1 1 3 3 MET H H 3 8.627 8.627 8.529 0.098 19610 2071 1 11 . 1 1 4 4 ASN N N 4 119.930 119.930 121.081 -1.151 19610 2072 1 11 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.741 -0.087 19610 2073 1 11 . 1 1 4 4 ASN C C 4 174.695 174.695 173.279 1.416 19610 2074 1 11 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.897 -0.660 19610 2075 1 11 . 1 1 4 4 ASN CB C 4 38.768 38.768 39.849 -1.081 19610 2076 1 11 . 1 1 4 4 ASN H H 4 8.497 8.497 8.044 0.453 19610 2077 1 11 . 1 1 5 5 GLN N N 5 121.523 121.523 124.496 -2.973 19610 2078 1 11 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.626 -0.033 19610 2079 1 11 . 1 1 5 5 GLN C C 5 173.849 173.849 174.189 -0.340 19610 2080 1 11 . 1 1 5 5 GLN CA C 5 53.724 53.724 53.922 -0.198 19610 2081 1 11 . 1 1 5 5 GLN CB C 5 28.914 28.914 29.425 -0.511 19610 2082 1 11 . 1 1 5 5 GLN H H 5 8.322 8.322 8.414 -0.092 19610 2083 1 11 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.464 -0.086 19610 2084 1 11 . 1 1 6 6 PRO C C 6 176.816 176.816 176.282 0.534 19610 2085 1 11 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.158 0.999 19610 2086 1 11 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.225 -0.139 19610 2087 1 11 . 1 1 7 7 GLN N N 7 121.005 121.005 118.764 2.241 19610 2088 1 11 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.080 0.165 19610 2089 1 11 . 1 1 7 7 GLN C C 7 175.941 175.941 175.720 0.221 19610 2090 1 11 . 1 1 7 7 GLN CA C 7 55.785 55.785 56.100 -0.315 19610 2091 1 11 . 1 1 7 7 GLN CB C 7 29.495 29.495 28.890 0.605 19610 2092 1 11 . 1 1 7 7 GLN H H 7 8.576 8.576 8.314 0.262 19610 2093 1 11 . 1 1 8 8 ARG N N 8 122.928 122.928 122.490 0.438 19610 2094 1 11 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.203 0.084 19610 2095 1 11 . 1 1 8 8 ARG C C 8 176.061 176.061 177.016 -0.955 19610 2096 1 11 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.468 -0.472 19610 2097 1 11 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.263 0.553 19610 2098 1 11 . 1 1 8 8 ARG H H 8 8.449 8.449 8.633 -0.184 19610 2099 1 11 . 1 1 9 9 MET N N 9 122.430 122.430 121.187 1.243 19610 2100 1 11 . 1 1 9 9 MET HA H 9 4.450 4.450 4.538 -0.088 19610 2101 1 11 . 1 1 9 9 MET C C 9 175.469 175.469 176.174 -0.705 19610 2102 1 11 . 1 1 9 9 MET CA C 9 54.941 54.941 55.990 -1.049 19610 2103 1 11 . 1 1 9 9 MET CB C 9 33.058 33.058 32.893 0.165 19610 2104 1 11 . 1 1 9 9 MET H H 9 8.471 8.471 8.157 0.314 19610 2105 1 11 . 1 1 10 10 ALA N N 10 127.153 127.153 126.809 0.344 19610 2106 1 11 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.442 0.099 19610 2107 1 11 . 1 1 10 10 ALA C C 10 175.353 175.353 176.187 -0.834 19610 2108 1 11 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.976 -0.489 19610 2109 1 11 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.125 -0.094 19610 2110 1 11 . 1 1 10 10 ALA H H 10 8.398 8.398 8.247 0.151 19610 2111 1 11 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.478 -0.040 19610 2112 1 11 . 1 1 11 11 PRO C C 11 176.896 176.896 175.989 0.907 19610 2113 1 11 . 1 1 11 11 PRO CA C 11 62.855 62.855 62.502 0.353 19610 2114 1 11 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.164 -0.143 19610 2115 1 11 . 1 1 12 12 VAL N N 12 120.652 120.652 117.948 2.704 19610 2116 1 11 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.228 -0.138 19610 2117 1 11 . 1 1 12 12 VAL C C 12 176.825 176.825 176.080 0.745 19610 2118 1 11 . 1 1 12 12 VAL CA C 12 62.403 62.403 62.767 -0.364 19610 2119 1 11 . 1 1 12 12 VAL CB C 12 32.901 32.901 32.633 0.268 19610 2120 1 11 . 1 1 12 12 VAL H H 12 8.373 8.373 8.119 0.254 19610 2121 1 11 . 1 1 13 13 GLY N N 13 112.483 112.483 113.915 -1.432 19610 2122 1 11 . 1 1 13 13 GLY C C 13 174.515 174.515 175.107 -0.592 19610 2123 1 11 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.459 -1.131 19610 2124 1 11 . 1 1 13 13 GLY H H 13 8.605 8.605 8.456 0.149 19610 2125 1 11 . 1 1 14 14 THR N N 14 113.531 113.531 117.527 -3.996 19610 2126 1 11 . 1 1 14 14 THR HA H 14 4.309 4.309 4.240 0.069 19610 2127 1 11 . 1 1 14 14 THR C C 14 174.742 174.742 175.454 -0.712 19610 2128 1 11 . 1 1 14 14 THR CA C 14 62.130 62.130 63.924 -1.794 19610 2129 1 11 . 1 1 14 14 THR CB C 14 69.981 69.981 68.532 1.449 19610 2130 1 11 . 1 1 14 14 THR H H 14 8.164 8.164 8.310 -0.146 19610 2131 1 11 . 1 1 15 15 ASP N N 15 122.439 122.439 120.598 1.841 19610 2132 1 11 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.356 0.154 19610 2133 1 11 . 1 1 15 15 ASP C C 15 177.216 177.216 178.044 -0.828 19610 2134 1 11 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.560 -2.298 19610 2135 1 11 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.718 -0.025 19610 2136 1 11 . 1 1 15 15 ASP H H 15 8.537 8.537 8.613 -0.076 19610 2137 1 11 . 1 1 16 16 LYS N N 16 122.807 122.807 118.124 4.683 19610 2138 1 11 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.155 -0.037 19610 2139 1 11 . 1 1 16 16 LYS C C 16 177.430 177.430 179.122 -1.692 19610 2140 1 11 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.223 -0.330 19610 2141 1 11 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.996 0.543 19610 2142 1 11 . 1 1 16 16 LYS H H 16 8.288 8.288 7.527 0.761 19610 2143 1 11 . 1 1 17 17 GLU N N 17 119.492 119.492 120.212 -0.720 19610 2144 1 11 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.063 0.049 19610 2145 1 11 . 1 1 17 17 GLU C C 17 178.007 178.007 179.042 -1.035 19610 2146 1 11 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.502 -1.250 19610 2147 1 11 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.669 -0.023 19610 2148 1 11 . 1 1 17 17 GLU H H 17 8.221 8.221 7.511 0.710 19610 2149 1 11 . 1 1 18 18 LEU N N 18 119.493 119.493 116.992 2.501 19610 2150 1 11 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.203 -0.056 19610 2151 1 11 . 1 1 18 18 LEU C C 18 178.359 178.359 179.013 -0.654 19610 2152 1 11 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.984 -1.562 19610 2153 1 11 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.260 0.500 19610 2154 1 11 . 1 1 18 18 LEU H H 18 7.998 7.998 8.085 -0.087 19610 2155 1 11 . 1 1 19 19 SER N N 19 114.728 114.728 115.580 -0.852 19610 2156 1 11 . 1 1 19 19 SER HA H 19 4.113 4.113 4.109 0.004 19610 2157 1 11 . 1 1 19 19 SER C C 19 175.912 175.912 176.559 -0.647 19610 2158 1 11 . 1 1 19 19 SER CA C 19 60.881 60.881 62.063 -1.182 19610 2159 1 11 . 1 1 19 19 SER CB C 19 63.043 63.043 62.607 0.436 19610 2160 1 11 . 1 1 19 19 SER H H 19 8.068 8.068 7.827 0.241 19610 2161 1 11 . 1 1 20 20 ASP N N 20 121.206 121.206 122.340 -1.134 19610 2162 1 11 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.162 0.286 19610 2163 1 11 . 1 1 20 20 ASP C C 20 177.598 177.598 178.416 -0.818 19610 2164 1 11 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.336 -1.341 19610 2165 1 11 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.763 -0.224 19610 2166 1 11 . 1 1 20 20 ASP H H 20 8.301 8.301 7.996 0.305 19610 2167 1 11 . 1 1 21 21 LEU N N 21 119.944 119.944 118.377 1.567 19610 2168 1 11 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.503 -0.361 19610 2169 1 11 . 1 1 21 21 LEU C C 21 177.822 177.822 178.659 -0.837 19610 2170 1 11 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.567 0.872 19610 2171 1 11 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.155 1.097 19610 2172 1 11 . 1 1 21 21 LEU H H 21 7.807 7.807 7.953 -0.146 19610 2173 1 11 . 1 1 22 22 LEU N N 22 119.558 119.558 121.832 -2.274 19610 2174 1 11 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.097 -0.021 19610 2175 1 11 . 1 1 22 22 LEU C C 22 177.131 177.131 178.276 -1.145 19610 2176 1 11 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.711 -1.656 19610 2177 1 11 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.804 0.040 19610 2178 1 11 . 1 1 22 22 LEU H H 22 7.878 7.878 7.658 0.220 19610 2179 1 11 . 1 1 23 23 ASP N N 23 119.509 119.509 119.832 -0.323 19610 2180 1 11 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.298 0.166 19610 2181 1 11 . 1 1 23 23 ASP C C 23 177.379 177.379 178.573 -1.194 19610 2182 1 11 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.403 -2.476 19610 2183 1 11 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.693 0.046 19610 2184 1 11 . 1 1 23 23 ASP H H 23 7.990 7.990 7.915 0.075 19610 2185 1 11 . 1 1 24 24 PHE N N 24 121.219 121.219 117.704 3.515 19610 2186 1 11 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.428 0.038 19610 2187 1 11 . 1 1 24 24 PHE C C 24 176.875 176.875 177.561 -0.686 19610 2188 1 11 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.023 0.206 19610 2189 1 11 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.462 0.545 19610 2190 1 11 . 1 1 24 24 PHE H H 24 8.204 8.204 7.703 0.501 19610 2191 1 11 . 1 1 25 25 SER N N 25 115.500 115.500 116.500 -1.000 19610 2192 1 11 . 1 1 25 25 SER HA H 25 4.108 4.108 4.607 -0.499 19610 2193 1 11 . 1 1 25 25 SER C C 25 175.386 175.386 176.312 -0.926 19610 2194 1 11 . 1 1 25 25 SER CA C 25 60.758 60.758 61.819 -1.061 19610 2195 1 11 . 1 1 25 25 SER CB C 25 62.998 62.998 63.413 -0.415 19610 2196 1 11 . 1 1 25 25 SER H H 25 8.326 8.326 7.800 0.526 19610 2197 1 11 . 1 1 26 26 MET N N 26 119.723 119.723 117.201 2.522 19610 2198 1 11 . 1 1 26 26 MET HA H 26 4.363 4.363 4.528 -0.165 19610 2199 1 11 . 1 1 26 26 MET C C 26 176.450 176.450 177.862 -1.412 19610 2200 1 11 . 1 1 26 26 MET CA C 26 55.949 55.949 57.066 -1.117 19610 2201 1 11 . 1 1 26 26 MET CB C 26 31.868 31.868 32.181 -0.313 19610 2202 1 11 . 1 1 26 26 MET H H 26 7.889 7.889 7.936 -0.047 19610 2203 1 11 . 1 1 27 27 MET N N 27 117.872 117.872 119.741 -1.869 19610 2204 1 11 . 1 1 27 27 MET HA H 27 4.186 4.186 4.307 -0.121 19610 2205 1 11 . 1 1 27 27 MET C C 27 175.341 175.341 176.596 -1.255 19610 2206 1 11 . 1 1 27 27 MET CA C 27 56.102 56.102 56.335 -0.233 19610 2207 1 11 . 1 1 27 27 MET CB C 27 33.161 33.161 32.665 0.496 19610 2208 1 11 . 1 1 27 27 MET H H 27 7.656 7.656 7.513 0.143 19610 2209 1 11 . 1 1 28 28 PHE N N 28 118.702 118.702 120.981 -2.279 19610 2210 1 11 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.472 0.332 19610 2211 1 11 . 1 1 28 28 PHE C C 28 173.132 173.132 175.149 -2.017 19610 2212 1 11 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.174 -2.379 19610 2213 1 11 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.130 0.599 19610 2214 1 11 . 1 1 28 28 PHE H H 28 7.682 7.682 7.757 -0.075 19610 2215 1 11 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.441 0.020 19610 2216 1 11 . 1 1 29 29 PRO C C 29 176.360 176.360 176.265 0.095 19610 2217 1 11 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.157 -0.337 19610 2218 1 11 . 1 1 29 29 PRO CB C 29 31.581 31.581 32.040 -0.459 19610 2219 1 11 . 1 1 30 30 LEU N N 30 123.391 123.391 121.740 1.651 19610 2220 1 11 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.538 0.001 19610 2221 1 11 . 1 1 30 30 LEU C C 30 175.365 175.365 176.060 -0.695 19610 2222 1 11 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.414 -0.503 19610 2223 1 11 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.781 -0.108 19610 2224 1 11 . 1 1 30 30 LEU H H 30 8.284 8.284 7.733 0.551 19610 2225 1 11 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.406 0.032 19610 2226 1 11 . 1 1 31 31 PRO C C 31 176.688 176.688 175.960 0.728 19610 2227 1 11 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.951 -0.071 19610 2228 1 11 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.457 1.586 19610 2229 1 11 . 1 1 32 32 VAL N N 32 120.844 120.844 123.605 -2.761 19610 2230 1 11 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.095 0.045 19610 2231 1 11 . 1 1 32 32 VAL C C 32 176.579 176.579 176.581 -0.002 19610 2232 1 11 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.235 0.006 19610 2233 1 11 . 1 1 32 32 VAL CB C 32 32.809 32.809 32.950 -0.141 19610 2234 1 11 . 1 1 32 32 VAL H H 32 8.344 8.344 7.858 0.486 19610 2235 1 11 . 1 1 33 33 THR N N 33 118.041 118.041 119.773 -1.732 19610 2236 1 11 . 1 1 33 33 THR HA H 33 4.373 4.373 4.489 -0.116 19610 2237 1 11 . 1 1 33 33 THR C C 33 174.172 174.172 174.332 -0.160 19610 2238 1 11 . 1 1 33 33 THR CA C 33 61.407 61.407 61.405 0.002 19610 2239 1 11 . 1 1 33 33 THR CB C 33 69.891 69.891 68.414 1.477 19610 2240 1 11 . 1 1 33 33 THR H H 33 8.326 8.326 8.432 -0.106 19610 2241 1 11 . 1 1 34 34 ASN N N 34 121.367 121.367 117.663 3.704 19610 2242 1 11 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.489 0.220 19610 2243 1 11 . 1 1 34 34 ASN C C 34 175.639 175.639 175.356 0.283 19610 2244 1 11 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.968 -0.750 19610 2245 1 11 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.519 1.438 19610 2246 1 11 . 1 1 34 34 ASN H H 34 8.526 8.526 8.214 0.312 19610 2247 1 11 . 1 1 35 35 GLY N N 35 109.437 109.437 108.160 1.277 19610 2248 1 11 . 1 1 35 35 GLY C C 35 174.112 174.112 173.793 0.319 19610 2249 1 11 . 1 1 35 35 GLY CA C 35 45.370 45.370 44.999 0.371 19610 2250 1 11 . 1 1 35 35 GLY H H 35 8.449 8.449 8.379 0.070 19610 2251 1 11 . 1 1 36 36 LYS N N 36 120.614 120.614 121.329 -0.715 19610 2252 1 11 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.553 -0.250 19610 2253 1 11 . 1 1 36 36 LYS C C 36 177.182 177.182 177.082 0.100 19610 2254 1 11 . 1 1 36 36 LYS CA C 36 56.300 56.300 54.514 1.786 19610 2255 1 11 . 1 1 36 36 LYS CB C 36 32.895 32.895 35.756 -2.861 19610 2256 1 11 . 1 1 36 36 LYS H H 36 8.261 8.261 7.635 0.626 19610 2257 1 11 . 1 1 37 37 GLY N N 37 110.011 110.011 109.956 0.055 19610 2258 1 11 . 1 1 37 37 GLY C C 37 173.463 173.463 174.602 -1.139 19610 2259 1 11 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.031 0.091 19610 2260 1 11 . 1 1 37 37 GLY H H 37 8.484 8.484 8.799 -0.315 19610 2261 1 11 . 1 1 38 38 ARG N N 38 121.698 121.698 122.249 -0.551 19610 2262 1 11 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.547 0.072 19610 2263 1 11 . 1 1 38 38 ARG C C 38 173.448 173.448 175.055 -1.607 19610 2264 1 11 . 1 1 38 38 ARG CA C 38 53.702 53.702 56.889 -3.187 19610 2265 1 11 . 1 1 38 38 ARG CB C 38 30.121 30.121 28.726 1.395 19610 2266 1 11 . 1 1 38 38 ARG H H 38 8.105 8.105 7.988 0.117 19610 2267 1 12 . 1 1 2 2 SER HA H 2 4.472 4.472 4.712 -0.240 19610 2268 1 12 . 1 1 2 2 SER C C 2 174.628 174.628 174.706 -0.078 19610 2269 1 12 . 1 1 2 2 SER CA C 2 58.397 58.397 57.792 0.605 19610 2270 1 12 . 1 1 2 2 SER CB C 2 63.896 63.896 63.608 0.288 19610 2271 1 12 . 1 1 3 3 MET N N 3 122.147 122.147 120.424 1.723 19610 2272 1 12 . 1 1 3 3 MET HA H 3 4.490 4.490 4.617 -0.127 19610 2273 1 12 . 1 1 3 3 MET C C 3 175.934 175.934 175.006 0.928 19610 2274 1 12 . 1 1 3 3 MET CA C 3 55.552 55.552 53.514 2.038 19610 2275 1 12 . 1 1 3 3 MET CB C 3 32.645 32.645 29.659 2.986 19610 2276 1 12 . 1 1 3 3 MET H H 3 8.627 8.627 7.827 0.800 19610 2277 1 12 . 1 1 4 4 ASN N N 4 119.930 119.930 124.046 -4.116 19610 2278 1 12 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.758 -0.104 19610 2279 1 12 . 1 1 4 4 ASN C C 4 174.695 174.695 175.117 -0.422 19610 2280 1 12 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.347 -0.110 19610 2281 1 12 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.030 0.738 19610 2282 1 12 . 1 1 4 4 ASN H H 4 8.497 8.497 8.346 0.151 19610 2283 1 12 . 1 1 5 5 GLN N N 5 121.523 121.523 122.184 -0.661 19610 2284 1 12 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.606 -0.013 19610 2285 1 12 . 1 1 5 5 GLN C C 5 173.849 173.849 174.671 -0.822 19610 2286 1 12 . 1 1 5 5 GLN CA C 5 53.724 53.724 53.648 0.076 19610 2287 1 12 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.372 0.542 19610 2288 1 12 . 1 1 5 5 GLN H H 5 8.322 8.322 7.898 0.424 19610 2289 1 12 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.432 -0.054 19610 2290 1 12 . 1 1 6 6 PRO C C 6 176.816 176.816 176.284 0.532 19610 2291 1 12 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.733 0.425 19610 2292 1 12 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.031 0.055 19610 2293 1 12 . 1 1 7 7 GLN N N 7 121.005 121.005 121.352 -0.347 19610 2294 1 12 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.162 0.083 19610 2295 1 12 . 1 1 7 7 GLN C C 7 175.941 175.941 176.025 -0.084 19610 2296 1 12 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.995 -0.209 19610 2297 1 12 . 1 1 7 7 GLN CB C 7 29.495 29.495 28.983 0.512 19610 2298 1 12 . 1 1 7 7 GLN H H 7 8.576 8.576 8.268 0.308 19610 2299 1 12 . 1 1 8 8 ARG N N 8 122.928 122.928 122.481 0.447 19610 2300 1 12 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.255 0.032 19610 2301 1 12 . 1 1 8 8 ARG C C 8 176.061 176.061 176.750 -0.689 19610 2302 1 12 . 1 1 8 8 ARG CA C 8 55.996 55.996 55.656 0.340 19610 2303 1 12 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.825 -0.009 19610 2304 1 12 . 1 1 8 8 ARG H H 8 8.449 8.449 8.453 -0.004 19610 2305 1 12 . 1 1 9 9 MET N N 9 122.430 122.430 122.022 0.408 19610 2306 1 12 . 1 1 9 9 MET HA H 9 4.450 4.450 4.344 0.106 19610 2307 1 12 . 1 1 9 9 MET C C 9 175.469 175.469 176.492 -1.023 19610 2308 1 12 . 1 1 9 9 MET CA C 9 54.941 54.941 55.987 -1.046 19610 2309 1 12 . 1 1 9 9 MET CB C 9 33.058 33.058 31.707 1.351 19610 2310 1 12 . 1 1 9 9 MET H H 9 8.471 8.471 8.442 0.029 19610 2311 1 12 . 1 1 10 10 ALA N N 10 127.153 127.153 130.596 -3.443 19610 2312 1 12 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.508 0.033 19610 2313 1 12 . 1 1 10 10 ALA C C 10 175.353 175.353 176.790 -1.437 19610 2314 1 12 . 1 1 10 10 ALA CA C 10 50.487 50.487 51.279 -0.792 19610 2315 1 12 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.480 -0.449 19610 2316 1 12 . 1 1 10 10 ALA H H 10 8.398 8.398 8.487 -0.089 19610 2317 1 12 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.492 -0.054 19610 2318 1 12 . 1 1 11 11 PRO C C 11 176.896 176.896 176.858 0.038 19610 2319 1 12 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.222 -1.367 19610 2320 1 12 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.200 -0.179 19610 2321 1 12 . 1 1 12 12 VAL N N 12 120.652 120.652 117.807 2.845 19610 2322 1 12 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.263 -0.173 19610 2323 1 12 . 1 1 12 12 VAL C C 12 176.825 176.825 174.432 2.393 19610 2324 1 12 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.270 1.133 19610 2325 1 12 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.713 -1.812 19610 2326 1 12 . 1 1 12 12 VAL H H 12 8.373 8.373 7.552 0.821 19610 2327 1 12 . 1 1 13 13 GLY N N 13 112.483 112.483 113.306 -0.823 19610 2328 1 12 . 1 1 13 13 GLY C C 13 174.515 174.515 175.077 -0.562 19610 2329 1 12 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.517 -1.189 19610 2330 1 12 . 1 1 13 13 GLY H H 13 8.605 8.605 8.240 0.365 19610 2331 1 12 . 1 1 14 14 THR N N 14 113.531 113.531 115.909 -2.378 19610 2332 1 12 . 1 1 14 14 THR HA H 14 4.309 4.309 4.139 0.170 19610 2333 1 12 . 1 1 14 14 THR C C 14 174.742 174.742 175.614 -0.872 19610 2334 1 12 . 1 1 14 14 THR CA C 14 62.130 62.130 64.396 -2.266 19610 2335 1 12 . 1 1 14 14 THR CB C 14 69.981 69.981 69.045 0.936 19610 2336 1 12 . 1 1 14 14 THR H H 14 8.164 8.164 8.023 0.141 19610 2337 1 12 . 1 1 15 15 ASP N N 15 122.439 122.439 120.491 1.948 19610 2338 1 12 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.456 0.054 19610 2339 1 12 . 1 1 15 15 ASP C C 15 177.216 177.216 178.305 -1.089 19610 2340 1 12 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.361 -2.099 19610 2341 1 12 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.707 -0.014 19610 2342 1 12 . 1 1 15 15 ASP H H 15 8.537 8.537 8.614 -0.077 19610 2343 1 12 . 1 1 16 16 LYS N N 16 122.807 122.807 118.530 4.277 19610 2344 1 12 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.088 0.030 19610 2345 1 12 . 1 1 16 16 LYS C C 16 177.430 177.430 179.210 -1.780 19610 2346 1 12 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.640 -0.747 19610 2347 1 12 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.837 0.702 19610 2348 1 12 . 1 1 16 16 LYS H H 16 8.288 8.288 7.421 0.867 19610 2349 1 12 . 1 1 17 17 GLU N N 17 119.492 119.492 119.346 0.146 19610 2350 1 12 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.147 -0.035 19610 2351 1 12 . 1 1 17 17 GLU C C 17 178.007 178.007 179.000 -0.993 19610 2352 1 12 . 1 1 17 17 GLU CA C 17 58.252 58.252 58.996 -0.744 19610 2353 1 12 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.425 0.222 19610 2354 1 12 . 1 1 17 17 GLU H H 17 8.221 8.221 7.738 0.483 19610 2355 1 12 . 1 1 18 18 LEU N N 18 119.493 119.493 117.027 2.466 19610 2356 1 12 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.304 -0.157 19610 2357 1 12 . 1 1 18 18 LEU C C 18 178.359 178.359 179.255 -0.896 19610 2358 1 12 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.495 -1.073 19610 2359 1 12 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.152 0.608 19610 2360 1 12 . 1 1 18 18 LEU H H 18 7.998 7.998 7.914 0.084 19610 2361 1 12 . 1 1 19 19 SER N N 19 114.728 114.728 114.352 0.376 19610 2362 1 12 . 1 1 19 19 SER HA H 19 4.113 4.113 4.124 -0.011 19610 2363 1 12 . 1 1 19 19 SER C C 19 175.912 175.912 176.075 -0.163 19610 2364 1 12 . 1 1 19 19 SER CA C 19 60.881 60.881 61.659 -0.778 19610 2365 1 12 . 1 1 19 19 SER CB C 19 63.043 63.043 62.873 0.170 19610 2366 1 12 . 1 1 19 19 SER H H 19 8.068 8.068 7.898 0.170 19610 2367 1 12 . 1 1 20 20 ASP N N 20 121.206 121.206 121.827 -0.621 19610 2368 1 12 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.431 0.017 19610 2369 1 12 . 1 1 20 20 ASP C C 20 177.598 177.598 178.143 -0.545 19610 2370 1 12 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.752 -0.757 19610 2371 1 12 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.032 -0.493 19610 2372 1 12 . 1 1 20 20 ASP H H 20 8.301 8.301 7.417 0.884 19610 2373 1 12 . 1 1 21 21 LEU N N 21 119.944 119.944 119.768 0.176 19610 2374 1 12 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.447 -0.305 19610 2375 1 12 . 1 1 21 21 LEU C C 21 177.822 177.822 178.080 -0.258 19610 2376 1 12 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.889 0.550 19610 2377 1 12 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.393 0.859 19610 2378 1 12 . 1 1 21 21 LEU H H 21 7.807 7.807 8.084 -0.277 19610 2379 1 12 . 1 1 22 22 LEU N N 22 119.558 119.558 121.087 -1.529 19610 2380 1 12 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.935 0.141 19610 2381 1 12 . 1 1 22 22 LEU C C 22 177.131 177.131 177.813 -0.682 19610 2382 1 12 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.472 -2.417 19610 2383 1 12 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.660 0.184 19610 2384 1 12 . 1 1 22 22 LEU H H 22 7.878 7.878 7.570 0.308 19610 2385 1 12 . 1 1 23 23 ASP N N 23 119.509 119.509 119.232 0.277 19610 2386 1 12 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.210 0.254 19610 2387 1 12 . 1 1 23 23 ASP C C 23 177.379 177.379 178.300 -0.921 19610 2388 1 12 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.226 -2.299 19610 2389 1 12 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.289 0.450 19610 2390 1 12 . 1 1 23 23 ASP H H 23 7.990 7.990 7.692 0.298 19610 2391 1 12 . 1 1 24 24 PHE N N 24 121.219 121.219 116.787 4.432 19610 2392 1 12 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.365 0.101 19610 2393 1 12 . 1 1 24 24 PHE C C 24 176.875 176.875 177.793 -0.918 19610 2394 1 12 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.712 -0.484 19610 2395 1 12 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.436 0.571 19610 2396 1 12 . 1 1 24 24 PHE H H 24 8.204 8.204 7.187 1.017 19610 2397 1 12 . 1 1 25 25 SER N N 25 115.500 115.500 116.461 -0.961 19610 2398 1 12 . 1 1 25 25 SER HA H 25 4.108 4.108 4.750 -0.642 19610 2399 1 12 . 1 1 25 25 SER C C 25 175.386 175.386 176.252 -0.866 19610 2400 1 12 . 1 1 25 25 SER CA C 25 60.758 60.758 61.520 -0.762 19610 2401 1 12 . 1 1 25 25 SER CB C 25 62.998 62.998 63.246 -0.248 19610 2402 1 12 . 1 1 25 25 SER H H 25 8.326 8.326 7.868 0.458 19610 2403 1 12 . 1 1 26 26 MET N N 26 119.723 119.723 116.838 2.885 19610 2404 1 12 . 1 1 26 26 MET HA H 26 4.363 4.363 4.676 -0.313 19610 2405 1 12 . 1 1 26 26 MET C C 26 176.450 176.450 177.233 -0.783 19610 2406 1 12 . 1 1 26 26 MET CA C 26 55.949 55.949 56.454 -0.505 19610 2407 1 12 . 1 1 26 26 MET CB C 26 31.868 31.868 32.681 -0.813 19610 2408 1 12 . 1 1 26 26 MET H H 26 7.889 7.889 7.994 -0.105 19610 2409 1 12 . 1 1 27 27 MET N N 27 117.872 117.872 119.372 -1.500 19610 2410 1 12 . 1 1 27 27 MET HA H 27 4.186 4.186 4.406 -0.220 19610 2411 1 12 . 1 1 27 27 MET C C 27 175.341 175.341 176.475 -1.134 19610 2412 1 12 . 1 1 27 27 MET CA C 27 56.102 56.102 55.270 0.832 19610 2413 1 12 . 1 1 27 27 MET CB C 27 33.161 33.161 33.215 -0.054 19610 2414 1 12 . 1 1 27 27 MET H H 27 7.656 7.656 7.453 0.203 19610 2415 1 12 . 1 1 28 28 PHE N N 28 118.702 118.702 122.453 -3.751 19610 2416 1 12 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.404 0.400 19610 2417 1 12 . 1 1 28 28 PHE C C 28 173.132 173.132 175.321 -2.189 19610 2418 1 12 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.825 -3.030 19610 2419 1 12 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.488 0.241 19610 2420 1 12 . 1 1 28 28 PHE H H 28 7.682 7.682 7.817 -0.135 19610 2421 1 12 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.429 0.032 19610 2422 1 12 . 1 1 29 29 PRO C C 29 176.360 176.360 176.457 -0.097 19610 2423 1 12 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.203 -0.383 19610 2424 1 12 . 1 1 29 29 PRO CB C 29 31.581 31.581 32.232 -0.651 19610 2425 1 12 . 1 1 30 30 LEU N N 30 123.391 123.391 121.694 1.697 19610 2426 1 12 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.470 0.069 19610 2427 1 12 . 1 1 30 30 LEU C C 30 175.365 175.365 175.898 -0.533 19610 2428 1 12 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.652 -0.741 19610 2429 1 12 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.898 -0.224 19610 2430 1 12 . 1 1 30 30 LEU H H 30 8.284 8.284 7.737 0.547 19610 2431 1 12 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.406 0.032 19610 2432 1 12 . 1 1 31 31 PRO C C 31 176.688 176.688 176.242 0.446 19610 2433 1 12 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.719 0.161 19610 2434 1 12 . 1 1 31 31 PRO CB C 31 32.043 32.043 31.078 0.965 19610 2435 1 12 . 1 1 32 32 VAL N N 32 120.844 120.844 128.145 -7.301 19610 2436 1 12 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.058 0.082 19610 2437 1 12 . 1 1 32 32 VAL C C 32 176.579 176.579 176.000 0.579 19610 2438 1 12 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.105 0.137 19610 2439 1 12 . 1 1 32 32 VAL CB C 32 32.809 32.809 30.991 1.819 19610 2440 1 12 . 1 1 32 32 VAL H H 32 8.344 8.344 8.231 0.113 19610 2441 1 12 . 1 1 33 33 THR N N 33 118.041 118.041 119.652 -1.611 19610 2442 1 12 . 1 1 33 33 THR HA H 33 4.373 4.373 4.300 0.073 19610 2443 1 12 . 1 1 33 33 THR C C 33 174.172 174.172 175.047 -0.875 19610 2444 1 12 . 1 1 33 33 THR CA C 33 61.407 61.407 62.220 -0.813 19610 2445 1 12 . 1 1 33 33 THR CB C 33 69.891 69.891 68.234 1.657 19610 2446 1 12 . 1 1 33 33 THR H H 33 8.326 8.326 8.172 0.154 19610 2447 1 12 . 1 1 34 34 ASN N N 34 121.367 121.367 124.093 -2.726 19610 2448 1 12 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.649 0.060 19610 2449 1 12 . 1 1 34 34 ASN C C 34 175.639 175.639 176.807 -1.168 19610 2450 1 12 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.627 -0.409 19610 2451 1 12 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.749 0.207 19610 2452 1 12 . 1 1 34 34 ASN H H 34 8.526 8.526 8.105 0.421 19610 2453 1 12 . 1 1 35 35 GLY N N 35 109.437 109.437 109.981 -0.544 19610 2454 1 12 . 1 1 35 35 GLY C C 35 174.112 174.112 175.095 -0.983 19610 2455 1 12 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.842 -0.472 19610 2456 1 12 . 1 1 35 35 GLY H H 35 8.449 8.449 8.469 -0.020 19610 2457 1 12 . 1 1 36 36 LYS N N 36 120.614 120.614 126.748 -6.134 19610 2458 1 12 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.343 -0.040 19610 2459 1 12 . 1 1 36 36 LYS C C 36 177.182 177.182 176.578 0.604 19610 2460 1 12 . 1 1 36 36 LYS CA C 36 56.300 56.300 54.872 1.428 19610 2461 1 12 . 1 1 36 36 LYS CB C 36 32.895 32.895 31.347 1.548 19610 2462 1 12 . 1 1 36 36 LYS H H 36 8.261 8.261 7.989 0.272 19610 2463 1 12 . 1 1 37 37 GLY N N 37 110.011 110.011 111.823 -1.812 19610 2464 1 12 . 1 1 37 37 GLY C C 37 173.463 173.463 174.266 -0.803 19610 2465 1 12 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.159 -0.037 19610 2466 1 12 . 1 1 37 37 GLY H H 37 8.484 8.484 8.430 0.054 19610 2467 1 12 . 1 1 38 38 ARG N N 38 121.698 121.698 123.524 -1.826 19610 2468 1 12 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.587 0.032 19610 2469 1 12 . 1 1 38 38 ARG C C 38 173.448 173.448 174.331 -0.883 19610 2470 1 12 . 1 1 38 38 ARG CA C 38 53.702 53.702 53.742 -0.040 19610 2471 1 12 . 1 1 38 38 ARG CB C 38 30.121 30.121 31.258 -1.137 19610 2472 1 12 . 1 1 38 38 ARG H H 38 8.105 8.105 7.979 0.126 19610 2473 1 13 . 1 1 2 2 SER HA H 2 4.472 4.472 4.603 -0.131 19610 2474 1 13 . 1 1 2 2 SER C C 2 174.628 174.628 174.159 0.469 19610 2475 1 13 . 1 1 2 2 SER CA C 2 58.397 58.397 58.345 0.052 19610 2476 1 13 . 1 1 2 2 SER CB C 2 63.896 63.896 62.402 1.494 19610 2477 1 13 . 1 1 3 3 MET N N 3 122.147 122.147 124.590 -2.443 19610 2478 1 13 . 1 1 3 3 MET HA H 3 4.490 4.490 4.592 -0.102 19610 2479 1 13 . 1 1 3 3 MET C C 3 175.934 175.934 174.870 1.064 19610 2480 1 13 . 1 1 3 3 MET CA C 3 55.552 55.552 55.210 0.342 19610 2481 1 13 . 1 1 3 3 MET CB C 3 32.645 32.645 33.816 -1.171 19610 2482 1 13 . 1 1 3 3 MET H H 3 8.627 8.627 8.017 0.610 19610 2483 1 13 . 1 1 4 4 ASN N N 4 119.930 119.930 120.490 -0.560 19610 2484 1 13 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.483 0.171 19610 2485 1 13 . 1 1 4 4 ASN C C 4 174.695 174.695 174.034 0.661 19610 2486 1 13 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.609 -0.373 19610 2487 1 13 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.826 -0.058 19610 2488 1 13 . 1 1 4 4 ASN H H 4 8.497 8.497 8.632 -0.135 19610 2489 1 13 . 1 1 5 5 GLN N N 5 121.523 121.523 120.688 0.835 19610 2490 1 13 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.390 0.203 19610 2491 1 13 . 1 1 5 5 GLN C C 5 173.849 173.849 174.885 -1.036 19610 2492 1 13 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.776 -1.052 19610 2493 1 13 . 1 1 5 5 GLN CB C 5 28.914 28.914 29.030 -0.116 19610 2494 1 13 . 1 1 5 5 GLN H H 5 8.322 8.322 8.492 -0.170 19610 2495 1 13 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.410 -0.032 19610 2496 1 13 . 1 1 6 6 PRO C C 6 176.816 176.816 176.528 0.288 19610 2497 1 13 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.489 0.668 19610 2498 1 13 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.272 -0.186 19610 2499 1 13 . 1 1 7 7 GLN N N 7 121.005 121.005 118.093 2.912 19610 2500 1 13 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.278 -0.033 19610 2501 1 13 . 1 1 7 7 GLN C C 7 175.941 175.941 175.942 -0.001 19610 2502 1 13 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.542 0.243 19610 2503 1 13 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.236 0.259 19610 2504 1 13 . 1 1 7 7 GLN H H 7 8.576 8.576 8.319 0.257 19610 2505 1 13 . 1 1 8 8 ARG N N 8 122.928 122.928 120.976 1.952 19610 2506 1 13 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.289 -0.002 19610 2507 1 13 . 1 1 8 8 ARG C C 8 176.061 176.061 176.420 -0.359 19610 2508 1 13 . 1 1 8 8 ARG CA C 8 55.996 55.996 55.873 0.123 19610 2509 1 13 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.837 0.979 19610 2510 1 13 . 1 1 8 8 ARG H H 8 8.449 8.449 8.515 -0.066 19610 2511 1 13 . 1 1 9 9 MET N N 9 122.430 122.430 122.391 0.039 19610 2512 1 13 . 1 1 9 9 MET HA H 9 4.450 4.450 4.508 -0.058 19610 2513 1 13 . 1 1 9 9 MET C C 9 175.469 175.469 177.032 -1.563 19610 2514 1 13 . 1 1 9 9 MET CA C 9 54.941 54.941 55.215 -0.274 19610 2515 1 13 . 1 1 9 9 MET CB C 9 33.058 33.058 32.808 0.250 19610 2516 1 13 . 1 1 9 9 MET H H 9 8.471 8.471 8.172 0.299 19610 2517 1 13 . 1 1 10 10 ALA N N 10 127.153 127.153 127.158 -0.005 19610 2518 1 13 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.423 0.118 19610 2519 1 13 . 1 1 10 10 ALA C C 10 175.353 175.353 176.632 -1.279 19610 2520 1 13 . 1 1 10 10 ALA CA C 10 50.487 50.487 51.054 -0.567 19610 2521 1 13 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.817 -0.786 19610 2522 1 13 . 1 1 10 10 ALA H H 10 8.398 8.398 8.337 0.061 19610 2523 1 13 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.417 0.021 19610 2524 1 13 . 1 1 11 11 PRO C C 11 176.896 176.896 176.809 0.087 19610 2525 1 13 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.303 -1.448 19610 2526 1 13 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.346 -0.325 19610 2527 1 13 . 1 1 12 12 VAL N N 12 120.652 120.652 116.070 4.582 19610 2528 1 13 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.281 -0.191 19610 2529 1 13 . 1 1 12 12 VAL C C 12 176.825 176.825 175.704 1.121 19610 2530 1 13 . 1 1 12 12 VAL CA C 12 62.403 62.403 60.724 1.679 19610 2531 1 13 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.538 -0.637 19610 2532 1 13 . 1 1 12 12 VAL H H 12 8.373 8.373 7.421 0.952 19610 2533 1 13 . 1 1 13 13 GLY N N 13 112.483 112.483 111.150 1.333 19610 2534 1 13 . 1 1 13 13 GLY C C 13 174.515 174.515 175.327 -0.812 19610 2535 1 13 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.237 -0.909 19610 2536 1 13 . 1 1 13 13 GLY H H 13 8.605 8.605 8.435 0.170 19610 2537 1 13 . 1 1 14 14 THR N N 14 113.531 113.531 117.723 -4.192 19610 2538 1 13 . 1 1 14 14 THR HA H 14 4.309 4.309 4.458 -0.149 19610 2539 1 13 . 1 1 14 14 THR C C 14 174.742 174.742 175.321 -0.579 19610 2540 1 13 . 1 1 14 14 THR CA C 14 62.130 62.130 63.807 -1.677 19610 2541 1 13 . 1 1 14 14 THR CB C 14 69.981 69.981 68.705 1.276 19610 2542 1 13 . 1 1 14 14 THR H H 14 8.164 8.164 8.209 -0.045 19610 2543 1 13 . 1 1 15 15 ASP N N 15 122.439 122.439 120.795 1.644 19610 2544 1 13 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.401 0.109 19610 2545 1 13 . 1 1 15 15 ASP C C 15 177.216 177.216 178.280 -1.064 19610 2546 1 13 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.557 -2.295 19610 2547 1 13 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.704 -0.011 19610 2548 1 13 . 1 1 15 15 ASP H H 15 8.537 8.537 8.660 -0.123 19610 2549 1 13 . 1 1 16 16 LYS N N 16 122.807 122.807 118.168 4.639 19610 2550 1 13 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.091 0.027 19610 2551 1 13 . 1 1 16 16 LYS C C 16 177.430 177.430 179.072 -1.642 19610 2552 1 13 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.713 -0.820 19610 2553 1 13 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.935 0.604 19610 2554 1 13 . 1 1 16 16 LYS H H 16 8.288 8.288 7.387 0.901 19610 2555 1 13 . 1 1 17 17 GLU N N 17 119.492 119.492 119.631 -0.139 19610 2556 1 13 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.070 0.042 19610 2557 1 13 . 1 1 17 17 GLU C C 17 178.007 178.007 179.260 -1.253 19610 2558 1 13 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.310 -1.058 19610 2559 1 13 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.677 -0.030 19610 2560 1 13 . 1 1 17 17 GLU H H 17 8.221 8.221 7.508 0.713 19610 2561 1 13 . 1 1 18 18 LEU N N 18 119.493 119.493 116.493 3.000 19610 2562 1 13 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.215 -0.068 19610 2563 1 13 . 1 1 18 18 LEU C C 18 178.359 178.359 178.945 -0.586 19610 2564 1 13 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.933 -1.511 19610 2565 1 13 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.171 0.589 19610 2566 1 13 . 1 1 18 18 LEU H H 18 7.998 7.998 8.067 -0.069 19610 2567 1 13 . 1 1 19 19 SER N N 19 114.728 114.728 115.416 -0.688 19610 2568 1 13 . 1 1 19 19 SER HA H 19 4.113 4.113 4.087 0.026 19610 2569 1 13 . 1 1 19 19 SER C C 19 175.912 175.912 176.000 -0.088 19610 2570 1 13 . 1 1 19 19 SER CA C 19 60.881 60.881 61.560 -0.679 19610 2571 1 13 . 1 1 19 19 SER CB C 19 63.043 63.043 62.669 0.374 19610 2572 1 13 . 1 1 19 19 SER H H 19 8.068 8.068 7.654 0.414 19610 2573 1 13 . 1 1 20 20 ASP N N 20 121.206 121.206 122.429 -1.223 19610 2574 1 13 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.227 0.221 19610 2575 1 13 . 1 1 20 20 ASP C C 20 177.598 177.598 178.450 -0.852 19610 2576 1 13 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.266 -1.271 19610 2577 1 13 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.671 -0.132 19610 2578 1 13 . 1 1 20 20 ASP H H 20 8.301 8.301 8.026 0.275 19610 2579 1 13 . 1 1 21 21 LEU N N 21 119.944 119.944 118.887 1.057 19610 2580 1 13 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.518 -0.376 19610 2581 1 13 . 1 1 21 21 LEU C C 21 177.822 177.822 178.694 -0.872 19610 2582 1 13 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.742 0.697 19610 2583 1 13 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.124 1.128 19610 2584 1 13 . 1 1 21 21 LEU H H 21 7.807 7.807 8.150 -0.343 19610 2585 1 13 . 1 1 22 22 LEU N N 22 119.558 119.558 122.071 -2.513 19610 2586 1 13 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.043 0.033 19610 2587 1 13 . 1 1 22 22 LEU C C 22 177.131 177.131 177.888 -0.757 19610 2588 1 13 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.878 -1.823 19610 2589 1 13 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.656 0.188 19610 2590 1 13 . 1 1 22 22 LEU H H 22 7.878 7.878 7.843 0.035 19610 2591 1 13 . 1 1 23 23 ASP N N 23 119.509 119.509 120.027 -0.518 19610 2592 1 13 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.239 0.225 19610 2593 1 13 . 1 1 23 23 ASP C C 23 177.379 177.379 178.525 -1.146 19610 2594 1 13 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.482 -2.555 19610 2595 1 13 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.600 0.139 19610 2596 1 13 . 1 1 23 23 ASP H H 23 7.990 7.990 7.681 0.309 19610 2597 1 13 . 1 1 24 24 PHE N N 24 121.219 121.219 116.725 4.494 19610 2598 1 13 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.293 0.173 19610 2599 1 13 . 1 1 24 24 PHE C C 24 176.875 176.875 177.797 -0.922 19610 2600 1 13 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.551 -0.322 19610 2601 1 13 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.184 0.823 19610 2602 1 13 . 1 1 24 24 PHE H H 24 8.204 8.204 7.665 0.539 19610 2603 1 13 . 1 1 25 25 SER N N 25 115.500 115.500 116.220 -0.720 19610 2604 1 13 . 1 1 25 25 SER HA H 25 4.108 4.108 4.682 -0.574 19610 2605 1 13 . 1 1 25 25 SER C C 25 175.386 175.386 176.170 -0.784 19610 2606 1 13 . 1 1 25 25 SER CA C 25 60.758 60.758 61.693 -0.935 19610 2607 1 13 . 1 1 25 25 SER CB C 25 62.998 62.998 63.373 -0.375 19610 2608 1 13 . 1 1 25 25 SER H H 25 8.326 8.326 7.879 0.447 19610 2609 1 13 . 1 1 26 26 MET N N 26 119.723 119.723 117.722 2.001 19610 2610 1 13 . 1 1 26 26 MET HA H 26 4.363 4.363 4.561 -0.198 19610 2611 1 13 . 1 1 26 26 MET C C 26 176.450 176.450 177.399 -0.949 19610 2612 1 13 . 1 1 26 26 MET CA C 26 55.949 55.949 56.801 -0.852 19610 2613 1 13 . 1 1 26 26 MET CB C 26 31.868 31.868 32.643 -0.775 19610 2614 1 13 . 1 1 26 26 MET H H 26 7.889 7.889 7.880 0.009 19610 2615 1 13 . 1 1 27 27 MET N N 27 117.872 117.872 118.788 -0.916 19610 2616 1 13 . 1 1 27 27 MET HA H 27 4.186 4.186 4.322 -0.136 19610 2617 1 13 . 1 1 27 27 MET C C 27 175.341 175.341 176.857 -1.516 19610 2618 1 13 . 1 1 27 27 MET CA C 27 56.102 56.102 57.140 -1.038 19610 2619 1 13 . 1 1 27 27 MET CB C 27 33.161 33.161 33.349 -0.188 19610 2620 1 13 . 1 1 27 27 MET H H 27 7.656 7.656 7.397 0.259 19610 2621 1 13 . 1 1 28 28 PHE N N 28 118.702 118.702 121.324 -2.622 19610 2622 1 13 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.432 0.372 19610 2623 1 13 . 1 1 28 28 PHE C C 28 173.132 173.132 175.151 -2.019 19610 2624 1 13 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.275 -2.480 19610 2625 1 13 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.248 0.480 19610 2626 1 13 . 1 1 28 28 PHE H H 28 7.682 7.682 7.769 -0.087 19610 2627 1 13 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.439 0.022 19610 2628 1 13 . 1 1 29 29 PRO C C 29 176.360 176.360 176.374 -0.014 19610 2629 1 13 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.260 -0.440 19610 2630 1 13 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.884 -0.303 19610 2631 1 13 . 1 1 30 30 LEU N N 30 123.391 123.391 121.482 1.909 19610 2632 1 13 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.583 -0.044 19610 2633 1 13 . 1 1 30 30 LEU C C 30 175.365 175.365 176.111 -0.746 19610 2634 1 13 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.376 -0.465 19610 2635 1 13 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.855 -0.182 19610 2636 1 13 . 1 1 30 30 LEU H H 30 8.284 8.284 7.729 0.555 19610 2637 1 13 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.388 0.050 19610 2638 1 13 . 1 1 31 31 PRO C C 31 176.688 176.688 175.754 0.934 19610 2639 1 13 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.641 0.239 19610 2640 1 13 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.292 1.751 19610 2641 1 13 . 1 1 32 32 VAL N N 32 120.844 120.844 124.756 -3.912 19610 2642 1 13 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.088 0.052 19610 2643 1 13 . 1 1 32 32 VAL C C 32 176.579 176.579 175.857 0.722 19610 2644 1 13 . 1 1 32 32 VAL CA C 32 62.241 62.241 61.698 0.543 19610 2645 1 13 . 1 1 32 32 VAL CB C 32 32.809 32.809 32.329 0.480 19610 2646 1 13 . 1 1 32 32 VAL H H 32 8.344 8.344 8.011 0.333 19610 2647 1 13 . 1 1 33 33 THR N N 33 118.041 118.041 122.231 -4.190 19610 2648 1 13 . 1 1 33 33 THR HA H 33 4.373 4.373 4.398 -0.025 19610 2649 1 13 . 1 1 33 33 THR C C 33 174.172 174.172 174.709 -0.537 19610 2650 1 13 . 1 1 33 33 THR CA C 33 61.407 61.407 61.525 -0.117 19610 2651 1 13 . 1 1 33 33 THR CB C 33 69.891 69.891 67.695 2.196 19610 2652 1 13 . 1 1 33 33 THR H H 33 8.326 8.326 8.416 -0.090 19610 2653 1 13 . 1 1 34 34 ASN N N 34 121.367 121.367 118.588 2.779 19610 2654 1 13 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.372 0.337 19610 2655 1 13 . 1 1 34 34 ASN C C 34 175.639 175.639 175.907 -0.268 19610 2656 1 13 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.851 -0.633 19610 2657 1 13 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.655 1.302 19610 2658 1 13 . 1 1 34 34 ASN H H 34 8.526 8.526 8.393 0.133 19610 2659 1 13 . 1 1 35 35 GLY N N 35 109.437 109.437 107.043 2.394 19610 2660 1 13 . 1 1 35 35 GLY C C 35 174.112 174.112 174.225 -0.113 19610 2661 1 13 . 1 1 35 35 GLY CA C 35 45.370 45.370 46.327 -0.957 19610 2662 1 13 . 1 1 35 35 GLY H H 35 8.449 8.449 8.340 0.109 19610 2663 1 13 . 1 1 36 36 LYS N N 36 120.614 120.614 121.469 -0.855 19610 2664 1 13 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.413 -0.110 19610 2665 1 13 . 1 1 36 36 LYS C C 36 177.182 177.182 175.321 1.861 19610 2666 1 13 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.471 -0.171 19610 2667 1 13 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.664 0.231 19610 2668 1 13 . 1 1 36 36 LYS H H 36 8.261 8.261 7.941 0.320 19610 2669 1 13 . 1 1 37 37 GLY N N 37 110.011 110.011 112.950 -2.939 19610 2670 1 13 . 1 1 37 37 GLY C C 37 173.463 173.463 175.094 -1.631 19610 2671 1 13 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.589 -0.467 19610 2672 1 13 . 1 1 37 37 GLY H H 37 8.484 8.484 8.846 -0.362 19610 2673 1 13 . 1 1 38 38 ARG N N 38 121.698 121.698 120.817 0.881 19610 2674 1 13 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.267 0.352 19610 2675 1 13 . 1 1 38 38 ARG C C 38 173.448 173.448 175.510 -2.062 19610 2676 1 13 . 1 1 38 38 ARG CA C 38 53.702 53.702 57.401 -3.699 19610 2677 1 13 . 1 1 38 38 ARG CB C 38 30.121 30.121 28.870 1.250 19610 2678 1 13 . 1 1 38 38 ARG H H 38 8.105 8.105 8.681 -0.576 19610 2679 1 14 . 1 1 2 2 SER HA H 2 4.472 4.472 4.416 0.056 19610 2680 1 14 . 1 1 2 2 SER C C 2 174.628 174.628 175.605 -0.977 19610 2681 1 14 . 1 1 2 2 SER CA C 2 58.397 58.397 59.563 -1.166 19610 2682 1 14 . 1 1 2 2 SER CB C 2 63.896 63.896 63.641 0.255 19610 2683 1 14 . 1 1 3 3 MET N N 3 122.147 122.147 122.768 -0.621 19610 2684 1 14 . 1 1 3 3 MET HA H 3 4.490 4.490 4.492 -0.002 19610 2685 1 14 . 1 1 3 3 MET C C 3 175.934 175.934 174.706 1.228 19610 2686 1 14 . 1 1 3 3 MET CA C 3 55.552 55.552 54.860 0.692 19610 2687 1 14 . 1 1 3 3 MET CB C 3 32.645 32.645 32.693 -0.048 19610 2688 1 14 . 1 1 3 3 MET H H 3 8.627 8.627 7.746 0.881 19610 2689 1 14 . 1 1 4 4 ASN N N 4 119.930 119.930 124.458 -4.528 19610 2690 1 14 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.879 -0.225 19610 2691 1 14 . 1 1 4 4 ASN C C 4 174.695 174.695 174.571 0.124 19610 2692 1 14 . 1 1 4 4 ASN CA C 4 53.237 53.237 52.962 0.275 19610 2693 1 14 . 1 1 4 4 ASN CB C 4 38.768 38.768 39.565 -0.797 19610 2694 1 14 . 1 1 4 4 ASN H H 4 8.497 8.497 8.548 -0.051 19610 2695 1 14 . 1 1 5 5 GLN N N 5 121.523 121.523 124.821 -3.298 19610 2696 1 14 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.604 -0.011 19610 2697 1 14 . 1 1 5 5 GLN C C 5 173.849 173.849 174.132 -0.283 19610 2698 1 14 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.059 -0.335 19610 2699 1 14 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.354 0.560 19610 2700 1 14 . 1 1 5 5 GLN H H 5 8.322 8.322 8.419 -0.097 19610 2701 1 14 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.358 0.020 19610 2702 1 14 . 1 1 6 6 PRO C C 6 176.816 176.816 176.586 0.230 19610 2703 1 14 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.699 0.458 19610 2704 1 14 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.270 -0.184 19610 2705 1 14 . 1 1 7 7 GLN N N 7 121.005 121.005 118.423 2.582 19610 2706 1 14 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.121 0.124 19610 2707 1 14 . 1 1 7 7 GLN C C 7 175.941 175.941 176.109 -0.168 19610 2708 1 14 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.589 0.196 19610 2709 1 14 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.189 0.306 19610 2710 1 14 . 1 1 7 7 GLN H H 7 8.576 8.576 8.256 0.320 19610 2711 1 14 . 1 1 8 8 ARG N N 8 122.928 122.928 121.082 1.846 19610 2712 1 14 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.140 0.147 19610 2713 1 14 . 1 1 8 8 ARG C C 8 176.061 176.061 176.713 -0.652 19610 2714 1 14 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.664 -0.668 19610 2715 1 14 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.428 0.388 19610 2716 1 14 . 1 1 8 8 ARG H H 8 8.449 8.449 8.547 -0.098 19610 2717 1 14 . 1 1 9 9 MET N N 9 122.430 122.430 122.008 0.422 19610 2718 1 14 . 1 1 9 9 MET HA H 9 4.450 4.450 4.467 -0.017 19610 2719 1 14 . 1 1 9 9 MET C C 9 175.469 175.469 176.044 -0.575 19610 2720 1 14 . 1 1 9 9 MET CA C 9 54.941 54.941 56.268 -1.327 19610 2721 1 14 . 1 1 9 9 MET CB C 9 33.058 33.058 32.673 0.385 19610 2722 1 14 . 1 1 9 9 MET H H 9 8.471 8.471 8.115 0.356 19610 2723 1 14 . 1 1 10 10 ALA N N 10 127.153 127.153 128.952 -1.799 19610 2724 1 14 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.476 0.065 19610 2725 1 14 . 1 1 10 10 ALA C C 10 175.353 175.353 176.291 -0.938 19610 2726 1 14 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.803 -0.316 19610 2727 1 14 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.530 -0.499 19610 2728 1 14 . 1 1 10 10 ALA H H 10 8.398 8.398 8.281 0.117 19610 2729 1 14 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.420 0.018 19610 2730 1 14 . 1 1 11 11 PRO C C 11 176.896 176.896 177.024 -0.128 19610 2731 1 14 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.465 -0.610 19610 2732 1 14 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.404 -0.383 19610 2733 1 14 . 1 1 12 12 VAL N N 12 120.652 120.652 117.040 3.612 19610 2734 1 14 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.177 -0.087 19610 2735 1 14 . 1 1 12 12 VAL C C 12 176.825 176.825 175.783 1.042 19610 2736 1 14 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.723 0.680 19610 2737 1 14 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.833 -0.932 19610 2738 1 14 . 1 1 12 12 VAL H H 12 8.373 8.373 7.561 0.812 19610 2739 1 14 . 1 1 13 13 GLY N N 13 112.483 112.483 115.477 -2.994 19610 2740 1 14 . 1 1 13 13 GLY C C 13 174.515 174.515 175.049 -0.534 19610 2741 1 14 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.605 -0.277 19610 2742 1 14 . 1 1 13 13 GLY H H 13 8.605 8.605 8.447 0.158 19610 2743 1 14 . 1 1 14 14 THR N N 14 113.531 113.531 116.734 -3.203 19610 2744 1 14 . 1 1 14 14 THR HA H 14 4.309 4.309 4.047 0.262 19610 2745 1 14 . 1 1 14 14 THR C C 14 174.742 174.742 175.301 -0.559 19610 2746 1 14 . 1 1 14 14 THR CA C 14 62.130 62.130 65.334 -3.204 19610 2747 1 14 . 1 1 14 14 THR CB C 14 69.981 69.981 68.697 1.284 19610 2748 1 14 . 1 1 14 14 THR H H 14 8.164 8.164 8.384 -0.220 19610 2749 1 14 . 1 1 15 15 ASP N N 15 122.439 122.439 119.814 2.625 19610 2750 1 14 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.456 0.054 19610 2751 1 14 . 1 1 15 15 ASP C C 15 177.216 177.216 178.325 -1.109 19610 2752 1 14 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.392 -2.130 19610 2753 1 14 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.792 -0.099 19610 2754 1 14 . 1 1 15 15 ASP H H 15 8.537 8.537 8.669 -0.132 19610 2755 1 14 . 1 1 16 16 LYS N N 16 122.807 122.807 118.387 4.420 19610 2756 1 14 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.218 -0.100 19610 2757 1 14 . 1 1 16 16 LYS C C 16 177.430 177.430 179.139 -1.709 19610 2758 1 14 . 1 1 16 16 LYS CA C 16 57.893 57.893 57.908 -0.015 19610 2759 1 14 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.993 0.546 19610 2760 1 14 . 1 1 16 16 LYS H H 16 8.288 8.288 7.599 0.689 19610 2761 1 14 . 1 1 17 17 GLU N N 17 119.492 119.492 120.141 -0.649 19610 2762 1 14 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.171 -0.059 19610 2763 1 14 . 1 1 17 17 GLU C C 17 178.007 178.007 178.960 -0.953 19610 2764 1 14 . 1 1 17 17 GLU CA C 17 58.252 58.252 58.878 -0.626 19610 2765 1 14 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.372 0.275 19610 2766 1 14 . 1 1 17 17 GLU H H 17 8.221 8.221 7.814 0.407 19610 2767 1 14 . 1 1 18 18 LEU N N 18 119.493 119.493 117.230 2.263 19610 2768 1 14 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.287 -0.140 19610 2769 1 14 . 1 1 18 18 LEU C C 18 178.359 178.359 179.302 -0.943 19610 2770 1 14 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.715 -1.293 19610 2771 1 14 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.075 0.684 19610 2772 1 14 . 1 1 18 18 LEU H H 18 7.998 7.998 7.889 0.109 19610 2773 1 14 . 1 1 19 19 SER N N 19 114.728 114.728 114.944 -0.216 19610 2774 1 14 . 1 1 19 19 SER HA H 19 4.113 4.113 4.121 -0.008 19610 2775 1 14 . 1 1 19 19 SER C C 19 175.912 175.912 176.673 -0.761 19610 2776 1 14 . 1 1 19 19 SER CA C 19 60.881 60.881 61.741 -0.860 19610 2777 1 14 . 1 1 19 19 SER CB C 19 63.043 63.043 62.618 0.425 19610 2778 1 14 . 1 1 19 19 SER H H 19 8.068 8.068 8.000 0.068 19610 2779 1 14 . 1 1 20 20 ASP N N 20 121.206 121.206 121.455 -0.249 19610 2780 1 14 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.458 -0.010 19610 2781 1 14 . 1 1 20 20 ASP C C 20 177.598 177.598 178.319 -0.721 19610 2782 1 14 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.550 -0.555 19610 2783 1 14 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.069 -0.530 19610 2784 1 14 . 1 1 20 20 ASP H H 20 8.301 8.301 7.537 0.764 19610 2785 1 14 . 1 1 21 21 LEU N N 21 119.944 119.944 119.243 0.701 19610 2786 1 14 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.556 -0.414 19610 2787 1 14 . 1 1 21 21 LEU C C 21 177.822 177.822 178.204 -0.382 19610 2788 1 14 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.932 0.506 19610 2789 1 14 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.360 0.892 19610 2790 1 14 . 1 1 21 21 LEU H H 21 7.807 7.807 7.990 -0.183 19610 2791 1 14 . 1 1 22 22 LEU N N 22 119.558 119.558 121.715 -2.157 19610 2792 1 14 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.034 0.042 19610 2793 1 14 . 1 1 22 22 LEU C C 22 177.131 177.131 178.087 -0.956 19610 2794 1 14 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.931 -1.875 19610 2795 1 14 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.611 0.233 19610 2796 1 14 . 1 1 22 22 LEU H H 22 7.878 7.878 7.722 0.156 19610 2797 1 14 . 1 1 23 23 ASP N N 23 119.509 119.509 119.664 -0.155 19610 2798 1 14 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.222 0.242 19610 2799 1 14 . 1 1 23 23 ASP C C 23 177.379 177.379 178.501 -1.122 19610 2800 1 14 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.488 -2.561 19610 2801 1 14 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.549 0.190 19610 2802 1 14 . 1 1 23 23 ASP H H 23 7.990 7.990 7.580 0.410 19610 2803 1 14 . 1 1 24 24 PHE N N 24 121.219 121.219 117.543 3.676 19610 2804 1 14 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.222 0.244 19610 2805 1 14 . 1 1 24 24 PHE C C 24 176.875 176.875 177.698 -0.823 19610 2806 1 14 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.898 -0.669 19610 2807 1 14 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.287 0.720 19610 2808 1 14 . 1 1 24 24 PHE H H 24 8.204 8.204 7.355 0.849 19610 2809 1 14 . 1 1 25 25 SER N N 25 115.500 115.500 116.008 -0.508 19610 2810 1 14 . 1 1 25 25 SER HA H 25 4.108 4.108 4.676 -0.568 19610 2811 1 14 . 1 1 25 25 SER C C 25 175.386 175.386 176.099 -0.713 19610 2812 1 14 . 1 1 25 25 SER CA C 25 60.758 60.758 61.427 -0.669 19610 2813 1 14 . 1 1 25 25 SER CB C 25 62.998 62.998 63.473 -0.475 19610 2814 1 14 . 1 1 25 25 SER H H 25 8.326 8.326 7.977 0.349 19610 2815 1 14 . 1 1 26 26 MET N N 26 119.723 119.723 116.127 3.596 19610 2816 1 14 . 1 1 26 26 MET HA H 26 4.363 4.363 4.704 -0.341 19610 2817 1 14 . 1 1 26 26 MET C C 26 176.450 176.450 177.359 -0.909 19610 2818 1 14 . 1 1 26 26 MET CA C 26 55.949 55.949 56.254 -0.305 19610 2819 1 14 . 1 1 26 26 MET CB C 26 31.868 31.868 32.972 -1.104 19610 2820 1 14 . 1 1 26 26 MET H H 26 7.889 7.889 7.829 0.060 19610 2821 1 14 . 1 1 27 27 MET N N 27 117.872 117.872 119.045 -1.173 19610 2822 1 14 . 1 1 27 27 MET HA H 27 4.186 4.186 4.326 -0.140 19610 2823 1 14 . 1 1 27 27 MET C C 27 175.341 175.341 176.820 -1.479 19610 2824 1 14 . 1 1 27 27 MET CA C 27 56.102 56.102 57.197 -1.095 19610 2825 1 14 . 1 1 27 27 MET CB C 27 33.161 33.161 33.413 -0.253 19610 2826 1 14 . 1 1 27 27 MET H H 27 7.656 7.656 7.423 0.233 19610 2827 1 14 . 1 1 28 28 PHE N N 28 118.702 118.702 121.702 -3.000 19610 2828 1 14 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.431 0.373 19610 2829 1 14 . 1 1 28 28 PHE C C 28 173.132 173.132 175.187 -2.055 19610 2830 1 14 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.154 -2.360 19610 2831 1 14 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.150 0.579 19610 2832 1 14 . 1 1 28 28 PHE H H 28 7.682 7.682 7.766 -0.084 19610 2833 1 14 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.332 0.129 19610 2834 1 14 . 1 1 29 29 PRO C C 29 176.360 176.360 176.660 -0.300 19610 2835 1 14 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.540 -0.720 19610 2836 1 14 . 1 1 29 29 PRO CB C 29 31.581 31.581 32.021 -0.440 19610 2837 1 14 . 1 1 30 30 LEU N N 30 123.391 123.391 120.734 2.657 19610 2838 1 14 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.477 0.062 19610 2839 1 14 . 1 1 30 30 LEU C C 30 175.365 175.365 176.133 -0.768 19610 2840 1 14 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.731 -0.820 19610 2841 1 14 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.824 -0.151 19610 2842 1 14 . 1 1 30 30 LEU H H 30 8.284 8.284 7.750 0.534 19610 2843 1 14 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.422 0.016 19610 2844 1 14 . 1 1 31 31 PRO C C 31 176.688 176.688 175.770 0.918 19610 2845 1 14 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.610 0.270 19610 2846 1 14 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.319 1.724 19610 2847 1 14 . 1 1 32 32 VAL N N 32 120.844 120.844 125.962 -5.118 19610 2848 1 14 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.981 0.159 19610 2849 1 14 . 1 1 32 32 VAL C C 32 176.579 176.579 176.657 -0.078 19610 2850 1 14 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.697 -0.455 19610 2851 1 14 . 1 1 32 32 VAL CB C 32 32.809 32.809 31.183 1.626 19610 2852 1 14 . 1 1 32 32 VAL H H 32 8.344 8.344 7.908 0.436 19610 2853 1 14 . 1 1 33 33 THR N N 33 118.041 118.041 119.443 -1.402 19610 2854 1 14 . 1 1 33 33 THR HA H 33 4.373 4.373 4.382 -0.009 19610 2855 1 14 . 1 1 33 33 THR C C 33 174.172 174.172 175.467 -1.295 19610 2856 1 14 . 1 1 33 33 THR CA C 33 61.407 61.407 62.008 -0.601 19610 2857 1 14 . 1 1 33 33 THR CB C 33 69.891 69.891 68.930 0.961 19610 2858 1 14 . 1 1 33 33 THR H H 33 8.326 8.326 8.448 -0.122 19610 2859 1 14 . 1 1 34 34 ASN N N 34 121.367 121.367 118.516 2.851 19610 2860 1 14 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.393 0.316 19610 2861 1 14 . 1 1 34 34 ASN C C 34 175.639 175.639 175.848 -0.209 19610 2862 1 14 . 1 1 34 34 ASN CA C 34 53.218 53.218 55.547 -2.329 19610 2863 1 14 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.004 1.953 19610 2864 1 14 . 1 1 34 34 ASN H H 34 8.526 8.526 8.297 0.229 19610 2865 1 14 . 1 1 35 35 GLY N N 35 109.437 109.437 111.466 -2.029 19610 2866 1 14 . 1 1 35 35 GLY C C 35 174.112 174.112 174.266 -0.154 19610 2867 1 14 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.398 -0.028 19610 2868 1 14 . 1 1 35 35 GLY H H 35 8.449 8.449 8.345 0.104 19610 2869 1 14 . 1 1 36 36 LYS N N 36 120.614 120.614 117.891 2.723 19610 2870 1 14 . 1 1 36 36 LYS HA H 36 4.303 4.303 3.968 0.335 19610 2871 1 14 . 1 1 36 36 LYS C C 36 177.182 177.182 175.611 1.571 19610 2872 1 14 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.397 -0.097 19610 2873 1 14 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.763 0.132 19610 2874 1 14 . 1 1 36 36 LYS H H 36 8.261 8.261 8.099 0.162 19610 2875 1 14 . 1 1 37 37 GLY N N 37 110.011 110.011 107.923 2.088 19610 2876 1 14 . 1 1 37 37 GLY C C 37 173.463 173.463 172.737 0.726 19610 2877 1 14 . 1 1 37 37 GLY CA C 37 45.122 45.122 44.683 0.439 19610 2878 1 14 . 1 1 37 37 GLY H H 37 8.484 8.484 8.287 0.197 19610 2879 1 14 . 1 1 38 38 ARG N N 38 121.698 121.698 120.383 1.315 19610 2880 1 14 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.648 -0.029 19610 2881 1 14 . 1 1 38 38 ARG C C 38 173.448 173.448 173.532 -0.084 19610 2882 1 14 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.354 -0.652 19610 2883 1 14 . 1 1 38 38 ARG CB C 38 30.121 30.121 30.618 -0.497 19610 2884 1 14 . 1 1 38 38 ARG H H 38 8.105 8.105 7.989 0.116 19610 2885 1 15 . 1 1 2 2 SER HA H 2 4.472 4.472 4.432 0.040 19610 2886 1 15 . 1 1 2 2 SER C C 2 174.628 174.628 174.445 0.183 19610 2887 1 15 . 1 1 2 2 SER CA C 2 58.397 58.397 58.972 -0.575 19610 2888 1 15 . 1 1 2 2 SER CB C 2 63.896 63.896 63.622 0.274 19610 2889 1 15 . 1 1 3 3 MET N N 3 122.147 122.147 126.193 -4.046 19610 2890 1 15 . 1 1 3 3 MET HA H 3 4.490 4.490 4.589 -0.099 19610 2891 1 15 . 1 1 3 3 MET C C 3 175.934 175.934 175.144 0.790 19610 2892 1 15 . 1 1 3 3 MET CA C 3 55.552 55.552 55.111 0.441 19610 2893 1 15 . 1 1 3 3 MET CB C 3 32.645 32.645 32.856 -0.211 19610 2894 1 15 . 1 1 3 3 MET H H 3 8.627 8.627 8.533 0.094 19610 2895 1 15 . 1 1 4 4 ASN N N 4 119.930 119.930 120.472 -0.542 19610 2896 1 15 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.945 -0.291 19610 2897 1 15 . 1 1 4 4 ASN C C 4 174.695 174.695 174.466 0.229 19610 2898 1 15 . 1 1 4 4 ASN CA C 4 53.237 53.237 52.972 0.265 19610 2899 1 15 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.304 0.464 19610 2900 1 15 . 1 1 4 4 ASN H H 4 8.497 8.497 8.624 -0.127 19610 2901 1 15 . 1 1 5 5 GLN N N 5 121.523 121.523 122.176 -0.653 19610 2902 1 15 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.648 -0.055 19610 2903 1 15 . 1 1 5 5 GLN C C 5 173.849 173.849 174.123 -0.274 19610 2904 1 15 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.013 -0.289 19610 2905 1 15 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.451 0.463 19610 2906 1 15 . 1 1 5 5 GLN H H 5 8.322 8.322 8.297 0.025 19610 2907 1 15 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.332 0.046 19610 2908 1 15 . 1 1 6 6 PRO C C 6 176.816 176.816 176.581 0.235 19610 2909 1 15 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.742 0.415 19610 2910 1 15 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.178 -0.093 19610 2911 1 15 . 1 1 7 7 GLN N N 7 121.005 121.005 119.725 1.280 19610 2912 1 15 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.167 0.078 19610 2913 1 15 . 1 1 7 7 GLN C C 7 175.941 175.941 176.168 -0.227 19610 2914 1 15 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.633 0.152 19610 2915 1 15 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.316 0.179 19610 2916 1 15 . 1 1 7 7 GLN H H 7 8.576 8.576 8.232 0.344 19610 2917 1 15 . 1 1 8 8 ARG N N 8 122.928 122.928 121.486 1.442 19610 2918 1 15 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.339 -0.052 19610 2919 1 15 . 1 1 8 8 ARG C C 8 176.061 176.061 176.155 -0.094 19610 2920 1 15 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.413 -0.417 19610 2921 1 15 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.332 1.484 19610 2922 1 15 . 1 1 8 8 ARG H H 8 8.449 8.449 8.528 -0.079 19610 2923 1 15 . 1 1 9 9 MET N N 9 122.430 122.430 121.933 0.497 19610 2924 1 15 . 1 1 9 9 MET HA H 9 4.450 4.450 4.952 -0.502 19610 2925 1 15 . 1 1 9 9 MET C C 9 175.469 175.469 175.788 -0.319 19610 2926 1 15 . 1 1 9 9 MET CA C 9 54.941 54.941 54.420 0.521 19610 2927 1 15 . 1 1 9 9 MET CB C 9 33.058 33.058 34.490 -1.432 19610 2928 1 15 . 1 1 9 9 MET H H 9 8.471 8.471 8.382 0.089 19610 2929 1 15 . 1 1 10 10 ALA N N 10 127.153 127.153 124.658 2.495 19610 2930 1 15 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.586 -0.045 19610 2931 1 15 . 1 1 10 10 ALA C C 10 175.353 175.353 176.541 -1.188 19610 2932 1 15 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.515 -0.028 19610 2933 1 15 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.634 -0.603 19610 2934 1 15 . 1 1 10 10 ALA H H 10 8.398 8.398 8.456 -0.058 19610 2935 1 15 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.397 0.041 19610 2936 1 15 . 1 1 11 11 PRO C C 11 176.896 176.896 176.747 0.149 19610 2937 1 15 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.131 -1.276 19610 2938 1 15 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.501 -0.480 19610 2939 1 15 . 1 1 12 12 VAL N N 12 120.652 120.652 116.081 4.571 19610 2940 1 15 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.217 -0.127 19610 2941 1 15 . 1 1 12 12 VAL C C 12 176.825 176.825 173.812 3.013 19610 2942 1 15 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.400 1.003 19610 2943 1 15 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.203 -1.302 19610 2944 1 15 . 1 1 12 12 VAL H H 12 8.373 8.373 7.395 0.978 19610 2945 1 15 . 1 1 13 13 GLY N N 13 112.483 112.483 112.380 0.103 19610 2946 1 15 . 1 1 13 13 GLY C C 13 174.515 174.515 174.881 -0.366 19610 2947 1 15 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.829 -0.501 19610 2948 1 15 . 1 1 13 13 GLY H H 13 8.605 8.605 8.386 0.218 19610 2949 1 15 . 1 1 14 14 THR N N 14 113.531 113.531 117.557 -4.026 19610 2950 1 15 . 1 1 14 14 THR HA H 14 4.309 4.309 4.457 -0.148 19610 2951 1 15 . 1 1 14 14 THR C C 14 174.742 174.742 175.535 -0.793 19610 2952 1 15 . 1 1 14 14 THR CA C 14 62.130 62.130 63.742 -1.612 19610 2953 1 15 . 1 1 14 14 THR CB C 14 69.981 69.981 68.507 1.474 19610 2954 1 15 . 1 1 14 14 THR H H 14 8.164 8.164 8.138 0.026 19610 2955 1 15 . 1 1 15 15 ASP N N 15 122.439 122.439 120.995 1.444 19610 2956 1 15 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.393 0.117 19610 2957 1 15 . 1 1 15 15 ASP C C 15 177.216 177.216 178.151 -0.935 19610 2958 1 15 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.897 -2.635 19610 2959 1 15 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.855 -0.162 19610 2960 1 15 . 1 1 15 15 ASP H H 15 8.537 8.537 8.618 -0.081 19610 2961 1 15 . 1 1 16 16 LYS N N 16 122.807 122.807 117.701 5.106 19610 2962 1 15 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.099 0.019 19610 2963 1 15 . 1 1 16 16 LYS C C 16 177.430 177.430 179.292 -1.862 19610 2964 1 15 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.642 -0.749 19610 2965 1 15 . 1 1 16 16 LYS CB C 16 32.539 32.539 32.055 0.484 19610 2966 1 15 . 1 1 16 16 LYS H H 16 8.288 8.288 7.702 0.586 19610 2967 1 15 . 1 1 17 17 GLU N N 17 119.492 119.492 119.386 0.106 19610 2968 1 15 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.183 -0.071 19610 2969 1 15 . 1 1 17 17 GLU C C 17 178.007 178.007 178.891 -0.884 19610 2970 1 15 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.160 -0.908 19610 2971 1 15 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.697 -0.050 19610 2972 1 15 . 1 1 17 17 GLU H H 17 8.221 8.221 7.440 0.781 19610 2973 1 15 . 1 1 18 18 LEU N N 18 119.493 119.493 118.041 1.452 19610 2974 1 15 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.253 -0.106 19610 2975 1 15 . 1 1 18 18 LEU C C 18 178.359 178.359 179.143 -0.784 19610 2976 1 15 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.770 -1.348 19610 2977 1 15 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.282 0.478 19610 2978 1 15 . 1 1 18 18 LEU H H 18 7.998 7.998 7.981 0.017 19610 2979 1 15 . 1 1 19 19 SER N N 19 114.728 114.728 114.125 0.603 19610 2980 1 15 . 1 1 19 19 SER HA H 19 4.113 4.113 4.135 -0.022 19610 2981 1 15 . 1 1 19 19 SER C C 19 175.912 175.912 176.206 -0.294 19610 2982 1 15 . 1 1 19 19 SER CA C 19 60.881 60.881 61.607 -0.726 19610 2983 1 15 . 1 1 19 19 SER CB C 19 63.043 63.043 62.936 0.107 19610 2984 1 15 . 1 1 19 19 SER H H 19 8.068 8.068 8.276 -0.208 19610 2985 1 15 . 1 1 20 20 ASP N N 20 121.206 121.206 121.759 -0.553 19610 2986 1 15 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.468 -0.020 19610 2987 1 15 . 1 1 20 20 ASP C C 20 177.598 177.598 178.187 -0.589 19610 2988 1 15 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.605 -0.610 19610 2989 1 15 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.141 -0.602 19610 2990 1 15 . 1 1 20 20 ASP H H 20 8.301 8.301 7.523 0.778 19610 2991 1 15 . 1 1 21 21 LEU N N 21 119.944 119.944 119.461 0.483 19610 2992 1 15 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.605 -0.463 19610 2993 1 15 . 1 1 21 21 LEU C C 21 177.822 177.822 178.173 -0.351 19610 2994 1 15 . 1 1 21 21 LEU CA C 21 56.439 56.439 56.013 0.426 19610 2995 1 15 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.420 0.832 19610 2996 1 15 . 1 1 21 21 LEU H H 21 7.807 7.807 8.081 -0.274 19610 2997 1 15 . 1 1 22 22 LEU N N 22 119.558 119.558 121.246 -1.688 19610 2998 1 15 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.011 0.065 19610 2999 1 15 . 1 1 22 22 LEU C C 22 177.131 177.131 177.994 -0.863 19610 3000 1 15 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.316 -2.261 19610 3001 1 15 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.533 0.311 19610 3002 1 15 . 1 1 22 22 LEU H H 22 7.878 7.878 7.598 0.280 19610 3003 1 15 . 1 1 23 23 ASP N N 23 119.509 119.509 118.766 0.743 19610 3004 1 15 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.261 0.203 19610 3005 1 15 . 1 1 23 23 ASP C C 23 177.379 177.379 178.288 -0.909 19610 3006 1 15 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.344 -2.417 19610 3007 1 15 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.411 0.327 19610 3008 1 15 . 1 1 23 23 ASP H H 23 7.990 7.990 7.810 0.180 19610 3009 1 15 . 1 1 24 24 PHE N N 24 121.219 121.219 116.901 4.318 19610 3010 1 15 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.261 0.205 19610 3011 1 15 . 1 1 24 24 PHE C C 24 176.875 176.875 177.764 -0.889 19610 3012 1 15 . 1 1 24 24 PHE CA C 24 59.229 59.229 60.209 -0.980 19610 3013 1 15 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.327 0.680 19610 3014 1 15 . 1 1 24 24 PHE H H 24 8.204 8.204 7.248 0.956 19610 3015 1 15 . 1 1 25 25 SER N N 25 115.500 115.500 116.058 -0.558 19610 3016 1 15 . 1 1 25 25 SER HA H 25 4.108 4.108 4.583 -0.475 19610 3017 1 15 . 1 1 25 25 SER C C 25 175.386 175.386 176.496 -1.110 19610 3018 1 15 . 1 1 25 25 SER CA C 25 60.758 60.758 61.568 -0.810 19610 3019 1 15 . 1 1 25 25 SER CB C 25 62.998 62.998 63.285 -0.287 19610 3020 1 15 . 1 1 25 25 SER H H 25 8.326 8.326 7.947 0.379 19610 3021 1 15 . 1 1 26 26 MET N N 26 119.723 119.723 117.666 2.057 19610 3022 1 15 . 1 1 26 26 MET HA H 26 4.363 4.363 4.592 -0.229 19610 3023 1 15 . 1 1 26 26 MET C C 26 176.450 176.450 177.318 -0.868 19610 3024 1 15 . 1 1 26 26 MET CA C 26 55.949 55.949 56.750 -0.801 19610 3025 1 15 . 1 1 26 26 MET CB C 26 31.868 31.868 32.471 -0.603 19610 3026 1 15 . 1 1 26 26 MET H H 26 7.889 7.889 7.710 0.179 19610 3027 1 15 . 1 1 27 27 MET N N 27 117.872 117.872 118.871 -0.999 19610 3028 1 15 . 1 1 27 27 MET HA H 27 4.186 4.186 4.283 -0.097 19610 3029 1 15 . 1 1 27 27 MET C C 27 175.341 175.341 176.772 -1.431 19610 3030 1 15 . 1 1 27 27 MET CA C 27 56.102 56.102 57.141 -1.039 19610 3031 1 15 . 1 1 27 27 MET CB C 27 33.161 33.161 33.219 -0.058 19610 3032 1 15 . 1 1 27 27 MET H H 27 7.656 7.656 7.365 0.291 19610 3033 1 15 . 1 1 28 28 PHE N N 28 118.702 118.702 121.407 -2.705 19610 3034 1 15 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.459 0.345 19610 3035 1 15 . 1 1 28 28 PHE C C 28 173.132 173.132 175.113 -1.981 19610 3036 1 15 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.175 -2.380 19610 3037 1 15 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.606 0.123 19610 3038 1 15 . 1 1 28 28 PHE H H 28 7.682 7.682 7.742 -0.060 19610 3039 1 15 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.496 -0.035 19610 3040 1 15 . 1 1 29 29 PRO C C 29 176.360 176.360 176.155 0.205 19610 3041 1 15 . 1 1 29 29 PRO CA C 29 62.820 62.820 62.975 -0.155 19610 3042 1 15 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.840 -0.259 19610 3043 1 15 . 1 1 30 30 LEU N N 30 123.391 123.391 121.790 1.601 19610 3044 1 15 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.616 -0.077 19610 3045 1 15 . 1 1 30 30 LEU C C 30 175.365 175.365 175.532 -0.167 19610 3046 1 15 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.340 -0.429 19610 3047 1 15 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.998 -0.325 19610 3048 1 15 . 1 1 30 30 LEU H H 30 8.284 8.284 7.741 0.543 19610 3049 1 15 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.455 -0.017 19610 3050 1 15 . 1 1 31 31 PRO C C 31 176.688 176.688 176.268 0.420 19610 3051 1 15 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.725 0.155 19610 3052 1 15 . 1 1 31 31 PRO CB C 31 32.043 32.043 31.831 0.212 19610 3053 1 15 . 1 1 32 32 VAL N N 32 120.844 120.844 126.412 -5.568 19610 3054 1 15 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.062 0.078 19610 3055 1 15 . 1 1 32 32 VAL C C 32 176.579 176.579 176.528 0.051 19610 3056 1 15 . 1 1 32 32 VAL CA C 32 62.241 62.241 63.072 -0.831 19610 3057 1 15 . 1 1 32 32 VAL CB C 32 32.809 32.809 30.977 1.832 19610 3058 1 15 . 1 1 32 32 VAL H H 32 8.344 8.344 8.297 0.047 19610 3059 1 15 . 1 1 33 33 THR N N 33 118.041 118.041 124.265 -6.224 19610 3060 1 15 . 1 1 33 33 THR HA H 33 4.373 4.373 4.296 0.077 19610 3061 1 15 . 1 1 33 33 THR C C 33 174.172 174.172 175.393 -1.221 19610 3062 1 15 . 1 1 33 33 THR CA C 33 61.407 61.407 62.791 -1.384 19610 3063 1 15 . 1 1 33 33 THR CB C 33 69.891 69.891 69.209 0.682 19610 3064 1 15 . 1 1 33 33 THR H H 33 8.326 8.326 8.595 -0.269 19610 3065 1 15 . 1 1 34 34 ASN N N 34 121.367 121.367 117.562 3.805 19610 3066 1 15 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.323 0.386 19610 3067 1 15 . 1 1 34 34 ASN C C 34 175.639 175.639 175.513 0.126 19610 3068 1 15 . 1 1 34 34 ASN CA C 34 53.218 53.218 54.995 -1.777 19610 3069 1 15 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.385 1.572 19610 3070 1 15 . 1 1 34 34 ASN H H 34 8.526 8.526 8.377 0.148 19610 3071 1 15 . 1 1 35 35 GLY N N 35 109.437 109.437 111.061 -1.624 19610 3072 1 15 . 1 1 35 35 GLY C C 35 174.112 174.112 173.311 0.801 19610 3073 1 15 . 1 1 35 35 GLY CA C 35 45.370 45.370 44.721 0.649 19610 3074 1 15 . 1 1 35 35 GLY H H 35 8.449 8.449 8.128 0.321 19610 3075 1 15 . 1 1 36 36 LYS N N 36 120.614 120.614 122.023 -1.409 19610 3076 1 15 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.225 0.078 19610 3077 1 15 . 1 1 36 36 LYS C C 36 177.182 177.182 178.054 -0.872 19610 3078 1 15 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.232 0.068 19610 3079 1 15 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.759 0.136 19610 3080 1 15 . 1 1 36 36 LYS H H 36 8.261 8.261 8.207 0.054 19610 3081 1 15 . 1 1 37 37 GLY N N 37 110.011 110.011 109.582 0.429 19610 3082 1 15 . 1 1 37 37 GLY C C 37 173.463 173.463 173.456 0.007 19610 3083 1 15 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.035 0.088 19610 3084 1 15 . 1 1 37 37 GLY H H 37 8.484 8.484 8.674 -0.190 19610 3085 1 15 . 1 1 38 38 ARG N N 38 121.698 121.698 121.876 -0.178 19610 3086 1 15 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.920 -0.301 19610 3087 1 15 . 1 1 38 38 ARG C C 38 173.448 173.448 173.958 -0.510 19610 3088 1 15 . 1 1 38 38 ARG CA C 38 53.702 53.702 53.856 -0.154 19610 3089 1 15 . 1 1 38 38 ARG CB C 38 30.121 30.121 29.207 0.914 19610 3090 1 15 . 1 1 38 38 ARG H H 38 8.105 8.105 8.153 -0.048 19610 3091 1 16 . 1 1 2 2 SER HA H 2 4.472 4.472 4.493 -0.021 19610 3092 1 16 . 1 1 2 2 SER C C 2 174.628 174.628 174.521 0.107 19610 3093 1 16 . 1 1 2 2 SER CA C 2 58.397 58.397 58.390 0.007 19610 3094 1 16 . 1 1 2 2 SER CB C 2 63.896 63.896 63.511 0.385 19610 3095 1 16 . 1 1 3 3 MET N N 3 122.147 122.147 125.677 -3.530 19610 3096 1 16 . 1 1 3 3 MET HA H 3 4.490 4.490 4.635 -0.145 19610 3097 1 16 . 1 1 3 3 MET C C 3 175.934 175.934 175.365 0.569 19610 3098 1 16 . 1 1 3 3 MET CA C 3 55.552 55.552 54.248 1.304 19610 3099 1 16 . 1 1 3 3 MET CB C 3 32.645 32.645 30.981 1.664 19610 3100 1 16 . 1 1 3 3 MET H H 3 8.627 8.627 8.508 0.119 19610 3101 1 16 . 1 1 4 4 ASN N N 4 119.930 119.930 121.811 -1.881 19610 3102 1 16 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.999 -0.345 19610 3103 1 16 . 1 1 4 4 ASN C C 4 174.695 174.695 174.197 0.498 19610 3104 1 16 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.238 -0.001 19610 3105 1 16 . 1 1 4 4 ASN CB C 4 38.768 38.768 40.421 -1.653 19610 3106 1 16 . 1 1 4 4 ASN H H 4 8.497 8.497 8.687 -0.190 19610 3107 1 16 . 1 1 5 5 GLN N N 5 121.523 121.523 122.113 -0.590 19610 3108 1 16 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.798 -0.205 19610 3109 1 16 . 1 1 5 5 GLN C C 5 173.849 173.849 174.267 -0.418 19610 3110 1 16 . 1 1 5 5 GLN CA C 5 53.724 53.724 53.888 -0.164 19610 3111 1 16 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.861 0.053 19610 3112 1 16 . 1 1 5 5 GLN H H 5 8.322 8.322 8.420 -0.098 19610 3113 1 16 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.416 -0.038 19610 3114 1 16 . 1 1 6 6 PRO C C 6 176.816 176.816 176.567 0.249 19610 3115 1 16 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.536 0.621 19610 3116 1 16 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.254 -0.168 19610 3117 1 16 . 1 1 7 7 GLN N N 7 121.005 121.005 118.600 2.405 19610 3118 1 16 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.184 0.061 19610 3119 1 16 . 1 1 7 7 GLN C C 7 175.941 175.941 176.200 -0.259 19610 3120 1 16 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.688 0.097 19610 3121 1 16 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.212 0.283 19610 3122 1 16 . 1 1 7 7 GLN H H 7 8.576 8.576 8.327 0.249 19610 3123 1 16 . 1 1 8 8 ARG N N 8 122.928 122.928 121.009 1.919 19610 3124 1 16 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.131 0.156 19610 3125 1 16 . 1 1 8 8 ARG C C 8 176.061 176.061 176.001 0.060 19610 3126 1 16 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.957 -0.961 19610 3127 1 16 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.143 1.673 19610 3128 1 16 . 1 1 8 8 ARG H H 8 8.449 8.449 8.514 -0.065 19610 3129 1 16 . 1 1 9 9 MET N N 9 122.430 122.430 123.267 -0.837 19610 3130 1 16 . 1 1 9 9 MET HA H 9 4.450 4.450 4.779 -0.329 19610 3131 1 16 . 1 1 9 9 MET C C 9 175.469 175.469 176.208 -0.739 19610 3132 1 16 . 1 1 9 9 MET CA C 9 54.941 54.941 54.505 0.437 19610 3133 1 16 . 1 1 9 9 MET CB C 9 33.058 33.058 34.333 -1.275 19610 3134 1 16 . 1 1 9 9 MET H H 9 8.471 8.471 8.337 0.134 19610 3135 1 16 . 1 1 10 10 ALA N N 10 127.153 127.153 124.431 2.722 19610 3136 1 16 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.569 -0.028 19610 3137 1 16 . 1 1 10 10 ALA C C 10 175.353 175.353 176.513 -1.160 19610 3138 1 16 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.452 0.035 19610 3139 1 16 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.675 -0.644 19610 3140 1 16 . 1 1 10 10 ALA H H 10 8.398 8.398 8.300 0.098 19610 3141 1 16 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.341 0.097 19610 3142 1 16 . 1 1 11 11 PRO C C 11 176.896 176.896 176.539 0.357 19610 3143 1 16 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.852 -0.997 19610 3144 1 16 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.206 -0.185 19610 3145 1 16 . 1 1 12 12 VAL N N 12 120.652 120.652 118.694 1.958 19610 3146 1 16 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.230 -0.140 19610 3147 1 16 . 1 1 12 12 VAL C C 12 176.825 176.825 175.108 1.717 19610 3148 1 16 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.859 0.544 19610 3149 1 16 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.782 -0.881 19610 3150 1 16 . 1 1 12 12 VAL H H 12 8.373 8.373 7.553 0.820 19610 3151 1 16 . 1 1 13 13 GLY N N 13 112.483 112.483 113.308 -0.825 19610 3152 1 16 . 1 1 13 13 GLY C C 13 174.515 174.515 175.448 -0.933 19610 3153 1 16 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.389 -1.061 19610 3154 1 16 . 1 1 13 13 GLY H H 13 8.605 8.605 8.347 0.258 19610 3155 1 16 . 1 1 14 14 THR N N 14 113.531 113.531 116.010 -2.479 19610 3156 1 16 . 1 1 14 14 THR HA H 14 4.309 4.309 4.374 -0.065 19610 3157 1 16 . 1 1 14 14 THR C C 14 174.742 174.742 175.284 -0.542 19610 3158 1 16 . 1 1 14 14 THR CA C 14 62.130 62.130 63.433 -1.303 19610 3159 1 16 . 1 1 14 14 THR CB C 14 69.981 69.981 69.003 0.978 19610 3160 1 16 . 1 1 14 14 THR H H 14 8.164 8.164 7.989 0.175 19610 3161 1 16 . 1 1 15 15 ASP N N 15 122.439 122.439 120.771 1.668 19610 3162 1 16 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.416 0.094 19610 3163 1 16 . 1 1 15 15 ASP C C 15 177.216 177.216 178.324 -1.108 19610 3164 1 16 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.404 -2.142 19610 3165 1 16 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.779 -0.086 19610 3166 1 16 . 1 1 15 15 ASP H H 15 8.537 8.537 8.682 -0.145 19610 3167 1 16 . 1 1 16 16 LYS N N 16 122.807 122.807 118.373 4.434 19610 3168 1 16 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.074 0.044 19610 3169 1 16 . 1 1 16 16 LYS C C 16 177.430 177.430 179.153 -1.723 19610 3170 1 16 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.814 -0.921 19610 3171 1 16 . 1 1 16 16 LYS CB C 16 32.539 32.539 32.094 0.445 19610 3172 1 16 . 1 1 16 16 LYS H H 16 8.288 8.288 7.520 0.768 19610 3173 1 16 . 1 1 17 17 GLU N N 17 119.492 119.492 119.386 0.106 19610 3174 1 16 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.127 -0.015 19610 3175 1 16 . 1 1 17 17 GLU C C 17 178.007 178.007 179.153 -1.146 19610 3176 1 16 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.252 -1.000 19610 3177 1 16 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.683 -0.036 19610 3178 1 16 . 1 1 17 17 GLU H H 17 8.221 8.221 7.640 0.581 19610 3179 1 16 . 1 1 18 18 LEU N N 18 119.493 119.493 116.776 2.717 19610 3180 1 16 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.177 -0.030 19610 3181 1 16 . 1 1 18 18 LEU C C 18 178.359 178.359 178.870 -0.511 19610 3182 1 16 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.976 -1.554 19610 3183 1 16 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.067 0.693 19610 3184 1 16 . 1 1 18 18 LEU H H 18 7.998 7.998 8.083 -0.085 19610 3185 1 16 . 1 1 19 19 SER N N 19 114.728 114.728 115.778 -1.050 19610 3186 1 16 . 1 1 19 19 SER HA H 19 4.113 4.113 4.122 -0.009 19610 3187 1 16 . 1 1 19 19 SER C C 19 175.912 175.912 176.676 -0.764 19610 3188 1 16 . 1 1 19 19 SER CA C 19 60.881 60.881 62.370 -1.489 19610 3189 1 16 . 1 1 19 19 SER CB C 19 63.043 63.043 62.699 0.344 19610 3190 1 16 . 1 1 19 19 SER H H 19 8.068 8.068 8.065 0.003 19610 3191 1 16 . 1 1 20 20 ASP N N 20 121.206 121.206 122.096 -0.890 19610 3192 1 16 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.452 -0.004 19610 3193 1 16 . 1 1 20 20 ASP C C 20 177.598 177.598 178.616 -1.018 19610 3194 1 16 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.758 -0.763 19610 3195 1 16 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.149 -0.610 19610 3196 1 16 . 1 1 20 20 ASP H H 20 8.301 8.301 7.795 0.506 19610 3197 1 16 . 1 1 21 21 LEU N N 21 119.944 119.944 119.473 0.471 19610 3198 1 16 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.628 -0.486 19610 3199 1 16 . 1 1 21 21 LEU C C 21 177.822 177.822 177.915 -0.093 19610 3200 1 16 . 1 1 21 21 LEU CA C 21 56.439 56.439 56.245 0.194 19610 3201 1 16 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.752 0.499 19610 3202 1 16 . 1 1 21 21 LEU H H 21 7.807 7.807 7.990 -0.183 19610 3203 1 16 . 1 1 22 22 LEU N N 22 119.558 119.558 121.348 -1.790 19610 3204 1 16 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.129 -0.053 19610 3205 1 16 . 1 1 22 22 LEU C C 22 177.131 177.131 178.452 -1.321 19610 3206 1 16 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.369 -1.314 19610 3207 1 16 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.521 0.323 19610 3208 1 16 . 1 1 22 22 LEU H H 22 7.878 7.878 7.814 0.064 19610 3209 1 16 . 1 1 23 23 ASP N N 23 119.509 119.509 119.793 -0.284 19610 3210 1 16 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.220 0.244 19610 3211 1 16 . 1 1 23 23 ASP C C 23 177.379 177.379 178.355 -0.976 19610 3212 1 16 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.395 -2.468 19610 3213 1 16 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.537 0.202 19610 3214 1 16 . 1 1 23 23 ASP H H 23 7.990 7.990 7.755 0.235 19610 3215 1 16 . 1 1 24 24 PHE N N 24 121.219 121.219 117.339 3.880 19610 3216 1 16 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.305 0.161 19610 3217 1 16 . 1 1 24 24 PHE C C 24 176.875 176.875 177.353 -0.478 19610 3218 1 16 . 1 1 24 24 PHE CA C 24 59.229 59.229 60.496 -1.267 19610 3219 1 16 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.604 0.403 19610 3220 1 16 . 1 1 24 24 PHE H H 24 8.204 8.204 7.354 0.850 19610 3221 1 16 . 1 1 25 25 SER N N 25 115.500 115.500 116.762 -1.262 19610 3222 1 16 . 1 1 25 25 SER HA H 25 4.108 4.108 4.667 -0.559 19610 3223 1 16 . 1 1 25 25 SER C C 25 175.386 175.386 176.188 -0.802 19610 3224 1 16 . 1 1 25 25 SER CA C 25 60.758 60.758 61.650 -0.892 19610 3225 1 16 . 1 1 25 25 SER CB C 25 62.998 62.998 62.931 0.067 19610 3226 1 16 . 1 1 25 25 SER H H 25 8.326 8.326 7.995 0.331 19610 3227 1 16 . 1 1 26 26 MET N N 26 119.723 119.723 117.198 2.525 19610 3228 1 16 . 1 1 26 26 MET HA H 26 4.363 4.363 4.516 -0.153 19610 3229 1 16 . 1 1 26 26 MET C C 26 176.450 176.450 177.221 -0.771 19610 3230 1 16 . 1 1 26 26 MET CA C 26 55.949 55.949 56.826 -0.877 19610 3231 1 16 . 1 1 26 26 MET CB C 26 31.868 31.868 32.277 -0.409 19610 3232 1 16 . 1 1 26 26 MET H H 26 7.889 7.889 7.885 0.004 19610 3233 1 16 . 1 1 27 27 MET N N 27 117.872 117.872 118.679 -0.807 19610 3234 1 16 . 1 1 27 27 MET HA H 27 4.186 4.186 4.300 -0.114 19610 3235 1 16 . 1 1 27 27 MET C C 27 175.341 175.341 176.847 -1.506 19610 3236 1 16 . 1 1 27 27 MET CA C 27 56.102 56.102 57.079 -0.977 19610 3237 1 16 . 1 1 27 27 MET CB C 27 33.161 33.161 33.262 -0.101 19610 3238 1 16 . 1 1 27 27 MET H H 27 7.656 7.656 7.354 0.302 19610 3239 1 16 . 1 1 28 28 PHE N N 28 118.702 118.702 121.558 -2.856 19610 3240 1 16 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.438 0.366 19610 3241 1 16 . 1 1 28 28 PHE C C 28 173.132 173.132 175.069 -1.937 19610 3242 1 16 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.260 -2.465 19610 3243 1 16 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.540 0.189 19610 3244 1 16 . 1 1 28 28 PHE H H 28 7.682 7.682 7.769 -0.087 19610 3245 1 16 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.520 -0.059 19610 3246 1 16 . 1 1 29 29 PRO C C 29 176.360 176.360 176.121 0.239 19610 3247 1 16 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.248 -0.429 19610 3248 1 16 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.938 -0.357 19610 3249 1 16 . 1 1 30 30 LEU N N 30 123.391 123.391 122.616 0.775 19610 3250 1 16 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.689 -0.150 19610 3251 1 16 . 1 1 30 30 LEU C C 30 175.365 175.365 175.831 -0.466 19610 3252 1 16 . 1 1 30 30 LEU CA C 30 52.911 52.911 52.506 0.405 19610 3253 1 16 . 1 1 30 30 LEU CB C 30 41.673 41.673 42.182 -0.509 19610 3254 1 16 . 1 1 30 30 LEU H H 30 8.284 8.284 7.636 0.648 19610 3255 1 16 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.472 -0.034 19610 3256 1 16 . 1 1 31 31 PRO C C 31 176.688 176.688 175.694 0.994 19610 3257 1 16 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.533 0.347 19610 3258 1 16 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.161 1.882 19610 3259 1 16 . 1 1 32 32 VAL N N 32 120.844 120.844 126.563 -5.719 19610 3260 1 16 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.057 0.083 19610 3261 1 16 . 1 1 32 32 VAL C C 32 176.579 176.579 176.213 0.366 19610 3262 1 16 . 1 1 32 32 VAL CA C 32 62.241 62.241 61.878 0.363 19610 3263 1 16 . 1 1 32 32 VAL CB C 32 32.809 32.809 30.522 2.287 19610 3264 1 16 . 1 1 32 32 VAL H H 32 8.344 8.344 7.970 0.374 19610 3265 1 16 . 1 1 33 33 THR N N 33 118.041 118.041 120.379 -2.338 19610 3266 1 16 . 1 1 33 33 THR HA H 33 4.373 4.373 4.305 0.068 19610 3267 1 16 . 1 1 33 33 THR C C 33 174.172 174.172 174.629 -0.457 19610 3268 1 16 . 1 1 33 33 THR CA C 33 61.407 61.407 61.967 -0.560 19610 3269 1 16 . 1 1 33 33 THR CB C 33 69.891 69.891 67.737 2.154 19610 3270 1 16 . 1 1 33 33 THR H H 33 8.326 8.326 8.308 0.018 19610 3271 1 16 . 1 1 34 34 ASN N N 34 121.367 121.367 118.723 2.644 19610 3272 1 16 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.328 0.381 19610 3273 1 16 . 1 1 34 34 ASN C C 34 175.639 175.639 175.815 -0.176 19610 3274 1 16 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.801 -0.583 19610 3275 1 16 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.755 1.202 19610 3276 1 16 . 1 1 34 34 ASN H H 34 8.526 8.526 8.302 0.224 19610 3277 1 16 . 1 1 35 35 GLY N N 35 109.437 109.437 106.143 3.294 19610 3278 1 16 . 1 1 35 35 GLY C C 35 174.112 174.112 174.327 -0.215 19610 3279 1 16 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.806 -0.436 19610 3280 1 16 . 1 1 35 35 GLY H H 35 8.449 8.449 8.339 0.110 19610 3281 1 16 . 1 1 36 36 LYS N N 36 120.614 120.614 119.613 1.001 19610 3282 1 16 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.482 -0.179 19610 3283 1 16 . 1 1 36 36 LYS C C 36 177.182 177.182 175.367 1.815 19610 3284 1 16 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.145 0.155 19610 3285 1 16 . 1 1 36 36 LYS CB C 36 32.895 32.895 33.176 -0.281 19610 3286 1 16 . 1 1 36 36 LYS H H 36 8.261 8.261 7.624 0.637 19610 3287 1 16 . 1 1 37 37 GLY N N 37 110.011 110.011 111.487 -1.476 19610 3288 1 16 . 1 1 37 37 GLY C C 37 173.463 173.463 173.915 -0.452 19610 3289 1 16 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.277 -0.155 19610 3290 1 16 . 1 1 37 37 GLY H H 37 8.484 8.484 8.180 0.304 19610 3291 1 16 . 1 1 38 38 ARG N N 38 121.698 121.698 120.234 1.464 19610 3292 1 16 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.215 0.404 19610 3293 1 16 . 1 1 38 38 ARG C C 38 173.448 173.448 174.121 -0.673 19610 3294 1 16 . 1 1 38 38 ARG CA C 38 53.702 53.702 56.117 -2.415 19610 3295 1 16 . 1 1 38 38 ARG CB C 38 30.121 30.121 28.382 1.739 19610 3296 1 16 . 1 1 38 38 ARG H H 38 8.105 8.105 8.555 -0.450 19610 3297 1 17 . 1 1 2 2 SER HA H 2 4.472 4.472 4.618 -0.146 19610 3298 1 17 . 1 1 2 2 SER C C 2 174.628 174.628 174.810 -0.182 19610 3299 1 17 . 1 1 2 2 SER CA C 2 58.397 58.397 58.142 0.255 19610 3300 1 17 . 1 1 2 2 SER CB C 2 63.896 63.896 63.952 -0.056 19610 3301 1 17 . 1 1 3 3 MET N N 3 122.147 122.147 125.907 -3.760 19610 3302 1 17 . 1 1 3 3 MET HA H 3 4.490 4.490 4.431 0.059 19610 3303 1 17 . 1 1 3 3 MET C C 3 175.934 175.934 175.533 0.401 19610 3304 1 17 . 1 1 3 3 MET CA C 3 55.552 55.552 55.569 -0.017 19610 3305 1 17 . 1 1 3 3 MET CB C 3 32.645 32.645 31.971 0.674 19610 3306 1 17 . 1 1 3 3 MET H H 3 8.627 8.627 8.737 -0.110 19610 3307 1 17 . 1 1 4 4 ASN N N 4 119.930 119.930 122.606 -2.676 19610 3308 1 17 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.827 -0.173 19610 3309 1 17 . 1 1 4 4 ASN C C 4 174.695 174.695 173.762 0.933 19610 3310 1 17 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.333 -0.096 19610 3311 1 17 . 1 1 4 4 ASN CB C 4 38.768 38.768 40.374 -1.606 19610 3312 1 17 . 1 1 4 4 ASN H H 4 8.497 8.497 8.592 -0.095 19610 3313 1 17 . 1 1 5 5 GLN N N 5 121.523 121.523 123.617 -2.094 19610 3314 1 17 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.585 0.008 19610 3315 1 17 . 1 1 5 5 GLN C C 5 173.849 173.849 174.353 -0.504 19610 3316 1 17 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.189 -0.465 19610 3317 1 17 . 1 1 5 5 GLN CB C 5 28.914 28.914 29.053 -0.139 19610 3318 1 17 . 1 1 5 5 GLN H H 5 8.322 8.322 8.392 -0.070 19610 3319 1 17 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.384 -0.006 19610 3320 1 17 . 1 1 6 6 PRO C C 6 176.816 176.816 176.412 0.404 19610 3321 1 17 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.509 0.648 19610 3322 1 17 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.228 -0.142 19610 3323 1 17 . 1 1 7 7 GLN N N 7 121.005 121.005 117.612 3.393 19610 3324 1 17 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.098 0.147 19610 3325 1 17 . 1 1 7 7 GLN C C 7 175.941 175.941 175.567 0.374 19610 3326 1 17 . 1 1 7 7 GLN CA C 7 55.785 55.785 56.083 -0.298 19610 3327 1 17 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.131 0.364 19610 3328 1 17 . 1 1 7 7 GLN H H 7 8.576 8.576 8.253 0.323 19610 3329 1 17 . 1 1 8 8 ARG N N 8 122.928 122.928 121.736 1.192 19610 3330 1 17 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.218 0.069 19610 3331 1 17 . 1 1 8 8 ARG C C 8 176.061 176.061 176.339 -0.278 19610 3332 1 17 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.197 -0.201 19610 3333 1 17 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.118 1.698 19610 3334 1 17 . 1 1 8 8 ARG H H 8 8.449 8.449 8.654 -0.205 19610 3335 1 17 . 1 1 9 9 MET N N 9 122.430 122.430 123.858 -1.428 19610 3336 1 17 . 1 1 9 9 MET HA H 9 4.450 4.450 4.412 0.038 19610 3337 1 17 . 1 1 9 9 MET C C 9 175.469 175.469 176.589 -1.120 19610 3338 1 17 . 1 1 9 9 MET CA C 9 54.941 54.941 55.453 -0.511 19610 3339 1 17 . 1 1 9 9 MET CB C 9 33.058 33.058 32.914 0.144 19610 3340 1 17 . 1 1 9 9 MET H H 9 8.471 8.471 8.370 0.101 19610 3341 1 17 . 1 1 10 10 ALA N N 10 127.153 127.153 128.925 -1.772 19610 3342 1 17 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.410 0.131 19610 3343 1 17 . 1 1 10 10 ALA C C 10 175.353 175.353 177.098 -1.745 19610 3344 1 17 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.625 -0.138 19610 3345 1 17 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.853 -0.822 19610 3346 1 17 . 1 1 10 10 ALA H H 10 8.398 8.398 8.397 0.001 19610 3347 1 17 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.392 0.046 19610 3348 1 17 . 1 1 11 11 PRO C C 11 176.896 176.896 176.654 0.242 19610 3349 1 17 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.706 -0.851 19610 3350 1 17 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.335 -0.314 19610 3351 1 17 . 1 1 12 12 VAL N N 12 120.652 120.652 116.375 4.277 19610 3352 1 17 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.211 -0.121 19610 3353 1 17 . 1 1 12 12 VAL C C 12 176.825 176.825 174.366 2.459 19610 3354 1 17 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.544 0.859 19610 3355 1 17 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.215 -1.315 19610 3356 1 17 . 1 1 12 12 VAL H H 12 8.373 8.373 7.477 0.896 19610 3357 1 17 . 1 1 13 13 GLY N N 13 112.483 112.483 112.268 0.215 19610 3358 1 17 . 1 1 13 13 GLY C C 13 174.515 174.515 174.673 -0.158 19610 3359 1 17 . 1 1 13 13 GLY CA C 13 45.328 45.328 45.543 -0.215 19610 3360 1 17 . 1 1 13 13 GLY H H 13 8.605 8.605 8.409 0.196 19610 3361 1 17 . 1 1 14 14 THR N N 14 113.531 113.531 116.619 -3.088 19610 3362 1 17 . 1 1 14 14 THR HA H 14 4.309 4.309 4.241 0.068 19610 3363 1 17 . 1 1 14 14 THR C C 14 174.742 174.742 175.730 -0.988 19610 3364 1 17 . 1 1 14 14 THR CA C 14 62.130 62.130 63.785 -1.655 19610 3365 1 17 . 1 1 14 14 THR CB C 14 69.981 69.981 68.902 1.079 19610 3366 1 17 . 1 1 14 14 THR H H 14 8.164 8.164 8.004 0.160 19610 3367 1 17 . 1 1 15 15 ASP N N 15 122.439 122.439 120.310 2.129 19610 3368 1 17 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.360 0.150 19610 3369 1 17 . 1 1 15 15 ASP C C 15 177.216 177.216 178.325 -1.109 19610 3370 1 17 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.932 -2.670 19610 3371 1 17 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.822 -0.129 19610 3372 1 17 . 1 1 15 15 ASP H H 15 8.537 8.537 8.666 -0.129 19610 3373 1 17 . 1 1 16 16 LYS N N 16 122.807 122.807 118.370 4.437 19610 3374 1 17 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.065 0.053 19610 3375 1 17 . 1 1 16 16 LYS C C 16 177.430 177.430 179.331 -1.901 19610 3376 1 17 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.632 -0.739 19610 3377 1 17 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.972 0.567 19610 3378 1 17 . 1 1 16 16 LYS H H 16 8.288 8.288 7.621 0.667 19610 3379 1 17 . 1 1 17 17 GLU N N 17 119.492 119.492 119.374 0.118 19610 3380 1 17 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.139 -0.027 19610 3381 1 17 . 1 1 17 17 GLU C C 17 178.007 178.007 179.034 -1.027 19610 3382 1 17 . 1 1 17 17 GLU CA C 17 58.252 58.252 58.979 -0.727 19610 3383 1 17 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.411 0.236 19610 3384 1 17 . 1 1 17 17 GLU H H 17 8.221 8.221 7.475 0.746 19610 3385 1 17 . 1 1 18 18 LEU N N 18 119.493 119.493 117.133 2.360 19610 3386 1 17 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.146 0.001 19610 3387 1 17 . 1 1 18 18 LEU C C 18 178.359 178.359 179.144 -0.785 19610 3388 1 17 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.876 -1.454 19610 3389 1 17 . 1 1 18 18 LEU CB C 18 41.760 41.760 40.998 0.762 19610 3390 1 17 . 1 1 18 18 LEU H H 18 7.998 7.998 8.093 -0.095 19610 3391 1 17 . 1 1 19 19 SER N N 19 114.728 114.728 114.725 0.003 19610 3392 1 17 . 1 1 19 19 SER HA H 19 4.113 4.113 4.109 0.004 19610 3393 1 17 . 1 1 19 19 SER C C 19 175.912 175.912 176.156 -0.244 19610 3394 1 17 . 1 1 19 19 SER CA C 19 60.881 60.881 62.267 -1.386 19610 3395 1 17 . 1 1 19 19 SER CB C 19 63.043 63.043 63.023 0.021 19610 3396 1 17 . 1 1 19 19 SER H H 19 8.068 8.068 8.053 0.015 19610 3397 1 17 . 1 1 20 20 ASP N N 20 121.206 121.206 122.164 -0.958 19610 3398 1 17 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.380 0.068 19610 3399 1 17 . 1 1 20 20 ASP C C 20 177.598 177.598 178.219 -0.621 19610 3400 1 17 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.817 -0.822 19610 3401 1 17 . 1 1 20 20 ASP CB C 20 40.539 40.539 41.051 -0.512 19610 3402 1 17 . 1 1 20 20 ASP H H 20 8.301 8.301 7.566 0.735 19610 3403 1 17 . 1 1 21 21 LEU N N 21 119.944 119.944 119.578 0.366 19610 3404 1 17 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.375 -0.233 19610 3405 1 17 . 1 1 21 21 LEU C C 21 177.822 177.822 178.285 -0.463 19610 3406 1 17 . 1 1 21 21 LEU CA C 21 56.439 56.439 56.338 0.101 19610 3407 1 17 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.352 0.900 19610 3408 1 17 . 1 1 21 21 LEU H H 21 7.807 7.807 7.960 -0.153 19610 3409 1 17 . 1 1 22 22 LEU N N 22 119.558 119.558 121.296 -1.738 19610 3410 1 17 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.058 0.018 19610 3411 1 17 . 1 1 22 22 LEU C C 22 177.131 177.131 178.111 -0.980 19610 3412 1 17 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.746 -1.691 19610 3413 1 17 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.328 0.516 19610 3414 1 17 . 1 1 22 22 LEU H H 22 7.878 7.878 7.672 0.206 19610 3415 1 17 . 1 1 23 23 ASP N N 23 119.509 119.509 119.212 0.297 19610 3416 1 17 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.227 0.237 19610 3417 1 17 . 1 1 23 23 ASP C C 23 177.379 177.379 178.451 -1.072 19610 3418 1 17 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.340 -2.413 19610 3419 1 17 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.305 0.434 19610 3420 1 17 . 1 1 23 23 ASP H H 23 7.990 7.990 7.638 0.352 19610 3421 1 17 . 1 1 24 24 PHE N N 24 121.219 121.219 117.331 3.888 19610 3422 1 17 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.316 0.150 19610 3423 1 17 . 1 1 24 24 PHE C C 24 176.875 176.875 177.835 -0.960 19610 3424 1 17 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.565 -0.336 19610 3425 1 17 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.111 0.896 19610 3426 1 17 . 1 1 24 24 PHE H H 24 8.204 8.204 7.216 0.988 19610 3427 1 17 . 1 1 25 25 SER N N 25 115.500 115.500 116.897 -1.397 19610 3428 1 17 . 1 1 25 25 SER HA H 25 4.108 4.108 4.645 -0.537 19610 3429 1 17 . 1 1 25 25 SER C C 25 175.386 175.386 176.221 -0.835 19610 3430 1 17 . 1 1 25 25 SER CA C 25 60.758 60.758 61.602 -0.844 19610 3431 1 17 . 1 1 25 25 SER CB C 25 62.998 62.998 63.017 -0.020 19610 3432 1 17 . 1 1 25 25 SER H H 25 8.326 8.326 8.028 0.298 19610 3433 1 17 . 1 1 26 26 MET N N 26 119.723 119.723 117.507 2.216 19610 3434 1 17 . 1 1 26 26 MET HA H 26 4.363 4.363 4.522 -0.159 19610 3435 1 17 . 1 1 26 26 MET C C 26 176.450 176.450 177.341 -0.891 19610 3436 1 17 . 1 1 26 26 MET CA C 26 55.949 55.949 56.870 -0.921 19610 3437 1 17 . 1 1 26 26 MET CB C 26 31.868 31.868 32.464 -0.596 19610 3438 1 17 . 1 1 26 26 MET H H 26 7.889 7.889 7.691 0.198 19610 3439 1 17 . 1 1 27 27 MET N N 27 117.872 117.872 118.692 -0.820 19610 3440 1 17 . 1 1 27 27 MET HA H 27 4.186 4.186 4.290 -0.104 19610 3441 1 17 . 1 1 27 27 MET C C 27 175.341 175.341 176.790 -1.449 19610 3442 1 17 . 1 1 27 27 MET CA C 27 56.102 56.102 57.193 -1.091 19610 3443 1 17 . 1 1 27 27 MET CB C 27 33.161 33.161 33.228 -0.067 19610 3444 1 17 . 1 1 27 27 MET H H 27 7.656 7.656 7.421 0.235 19610 3445 1 17 . 1 1 28 28 PHE N N 28 118.702 118.702 121.448 -2.746 19610 3446 1 17 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.447 0.357 19610 3447 1 17 . 1 1 28 28 PHE C C 28 173.132 173.132 175.084 -1.952 19610 3448 1 17 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.163 -2.368 19610 3449 1 17 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.497 0.232 19610 3450 1 17 . 1 1 28 28 PHE H H 28 7.682 7.682 7.750 -0.068 19610 3451 1 17 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.487 -0.026 19610 3452 1 17 . 1 1 29 29 PRO C C 29 176.360 176.360 176.272 0.088 19610 3453 1 17 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.309 -0.489 19610 3454 1 17 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.983 -0.402 19610 3455 1 17 . 1 1 30 30 LEU N N 30 123.391 123.391 122.501 0.890 19610 3456 1 17 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.633 -0.094 19610 3457 1 17 . 1 1 30 30 LEU C C 30 175.365 175.365 175.580 -0.215 19610 3458 1 17 . 1 1 30 30 LEU CA C 30 52.911 52.911 52.665 0.246 19610 3459 1 17 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.980 -0.307 19610 3460 1 17 . 1 1 30 30 LEU H H 30 8.284 8.284 7.629 0.655 19610 3461 1 17 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.434 0.004 19610 3462 1 17 . 1 1 31 31 PRO C C 31 176.688 176.688 176.159 0.529 19610 3463 1 17 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.742 0.138 19610 3464 1 17 . 1 1 31 31 PRO CB C 31 32.043 32.043 31.232 0.811 19610 3465 1 17 . 1 1 32 32 VAL N N 32 120.844 120.844 124.999 -4.155 19610 3466 1 17 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.919 0.221 19610 3467 1 17 . 1 1 32 32 VAL C C 32 176.579 176.579 176.332 0.247 19610 3468 1 17 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.267 -0.026 19610 3469 1 17 . 1 1 32 32 VAL CB C 32 32.809 32.809 31.916 0.892 19610 3470 1 17 . 1 1 32 32 VAL H H 32 8.344 8.344 8.273 0.071 19610 3471 1 17 . 1 1 33 33 THR N N 33 118.041 118.041 119.943 -1.902 19610 3472 1 17 . 1 1 33 33 THR HA H 33 4.373 4.373 4.234 0.139 19610 3473 1 17 . 1 1 33 33 THR C C 33 174.172 174.172 175.352 -1.180 19610 3474 1 17 . 1 1 33 33 THR CA C 33 61.407 61.407 63.777 -2.370 19610 3475 1 17 . 1 1 33 33 THR CB C 33 69.891 69.891 69.247 0.644 19610 3476 1 17 . 1 1 33 33 THR H H 33 8.326 8.326 8.240 0.086 19610 3477 1 17 . 1 1 34 34 ASN N N 34 121.367 121.367 115.805 5.562 19610 3478 1 17 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.756 -0.047 19610 3479 1 17 . 1 1 34 34 ASN C C 34 175.639 175.639 174.709 0.930 19610 3480 1 17 . 1 1 34 34 ASN CA C 34 53.218 53.218 52.683 0.535 19610 3481 1 17 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.922 0.035 19610 3482 1 17 . 1 1 34 34 ASN H H 34 8.526 8.526 8.046 0.480 19610 3483 1 17 . 1 1 35 35 GLY N N 35 109.437 109.437 109.130 0.307 19610 3484 1 17 . 1 1 35 35 GLY C C 35 174.112 174.112 173.883 0.229 19610 3485 1 17 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.031 0.339 19610 3486 1 17 . 1 1 35 35 GLY H H 35 8.449 8.449 8.549 -0.100 19610 3487 1 17 . 1 1 36 36 LYS N N 36 120.614 120.614 121.104 -0.490 19610 3488 1 17 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.492 -0.189 19610 3489 1 17 . 1 1 36 36 LYS C C 36 177.182 177.182 176.329 0.853 19610 3490 1 17 . 1 1 36 36 LYS CA C 36 56.300 56.300 55.390 0.910 19610 3491 1 17 . 1 1 36 36 LYS CB C 36 32.895 32.895 34.550 -1.655 19610 3492 1 17 . 1 1 36 36 LYS H H 36 8.261 8.261 7.783 0.478 19610 3493 1 17 . 1 1 37 37 GLY N N 37 110.011 110.011 109.710 0.301 19610 3494 1 17 . 1 1 37 37 GLY C C 37 173.463 173.463 173.211 0.252 19610 3495 1 17 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.064 0.058 19610 3496 1 17 . 1 1 37 37 GLY H H 37 8.484 8.484 8.514 -0.030 19610 3497 1 17 . 1 1 38 38 ARG N N 38 121.698 121.698 120.680 1.018 19610 3498 1 17 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.171 0.448 19610 3499 1 17 . 1 1 38 38 ARG C C 38 173.448 173.448 174.406 -0.958 19610 3500 1 17 . 1 1 38 38 ARG CA C 38 53.702 53.702 55.617 -1.915 19610 3501 1 17 . 1 1 38 38 ARG CB C 38 30.121 30.121 29.645 0.476 19610 3502 1 17 . 1 1 38 38 ARG H H 38 8.105 8.105 8.178 -0.073 19610 3503 1 18 . 1 1 2 2 SER HA H 2 4.472 4.472 4.628 -0.156 19610 3504 1 18 . 1 1 2 2 SER C C 2 174.628 174.628 174.989 -0.361 19610 3505 1 18 . 1 1 2 2 SER CA C 2 58.397 58.397 58.333 0.064 19610 3506 1 18 . 1 1 2 2 SER CB C 2 63.896 63.896 63.446 0.450 19610 3507 1 18 . 1 1 3 3 MET N N 3 122.147 122.147 120.785 1.362 19610 3508 1 18 . 1 1 3 3 MET HA H 3 4.490 4.490 4.459 0.031 19610 3509 1 18 . 1 1 3 3 MET C C 3 175.934 175.934 176.184 -0.250 19610 3510 1 18 . 1 1 3 3 MET CA C 3 55.552 55.552 56.675 -1.123 19610 3511 1 18 . 1 1 3 3 MET CB C 3 32.645 32.645 33.134 -0.489 19610 3512 1 18 . 1 1 3 3 MET H H 3 8.627 8.627 7.958 0.669 19610 3513 1 18 . 1 1 4 4 ASN N N 4 119.930 119.930 120.093 -0.163 19610 3514 1 18 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.660 -0.006 19610 3515 1 18 . 1 1 4 4 ASN C C 4 174.695 174.695 174.937 -0.242 19610 3516 1 18 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.210 0.027 19610 3517 1 18 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.136 0.632 19610 3518 1 18 . 1 1 4 4 ASN H H 4 8.497 8.497 8.191 0.306 19610 3519 1 18 . 1 1 5 5 GLN N N 5 121.523 121.523 124.569 -3.046 19610 3520 1 18 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.579 0.014 19610 3521 1 18 . 1 1 5 5 GLN C C 5 173.849 173.849 174.707 -0.858 19610 3522 1 18 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.100 -0.376 19610 3523 1 18 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.859 0.055 19610 3524 1 18 . 1 1 5 5 GLN H H 5 8.322 8.322 8.265 0.057 19610 3525 1 18 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.386 -0.008 19610 3526 1 18 . 1 1 6 6 PRO C C 6 176.816 176.816 176.305 0.511 19610 3527 1 18 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.666 0.491 19610 3528 1 18 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.062 0.024 19610 3529 1 18 . 1 1 7 7 GLN N N 7 121.005 121.005 118.069 2.936 19610 3530 1 18 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.198 0.047 19610 3531 1 18 . 1 1 7 7 GLN C C 7 175.941 175.941 175.662 0.279 19610 3532 1 18 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.805 -0.020 19610 3533 1 18 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.195 0.300 19610 3534 1 18 . 1 1 7 7 GLN H H 7 8.576 8.576 8.248 0.328 19610 3535 1 18 . 1 1 8 8 ARG N N 8 122.928 122.928 120.795 2.133 19610 3536 1 18 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.274 0.013 19610 3537 1 18 . 1 1 8 8 ARG C C 8 176.061 176.061 176.246 -0.185 19610 3538 1 18 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.173 -0.177 19610 3539 1 18 . 1 1 8 8 ARG CB C 8 30.816 30.816 28.897 1.919 19610 3540 1 18 . 1 1 8 8 ARG H H 8 8.449 8.449 8.589 -0.140 19610 3541 1 18 . 1 1 9 9 MET N N 9 122.430 122.430 123.286 -0.856 19610 3542 1 18 . 1 1 9 9 MET HA H 9 4.450 4.450 4.525 -0.075 19610 3543 1 18 . 1 1 9 9 MET C C 9 175.469 175.469 176.596 -1.127 19610 3544 1 18 . 1 1 9 9 MET CA C 9 54.941 54.941 55.076 -0.135 19610 3545 1 18 . 1 1 9 9 MET CB C 9 33.058 33.058 33.719 -0.661 19610 3546 1 18 . 1 1 9 9 MET H H 9 8.471 8.471 8.263 0.208 19610 3547 1 18 . 1 1 10 10 ALA N N 10 127.153 127.153 125.446 1.707 19610 3548 1 18 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.433 0.108 19610 3549 1 18 . 1 1 10 10 ALA C C 10 175.353 175.353 176.888 -1.535 19610 3550 1 18 . 1 1 10 10 ALA CA C 10 50.487 50.487 51.028 -0.541 19610 3551 1 18 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.334 -0.303 19610 3552 1 18 . 1 1 10 10 ALA H H 10 8.398 8.398 8.290 0.108 19610 3553 1 18 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.375 0.063 19610 3554 1 18 . 1 1 11 11 PRO C C 11 176.896 176.896 176.917 -0.021 19610 3555 1 18 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.729 -0.874 19610 3556 1 18 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.420 -0.399 19610 3557 1 18 . 1 1 12 12 VAL N N 12 120.652 120.652 116.508 4.144 19610 3558 1 18 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.191 -0.101 19610 3559 1 18 . 1 1 12 12 VAL C C 12 176.825 176.825 174.145 2.680 19610 3560 1 18 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.109 1.294 19610 3561 1 18 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.627 -0.726 19610 3562 1 18 . 1 1 12 12 VAL H H 12 8.373 8.373 7.459 0.914 19610 3563 1 18 . 1 1 13 13 GLY N N 13 112.483 112.483 112.399 0.084 19610 3564 1 18 . 1 1 13 13 GLY C C 13 174.515 174.515 174.971 -0.456 19610 3565 1 18 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.264 -0.936 19610 3566 1 18 . 1 1 13 13 GLY H H 13 8.605 8.605 8.230 0.375 19610 3567 1 18 . 1 1 14 14 THR N N 14 113.531 113.531 116.297 -2.766 19610 3568 1 18 . 1 1 14 14 THR HA H 14 4.309 4.309 4.083 0.226 19610 3569 1 18 . 1 1 14 14 THR C C 14 174.742 174.742 175.596 -0.854 19610 3570 1 18 . 1 1 14 14 THR CA C 14 62.130 62.130 64.615 -2.485 19610 3571 1 18 . 1 1 14 14 THR CB C 14 69.981 69.981 68.969 1.012 19610 3572 1 18 . 1 1 14 14 THR H H 14 8.164 8.164 8.030 0.134 19610 3573 1 18 . 1 1 15 15 ASP N N 15 122.439 122.439 120.306 2.133 19610 3574 1 18 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.394 0.116 19610 3575 1 18 . 1 1 15 15 ASP C C 15 177.216 177.216 178.401 -1.185 19610 3576 1 18 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.500 -2.238 19610 3577 1 18 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.779 -0.086 19610 3578 1 18 . 1 1 15 15 ASP H H 15 8.537 8.537 8.661 -0.124 19610 3579 1 18 . 1 1 16 16 LYS N N 16 122.807 122.807 118.717 4.090 19610 3580 1 18 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.124 -0.006 19610 3581 1 18 . 1 1 16 16 LYS C C 16 177.430 177.430 179.151 -1.721 19610 3582 1 18 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.364 -0.471 19610 3583 1 18 . 1 1 16 16 LYS CB C 16 32.539 32.539 32.009 0.530 19610 3584 1 18 . 1 1 16 16 LYS H H 16 8.288 8.288 7.609 0.679 19610 3585 1 18 . 1 1 17 17 GLU N N 17 119.492 119.492 119.327 0.165 19610 3586 1 18 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.102 0.010 19610 3587 1 18 . 1 1 17 17 GLU C C 17 178.007 178.007 179.236 -1.229 19610 3588 1 18 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.060 -0.808 19610 3589 1 18 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.279 0.367 19610 3590 1 18 . 1 1 17 17 GLU H H 17 8.221 8.221 7.677 0.544 19610 3591 1 18 . 1 1 18 18 LEU N N 18 119.493 119.493 116.771 2.722 19610 3592 1 18 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.274 -0.127 19610 3593 1 18 . 1 1 18 18 LEU C C 18 178.359 178.359 179.227 -0.868 19610 3594 1 18 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.933 -1.511 19610 3595 1 18 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.330 0.430 19610 3596 1 18 . 1 1 18 18 LEU H H 18 7.998 7.998 7.755 0.243 19610 3597 1 18 . 1 1 19 19 SER N N 19 114.728 114.728 115.198 -0.470 19610 3598 1 18 . 1 1 19 19 SER HA H 19 4.113 4.113 4.093 0.020 19610 3599 1 18 . 1 1 19 19 SER C C 19 175.912 175.912 176.232 -0.320 19610 3600 1 18 . 1 1 19 19 SER CA C 19 60.881 60.881 61.690 -0.809 19610 3601 1 18 . 1 1 19 19 SER CB C 19 63.043 63.043 62.611 0.432 19610 3602 1 18 . 1 1 19 19 SER H H 19 8.068 8.068 7.661 0.407 19610 3603 1 18 . 1 1 20 20 ASP N N 20 121.206 121.206 122.217 -1.011 19610 3604 1 18 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.536 -0.088 19610 3605 1 18 . 1 1 20 20 ASP C C 20 177.598 177.598 178.516 -0.918 19610 3606 1 18 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.056 -1.061 19610 3607 1 18 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.848 -0.309 19610 3608 1 18 . 1 1 20 20 ASP H H 20 8.301 8.301 8.043 0.258 19610 3609 1 18 . 1 1 21 21 LEU N N 21 119.944 119.944 119.652 0.292 19610 3610 1 18 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.580 -0.438 19610 3611 1 18 . 1 1 21 21 LEU C C 21 177.822 177.822 179.252 -1.430 19610 3612 1 18 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.907 0.532 19610 3613 1 18 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.254 0.998 19610 3614 1 18 . 1 1 21 21 LEU H H 21 7.807 7.807 7.730 0.077 19610 3615 1 18 . 1 1 22 22 LEU N N 22 119.558 119.558 121.800 -2.242 19610 3616 1 18 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.979 0.097 19610 3617 1 18 . 1 1 22 22 LEU C C 22 177.131 177.131 177.963 -0.832 19610 3618 1 18 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.532 -2.477 19610 3619 1 18 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.399 0.445 19610 3620 1 18 . 1 1 22 22 LEU H H 22 7.878 7.878 7.730 0.148 19610 3621 1 18 . 1 1 23 23 ASP N N 23 119.509 119.509 118.875 0.634 19610 3622 1 18 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.203 0.261 19610 3623 1 18 . 1 1 23 23 ASP C C 23 177.379 177.379 178.854 -1.475 19610 3624 1 18 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.658 -2.731 19610 3625 1 18 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.061 0.678 19610 3626 1 18 . 1 1 23 23 ASP H H 23 7.990 7.990 7.713 0.277 19610 3627 1 18 . 1 1 24 24 PHE N N 24 121.219 121.219 117.341 3.878 19610 3628 1 18 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.332 0.134 19610 3629 1 18 . 1 1 24 24 PHE C C 24 176.875 176.875 177.918 -1.043 19610 3630 1 18 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.415 -0.186 19610 3631 1 18 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.104 0.903 19610 3632 1 18 . 1 1 24 24 PHE H H 24 8.204 8.204 7.335 0.869 19610 3633 1 18 . 1 1 25 25 SER N N 25 115.500 115.500 116.343 -0.843 19610 3634 1 18 . 1 1 25 25 SER HA H 25 4.108 4.108 4.652 -0.544 19610 3635 1 18 . 1 1 25 25 SER C C 25 175.386 175.386 176.861 -1.475 19610 3636 1 18 . 1 1 25 25 SER CA C 25 60.758 60.758 61.914 -1.156 19610 3637 1 18 . 1 1 25 25 SER CB C 25 62.998 62.998 63.217 -0.219 19610 3638 1 18 . 1 1 25 25 SER H H 25 8.326 8.326 7.845 0.481 19610 3639 1 18 . 1 1 26 26 MET N N 26 119.723 119.723 119.474 0.249 19610 3640 1 18 . 1 1 26 26 MET HA H 26 4.363 4.363 4.470 -0.107 19610 3641 1 18 . 1 1 26 26 MET C C 26 176.450 176.450 177.315 -0.865 19610 3642 1 18 . 1 1 26 26 MET CA C 26 55.949 55.949 57.350 -1.401 19610 3643 1 18 . 1 1 26 26 MET CB C 26 31.868 31.868 32.156 -0.288 19610 3644 1 18 . 1 1 26 26 MET H H 26 7.889 7.889 7.797 0.092 19610 3645 1 18 . 1 1 27 27 MET N N 27 117.872 117.872 118.596 -0.724 19610 3646 1 18 . 1 1 27 27 MET HA H 27 4.186 4.186 4.289 -0.103 19610 3647 1 18 . 1 1 27 27 MET C C 27 175.341 175.341 176.709 -1.368 19610 3648 1 18 . 1 1 27 27 MET CA C 27 56.102 56.102 57.129 -1.027 19610 3649 1 18 . 1 1 27 27 MET CB C 27 33.161 33.161 33.231 -0.070 19610 3650 1 18 . 1 1 27 27 MET H H 27 7.656 7.656 7.453 0.203 19610 3651 1 18 . 1 1 28 28 PHE N N 28 118.702 118.702 121.474 -2.772 19610 3652 1 18 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.462 0.342 19610 3653 1 18 . 1 1 28 28 PHE C C 28 173.132 173.132 175.031 -1.899 19610 3654 1 18 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.087 -2.292 19610 3655 1 18 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.503 0.226 19610 3656 1 18 . 1 1 28 28 PHE H H 28 7.682 7.682 7.737 -0.055 19610 3657 1 18 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.481 -0.020 19610 3658 1 18 . 1 1 29 29 PRO C C 29 176.360 176.360 176.305 0.055 19610 3659 1 18 . 1 1 29 29 PRO CA C 29 62.820 62.820 62.977 -0.158 19610 3660 1 18 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.965 -0.384 19610 3661 1 18 . 1 1 30 30 LEU N N 30 123.391 123.391 121.797 1.594 19610 3662 1 18 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.611 -0.072 19610 3663 1 18 . 1 1 30 30 LEU C C 30 175.365 175.365 176.263 -0.898 19610 3664 1 18 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.422 -0.511 19610 3665 1 18 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.863 -0.190 19610 3666 1 18 . 1 1 30 30 LEU H H 30 8.284 8.284 7.688 0.596 19610 3667 1 18 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.447 -0.009 19610 3668 1 18 . 1 1 31 31 PRO C C 31 176.688 176.688 175.802 0.886 19610 3669 1 18 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.855 0.025 19610 3670 1 18 . 1 1 31 31 PRO CB C 31 32.043 32.043 29.820 2.223 19610 3671 1 18 . 1 1 32 32 VAL N N 32 120.844 120.844 124.827 -3.983 19610 3672 1 18 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.906 0.234 19610 3673 1 18 . 1 1 32 32 VAL C C 32 176.579 176.579 176.999 -0.420 19610 3674 1 18 . 1 1 32 32 VAL CA C 32 62.241 62.241 63.041 -0.800 19610 3675 1 18 . 1 1 32 32 VAL CB C 32 32.809 32.809 31.933 0.876 19610 3676 1 18 . 1 1 32 32 VAL H H 32 8.344 8.344 7.958 0.386 19610 3677 1 18 . 1 1 33 33 THR N N 33 118.041 118.041 121.367 -3.326 19610 3678 1 18 . 1 1 33 33 THR HA H 33 4.373 4.373 4.239 0.134 19610 3679 1 18 . 1 1 33 33 THR C C 33 174.172 174.172 175.322 -1.150 19610 3680 1 18 . 1 1 33 33 THR CA C 33 61.407 61.407 64.311 -2.905 19610 3681 1 18 . 1 1 33 33 THR CB C 33 69.891 69.891 69.401 0.490 19610 3682 1 18 . 1 1 33 33 THR H H 33 8.326 8.326 8.594 -0.268 19610 3683 1 18 . 1 1 34 34 ASN N N 34 121.367 121.367 116.669 4.698 19610 3684 1 18 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.769 -0.060 19610 3685 1 18 . 1 1 34 34 ASN C C 34 175.639 175.639 175.471 0.168 19610 3686 1 18 . 1 1 34 34 ASN CA C 34 53.218 53.218 52.815 0.404 19610 3687 1 18 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.987 -0.030 19610 3688 1 18 . 1 1 34 34 ASN H H 34 8.526 8.526 7.770 0.756 19610 3689 1 18 . 1 1 35 35 GLY N N 35 109.437 109.437 106.950 2.487 19610 3690 1 18 . 1 1 35 35 GLY C C 35 174.112 174.112 174.949 -0.837 19610 3691 1 18 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.372 -0.002 19610 3692 1 18 . 1 1 35 35 GLY H H 35 8.449 8.449 8.322 0.127 19610 3693 1 18 . 1 1 36 36 LYS N N 36 120.614 120.614 119.930 0.684 19610 3694 1 18 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.545 -0.242 19610 3695 1 18 . 1 1 36 36 LYS C C 36 177.182 177.182 177.507 -0.325 19610 3696 1 18 . 1 1 36 36 LYS CA C 36 56.300 56.300 55.232 1.068 19610 3697 1 18 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.915 -0.020 19610 3698 1 18 . 1 1 36 36 LYS H H 36 8.261 8.261 7.484 0.777 19610 3699 1 18 . 1 1 37 37 GLY N N 37 110.011 110.011 110.583 -0.572 19610 3700 1 18 . 1 1 37 37 GLY C C 37 173.463 173.463 174.352 -0.889 19610 3701 1 18 . 1 1 37 37 GLY CA C 37 45.122 45.122 46.173 -1.051 19610 3702 1 18 . 1 1 37 37 GLY H H 37 8.484 8.484 8.450 0.034 19610 3703 1 18 . 1 1 38 38 ARG N N 38 121.698 121.698 118.466 3.232 19610 3704 1 18 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.615 0.004 19610 3705 1 18 . 1 1 38 38 ARG C C 38 173.448 173.448 173.384 0.064 19610 3706 1 18 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.294 -0.592 19610 3707 1 18 . 1 1 38 38 ARG CB C 38 30.121 30.121 29.819 0.302 19610 3708 1 18 . 1 1 38 38 ARG H H 38 8.105 8.105 7.569 0.536 19610 3709 1 19 . 1 1 2 2 SER HA H 2 4.472 4.472 4.649 -0.177 19610 3710 1 19 . 1 1 2 2 SER C C 2 174.628 174.628 174.176 0.452 19610 3711 1 19 . 1 1 2 2 SER CA C 2 58.397 58.397 58.311 0.086 19610 3712 1 19 . 1 1 2 2 SER CB C 2 63.896 63.896 64.068 -0.172 19610 3713 1 19 . 1 1 3 3 MET N N 3 122.147 122.147 123.524 -1.377 19610 3714 1 19 . 1 1 3 3 MET HA H 3 4.490 4.490 4.366 0.124 19610 3715 1 19 . 1 1 3 3 MET C C 3 175.934 175.934 175.848 0.086 19610 3716 1 19 . 1 1 3 3 MET CA C 3 55.552 55.552 55.157 0.395 19610 3717 1 19 . 1 1 3 3 MET CB C 3 32.645 32.645 31.984 0.661 19610 3718 1 19 . 1 1 3 3 MET H H 3 8.627 8.627 7.859 0.768 19610 3719 1 19 . 1 1 4 4 ASN N N 4 119.930 119.930 123.618 -3.688 19610 3720 1 19 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.705 -0.051 19610 3721 1 19 . 1 1 4 4 ASN C C 4 174.695 174.695 174.958 -0.263 19610 3722 1 19 . 1 1 4 4 ASN CA C 4 53.237 53.237 52.812 0.425 19610 3723 1 19 . 1 1 4 4 ASN CB C 4 38.768 38.768 37.284 1.484 19610 3724 1 19 . 1 1 4 4 ASN H H 4 8.497 8.497 8.685 -0.188 19610 3725 1 19 . 1 1 5 5 GLN N N 5 121.523 121.523 122.570 -1.047 19610 3726 1 19 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.398 0.195 19610 3727 1 19 . 1 1 5 5 GLN C C 5 173.849 173.849 174.968 -1.119 19610 3728 1 19 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.218 -0.494 19610 3729 1 19 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.225 0.689 19610 3730 1 19 . 1 1 5 5 GLN H H 5 8.322 8.322 7.823 0.499 19610 3731 1 19 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.433 -0.055 19610 3732 1 19 . 1 1 6 6 PRO C C 6 176.816 176.816 176.716 0.100 19610 3733 1 19 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.565 0.592 19610 3734 1 19 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.340 -0.254 19610 3735 1 19 . 1 1 7 7 GLN N N 7 121.005 121.005 120.064 0.941 19610 3736 1 19 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.106 0.139 19610 3737 1 19 . 1 1 7 7 GLN C C 7 175.941 175.941 175.637 0.304 19610 3738 1 19 . 1 1 7 7 GLN CA C 7 55.785 55.785 56.134 -0.349 19610 3739 1 19 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.040 0.455 19610 3740 1 19 . 1 1 7 7 GLN H H 7 8.576 8.576 8.384 0.192 19610 3741 1 19 . 1 1 8 8 ARG N N 8 122.928 122.928 122.058 0.870 19610 3742 1 19 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.327 -0.040 19610 3743 1 19 . 1 1 8 8 ARG C C 8 176.061 176.061 176.826 -0.765 19610 3744 1 19 . 1 1 8 8 ARG CA C 8 55.996 55.996 55.804 0.192 19610 3745 1 19 . 1 1 8 8 ARG CB C 8 30.816 30.816 30.584 0.232 19610 3746 1 19 . 1 1 8 8 ARG H H 8 8.449 8.449 8.495 -0.046 19610 3747 1 19 . 1 1 9 9 MET N N 9 122.430 122.430 120.895 1.535 19610 3748 1 19 . 1 1 9 9 MET HA H 9 4.450 4.450 4.535 -0.085 19610 3749 1 19 . 1 1 9 9 MET C C 9 175.469 175.469 176.428 -0.959 19610 3750 1 19 . 1 1 9 9 MET CA C 9 54.941 54.941 55.362 -0.421 19610 3751 1 19 . 1 1 9 9 MET CB C 9 33.058 33.058 32.974 0.084 19610 3752 1 19 . 1 1 9 9 MET H H 9 8.471 8.471 8.413 0.058 19610 3753 1 19 . 1 1 10 10 ALA N N 10 127.153 127.153 129.520 -2.367 19610 3754 1 19 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.535 0.006 19610 3755 1 19 . 1 1 10 10 ALA C C 10 175.353 175.353 176.539 -1.186 19610 3756 1 19 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.873 -0.386 19610 3757 1 19 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.400 -0.369 19610 3758 1 19 . 1 1 10 10 ALA H H 10 8.398 8.398 8.574 -0.176 19610 3759 1 19 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.494 -0.056 19610 3760 1 19 . 1 1 11 11 PRO C C 11 176.896 176.896 176.714 0.182 19610 3761 1 19 . 1 1 11 11 PRO CA C 11 62.855 62.855 64.280 -1.425 19610 3762 1 19 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.081 -0.060 19610 3763 1 19 . 1 1 12 12 VAL N N 12 120.652 120.652 116.770 3.882 19610 3764 1 19 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.514 -0.424 19610 3765 1 19 . 1 1 12 12 VAL C C 12 176.825 176.825 174.798 2.027 19610 3766 1 19 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.885 0.518 19610 3767 1 19 . 1 1 12 12 VAL CB C 12 32.901 32.901 34.965 -2.064 19610 3768 1 19 . 1 1 12 12 VAL H H 12 8.373 8.373 7.886 0.487 19610 3769 1 19 . 1 1 13 13 GLY N N 13 112.483 112.483 111.302 1.181 19610 3770 1 19 . 1 1 13 13 GLY C C 13 174.515 174.515 175.453 -0.938 19610 3771 1 19 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.024 -0.696 19610 3772 1 19 . 1 1 13 13 GLY H H 13 8.605 8.605 8.475 0.130 19610 3773 1 19 . 1 1 14 14 THR N N 14 113.531 113.531 117.012 -3.481 19610 3774 1 19 . 1 1 14 14 THR HA H 14 4.309 4.309 4.257 0.052 19610 3775 1 19 . 1 1 14 14 THR C C 14 174.742 174.742 175.569 -0.827 19610 3776 1 19 . 1 1 14 14 THR CA C 14 62.130 62.130 64.072 -1.942 19610 3777 1 19 . 1 1 14 14 THR CB C 14 69.981 69.981 68.777 1.204 19610 3778 1 19 . 1 1 14 14 THR H H 14 8.164 8.164 8.039 0.125 19610 3779 1 19 . 1 1 15 15 ASP N N 15 122.439 122.439 120.151 2.288 19610 3780 1 19 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.414 0.096 19610 3781 1 19 . 1 1 15 15 ASP C C 15 177.216 177.216 178.209 -0.993 19610 3782 1 19 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.521 -2.259 19610 3783 1 19 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.846 -0.153 19610 3784 1 19 . 1 1 15 15 ASP H H 15 8.537 8.537 8.662 -0.125 19610 3785 1 19 . 1 1 16 16 LYS N N 16 122.807 122.807 118.562 4.245 19610 3786 1 19 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.077 0.041 19610 3787 1 19 . 1 1 16 16 LYS C C 16 177.430 177.430 178.905 -1.475 19610 3788 1 19 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.886 -0.993 19610 3789 1 19 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.876 0.663 19610 3790 1 19 . 1 1 16 16 LYS H H 16 8.288 8.288 7.545 0.743 19610 3791 1 19 . 1 1 17 17 GLU N N 17 119.492 119.492 118.709 0.783 19610 3792 1 19 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.139 -0.027 19610 3793 1 19 . 1 1 17 17 GLU C C 17 178.007 178.007 179.302 -1.295 19610 3794 1 19 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.033 -0.781 19610 3795 1 19 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.060 0.587 19610 3796 1 19 . 1 1 17 17 GLU H H 17 8.221 8.221 7.573 0.648 19610 3797 1 19 . 1 1 18 18 LEU N N 18 119.493 119.493 117.015 2.478 19610 3798 1 19 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.271 -0.124 19610 3799 1 19 . 1 1 18 18 LEU C C 18 178.359 178.359 179.295 -0.936 19610 3800 1 19 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.605 -1.183 19610 3801 1 19 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.015 0.745 19610 3802 1 19 . 1 1 18 18 LEU H H 18 7.998 7.998 7.783 0.215 19610 3803 1 19 . 1 1 19 19 SER N N 19 114.728 114.728 115.209 -0.481 19610 3804 1 19 . 1 1 19 19 SER HA H 19 4.113 4.113 4.172 -0.059 19610 3805 1 19 . 1 1 19 19 SER C C 19 175.912 175.912 176.593 -0.681 19610 3806 1 19 . 1 1 19 19 SER CA C 19 60.881 60.881 61.626 -0.745 19610 3807 1 19 . 1 1 19 19 SER CB C 19 63.043 63.043 62.912 0.131 19610 3808 1 19 . 1 1 19 19 SER H H 19 8.068 8.068 7.819 0.249 19610 3809 1 19 . 1 1 20 20 ASP N N 20 121.206 121.206 122.478 -1.272 19610 3810 1 19 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.521 -0.073 19610 3811 1 19 . 1 1 20 20 ASP C C 20 177.598 177.598 178.261 -0.663 19610 3812 1 19 . 1 1 20 20 ASP CA C 20 55.995 55.995 57.064 -1.069 19610 3813 1 19 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.919 -0.380 19610 3814 1 19 . 1 1 20 20 ASP H H 20 8.301 8.301 7.906 0.395 19610 3815 1 19 . 1 1 21 21 LEU N N 21 119.944 119.944 119.402 0.542 19610 3816 1 19 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.577 -0.435 19610 3817 1 19 . 1 1 21 21 LEU C C 21 177.822 177.822 179.252 -1.430 19610 3818 1 19 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.857 0.582 19610 3819 1 19 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.249 1.003 19610 3820 1 19 . 1 1 21 21 LEU H H 21 7.807 7.807 7.877 -0.070 19610 3821 1 19 . 1 1 22 22 LEU N N 22 119.558 119.558 121.828 -2.270 19610 3822 1 19 . 1 1 22 22 LEU HA H 22 4.076 4.076 3.999 0.077 19610 3823 1 19 . 1 1 22 22 LEU C C 22 177.131 177.131 177.918 -0.787 19610 3824 1 19 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.492 -2.437 19610 3825 1 19 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.483 0.362 19610 3826 1 19 . 1 1 22 22 LEU H H 22 7.878 7.878 7.709 0.169 19610 3827 1 19 . 1 1 23 23 ASP N N 23 119.509 119.509 118.828 0.681 19610 3828 1 19 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.252 0.212 19610 3829 1 19 . 1 1 23 23 ASP C C 23 177.379 177.379 178.815 -1.436 19610 3830 1 19 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.480 -2.553 19610 3831 1 19 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.087 0.652 19610 3832 1 19 . 1 1 23 23 ASP H H 23 7.990 7.990 7.649 0.341 19610 3833 1 19 . 1 1 24 24 PHE N N 24 121.219 121.219 117.856 3.363 19610 3834 1 19 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.328 0.138 19610 3835 1 19 . 1 1 24 24 PHE C C 24 176.875 176.875 177.760 -0.885 19610 3836 1 19 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.387 -0.158 19610 3837 1 19 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.069 0.938 19610 3838 1 19 . 1 1 24 24 PHE H H 24 8.204 8.204 7.393 0.811 19610 3839 1 19 . 1 1 25 25 SER N N 25 115.500 115.500 116.148 -0.648 19610 3840 1 19 . 1 1 25 25 SER HA H 25 4.108 4.108 4.620 -0.512 19610 3841 1 19 . 1 1 25 25 SER C C 25 175.386 175.386 176.083 -0.697 19610 3842 1 19 . 1 1 25 25 SER CA C 25 60.758 60.758 61.150 -0.392 19610 3843 1 19 . 1 1 25 25 SER CB C 25 62.998 62.998 63.420 -0.422 19610 3844 1 19 . 1 1 25 25 SER H H 25 8.326 8.326 7.872 0.454 19610 3845 1 19 . 1 1 26 26 MET N N 26 119.723 119.723 117.868 1.855 19610 3846 1 19 . 1 1 26 26 MET HA H 26 4.363 4.363 4.577 -0.214 19610 3847 1 19 . 1 1 26 26 MET C C 26 176.450 176.450 177.359 -0.909 19610 3848 1 19 . 1 1 26 26 MET CA C 26 55.949 55.949 56.572 -0.623 19610 3849 1 19 . 1 1 26 26 MET CB C 26 31.868 31.868 32.644 -0.776 19610 3850 1 19 . 1 1 26 26 MET H H 26 7.889 7.889 7.922 -0.033 19610 3851 1 19 . 1 1 27 27 MET N N 27 117.872 117.872 118.872 -1.000 19610 3852 1 19 . 1 1 27 27 MET HA H 27 4.186 4.186 4.289 -0.103 19610 3853 1 19 . 1 1 27 27 MET C C 27 175.341 175.341 177.001 -1.660 19610 3854 1 19 . 1 1 27 27 MET CA C 27 56.102 56.102 57.220 -1.118 19610 3855 1 19 . 1 1 27 27 MET CB C 27 33.161 33.161 33.246 -0.085 19610 3856 1 19 . 1 1 27 27 MET H H 27 7.656 7.656 7.369 0.287 19610 3857 1 19 . 1 1 28 28 PHE N N 28 118.702 118.702 121.266 -2.564 19610 3858 1 19 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.410 0.394 19610 3859 1 19 . 1 1 28 28 PHE C C 28 173.132 173.132 174.888 -1.756 19610 3860 1 19 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.452 -2.657 19610 3861 1 19 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.339 0.390 19610 3862 1 19 . 1 1 28 28 PHE H H 28 7.682 7.682 7.763 -0.081 19610 3863 1 19 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.489 -0.028 19610 3864 1 19 . 1 1 29 29 PRO C C 29 176.360 176.360 176.165 0.195 19610 3865 1 19 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.062 -0.242 19610 3866 1 19 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.701 -0.120 19610 3867 1 19 . 1 1 30 30 LEU N N 30 123.391 123.391 121.679 1.712 19610 3868 1 19 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.655 -0.116 19610 3869 1 19 . 1 1 30 30 LEU C C 30 175.365 175.365 176.035 -0.670 19610 3870 1 19 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.089 -0.178 19610 3871 1 19 . 1 1 30 30 LEU CB C 30 41.673 41.673 42.045 -0.373 19610 3872 1 19 . 1 1 30 30 LEU H H 30 8.284 8.284 7.678 0.606 19610 3873 1 19 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.352 0.086 19610 3874 1 19 . 1 1 31 31 PRO C C 31 176.688 176.688 175.685 1.003 19610 3875 1 19 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.945 -0.065 19610 3876 1 19 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.270 1.774 19610 3877 1 19 . 1 1 32 32 VAL N N 32 120.844 120.844 125.267 -4.423 19610 3878 1 19 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.133 0.007 19610 3879 1 19 . 1 1 32 32 VAL C C 32 176.579 176.579 176.020 0.559 19610 3880 1 19 . 1 1 32 32 VAL CA C 32 62.241 62.241 61.858 0.383 19610 3881 1 19 . 1 1 32 32 VAL CB C 32 32.809 32.809 33.229 -0.420 19610 3882 1 19 . 1 1 32 32 VAL H H 32 8.344 8.344 7.966 0.378 19610 3883 1 19 . 1 1 33 33 THR N N 33 118.041 118.041 119.311 -1.270 19610 3884 1 19 . 1 1 33 33 THR HA H 33 4.373 4.373 4.350 0.023 19610 3885 1 19 . 1 1 33 33 THR C C 33 174.172 174.172 175.272 -1.100 19610 3886 1 19 . 1 1 33 33 THR CA C 33 61.407 61.407 63.378 -1.971 19610 3887 1 19 . 1 1 33 33 THR CB C 33 69.891 69.891 69.541 0.350 19610 3888 1 19 . 1 1 33 33 THR H H 33 8.326 8.326 8.584 -0.258 19610 3889 1 19 . 1 1 34 34 ASN N N 34 121.367 121.367 118.774 2.593 19610 3890 1 19 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.899 -0.190 19610 3891 1 19 . 1 1 34 34 ASN C C 34 175.639 175.639 175.514 0.125 19610 3892 1 19 . 1 1 34 34 ASN CA C 34 53.218 53.218 52.491 0.727 19610 3893 1 19 . 1 1 34 34 ASN CB C 34 38.957 38.957 39.738 -0.781 19610 3894 1 19 . 1 1 34 34 ASN H H 34 8.526 8.526 8.261 0.265 19610 3895 1 19 . 1 1 35 35 GLY N N 35 109.437 109.437 108.908 0.529 19610 3896 1 19 . 1 1 35 35 GLY C C 35 174.112 174.112 174.538 -0.426 19610 3897 1 19 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.313 0.057 19610 3898 1 19 . 1 1 35 35 GLY H H 35 8.449 8.449 8.402 0.047 19610 3899 1 19 . 1 1 36 36 LYS N N 36 120.614 120.614 121.939 -1.325 19610 3900 1 19 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.274 0.029 19610 3901 1 19 . 1 1 36 36 LYS C C 36 177.182 177.182 177.416 -0.234 19610 3902 1 19 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.041 0.259 19610 3903 1 19 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.504 0.391 19610 3904 1 19 . 1 1 36 36 LYS H H 36 8.261 8.261 7.716 0.545 19610 3905 1 19 . 1 1 37 37 GLY N N 37 110.011 110.011 112.798 -2.787 19610 3906 1 19 . 1 1 37 37 GLY C C 37 173.463 173.463 173.771 -0.308 19610 3907 1 19 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.161 -0.039 19610 3908 1 19 . 1 1 37 37 GLY H H 37 8.484 8.484 8.492 -0.008 19610 3909 1 19 . 1 1 38 38 ARG N N 38 121.698 121.698 118.820 2.878 19610 3910 1 19 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.631 -0.012 19610 3911 1 19 . 1 1 38 38 ARG C C 38 173.448 173.448 173.302 0.146 19610 3912 1 19 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.025 -0.323 19610 3913 1 19 . 1 1 38 38 ARG CB C 38 30.121 30.121 31.347 -1.226 19610 3914 1 19 . 1 1 38 38 ARG H H 38 8.105 8.105 7.915 0.190 19610 3915 1 20 . 1 1 2 2 SER HA H 2 4.472 4.472 4.761 -0.289 19610 3916 1 20 . 1 1 2 2 SER C C 2 174.628 174.628 173.801 0.827 19610 3917 1 20 . 1 1 2 2 SER CA C 2 58.397 58.397 58.112 0.285 19610 3918 1 20 . 1 1 2 2 SER CB C 2 63.896 63.896 63.259 0.637 19610 3919 1 20 . 1 1 3 3 MET N N 3 122.147 122.147 123.301 -1.154 19610 3920 1 20 . 1 1 3 3 MET HA H 3 4.490 4.490 4.731 -0.241 19610 3921 1 20 . 1 1 3 3 MET C C 3 175.934 175.934 175.429 0.505 19610 3922 1 20 . 1 1 3 3 MET CA C 3 55.552 55.552 55.204 0.348 19610 3923 1 20 . 1 1 3 3 MET CB C 3 32.645 32.645 32.523 0.123 19610 3924 1 20 . 1 1 3 3 MET H H 3 8.627 8.627 8.338 0.289 19610 3925 1 20 . 1 1 4 4 ASN N N 4 119.930 119.930 124.093 -4.163 19610 3926 1 20 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.862 -0.208 19610 3927 1 20 . 1 1 4 4 ASN C C 4 174.695 174.695 174.756 -0.061 19610 3928 1 20 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.138 0.099 19610 3929 1 20 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.523 0.245 19610 3930 1 20 . 1 1 4 4 ASN H H 4 8.497 8.497 8.654 -0.157 19610 3931 1 20 . 1 1 5 5 GLN N N 5 121.523 121.523 122.006 -0.483 19610 3932 1 20 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.479 0.114 19610 3933 1 20 . 1 1 5 5 GLN C C 5 173.849 173.849 174.723 -0.874 19610 3934 1 20 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.672 -0.948 19610 3935 1 20 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.047 0.867 19610 3936 1 20 . 1 1 5 5 GLN H H 5 8.322 8.322 8.295 0.027 19610 3937 1 20 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.471 -0.093 19610 3938 1 20 . 1 1 6 6 PRO C C 6 176.816 176.816 176.667 0.149 19610 3939 1 20 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.360 0.797 19610 3940 1 20 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.303 -0.217 19610 3941 1 20 . 1 1 7 7 GLN N N 7 121.005 121.005 118.496 2.509 19610 3942 1 20 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.190 0.055 19610 3943 1 20 . 1 1 7 7 GLN C C 7 175.941 175.941 175.859 0.082 19610 3944 1 20 . 1 1 7 7 GLN CA C 7 55.785 55.785 56.137 -0.352 19610 3945 1 20 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.412 0.083 19610 3946 1 20 . 1 1 7 7 GLN H H 7 8.576 8.576 8.361 0.215 19610 3947 1 20 . 1 1 8 8 ARG N N 8 122.928 122.928 122.271 0.657 19610 3948 1 20 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.271 0.016 19610 3949 1 20 . 1 1 8 8 ARG C C 8 176.061 176.061 176.363 -0.302 19610 3950 1 20 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.063 -0.067 19610 3951 1 20 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.097 1.719 19610 3952 1 20 . 1 1 8 8 ARG H H 8 8.449 8.449 8.608 -0.159 19610 3953 1 20 . 1 1 9 9 MET N N 9 122.430 122.430 122.214 0.216 19610 3954 1 20 . 1 1 9 9 MET HA H 9 4.450 4.450 4.555 -0.105 19610 3955 1 20 . 1 1 9 9 MET C C 9 175.469 175.469 176.181 -0.712 19610 3956 1 20 . 1 1 9 9 MET CA C 9 54.941 54.941 54.147 0.794 19610 3957 1 20 . 1 1 9 9 MET CB C 9 33.058 33.058 33.122 -0.064 19610 3958 1 20 . 1 1 9 9 MET H H 9 8.471 8.471 8.233 0.238 19610 3959 1 20 . 1 1 10 10 ALA N N 10 127.153 127.153 126.547 0.606 19610 3960 1 20 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.460 0.081 19610 3961 1 20 . 1 1 10 10 ALA C C 10 175.353 175.353 176.692 -1.339 19610 3962 1 20 . 1 1 10 10 ALA CA C 10 50.487 50.487 51.053 -0.566 19610 3963 1 20 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.304 -0.273 19610 3964 1 20 . 1 1 10 10 ALA H H 10 8.398 8.398 8.320 0.078 19610 3965 1 20 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.366 0.072 19610 3966 1 20 . 1 1 11 11 PRO C C 11 176.896 176.896 176.260 0.636 19610 3967 1 20 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.942 -1.087 19610 3968 1 20 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.230 -0.209 19610 3969 1 20 . 1 1 12 12 VAL N N 12 120.652 120.652 114.625 6.027 19610 3970 1 20 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.097 -0.007 19610 3971 1 20 . 1 1 12 12 VAL C C 12 176.825 176.825 174.405 2.420 19610 3972 1 20 . 1 1 12 12 VAL CA C 12 62.403 62.403 60.572 1.831 19610 3973 1 20 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.675 -0.774 19610 3974 1 20 . 1 1 12 12 VAL H H 12 8.373 8.373 7.564 0.809 19610 3975 1 20 . 1 1 13 13 GLY N N 13 112.483 112.483 111.935 0.548 19610 3976 1 20 . 1 1 13 13 GLY C C 13 174.515 174.515 174.952 -0.437 19610 3977 1 20 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.343 -1.016 19610 3978 1 20 . 1 1 13 13 GLY H H 13 8.605 8.605 8.204 0.401 19610 3979 1 20 . 1 1 14 14 THR N N 14 113.531 113.531 117.598 -4.067 19610 3980 1 20 . 1 1 14 14 THR HA H 14 4.309 4.309 4.447 -0.138 19610 3981 1 20 . 1 1 14 14 THR C C 14 174.742 174.742 176.178 -1.436 19610 3982 1 20 . 1 1 14 14 THR CA C 14 62.130 62.130 64.043 -1.913 19610 3983 1 20 . 1 1 14 14 THR CB C 14 69.981 69.981 68.904 1.077 19610 3984 1 20 . 1 1 14 14 THR H H 14 8.164 8.164 8.146 0.018 19610 3985 1 20 . 1 1 15 15 ASP N N 15 122.439 122.439 119.516 2.923 19610 3986 1 20 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.433 0.077 19610 3987 1 20 . 1 1 15 15 ASP C C 15 177.216 177.216 178.448 -1.232 19610 3988 1 20 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.802 -2.540 19610 3989 1 20 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.799 -0.106 19610 3990 1 20 . 1 1 15 15 ASP H H 15 8.537 8.537 8.625 -0.088 19610 3991 1 20 . 1 1 16 16 LYS N N 16 122.807 122.807 118.761 4.046 19610 3992 1 20 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.068 0.050 19610 3993 1 20 . 1 1 16 16 LYS C C 16 177.430 177.430 179.204 -1.774 19610 3994 1 20 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.746 -0.853 19610 3995 1 20 . 1 1 16 16 LYS CB C 16 32.539 32.539 32.157 0.382 19610 3996 1 20 . 1 1 16 16 LYS H H 16 8.288 8.288 7.535 0.753 19610 3997 1 20 . 1 1 17 17 GLU N N 17 119.492 119.492 119.205 0.287 19610 3998 1 20 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.200 -0.088 19610 3999 1 20 . 1 1 17 17 GLU C C 17 178.007 178.007 179.129 -1.122 19610 4000 1 20 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.200 -0.948 19610 4001 1 20 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.740 -0.093 19610 4002 1 20 . 1 1 17 17 GLU H H 17 8.221 8.221 7.843 0.378 19610 4003 1 20 . 1 1 18 18 LEU N N 18 119.493 119.493 116.714 2.779 19610 4004 1 20 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.166 -0.019 19610 4005 1 20 . 1 1 18 18 LEU C C 18 178.359 178.359 178.712 -0.353 19610 4006 1 20 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.704 -1.282 19610 4007 1 20 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.125 0.635 19610 4008 1 20 . 1 1 18 18 LEU H H 18 7.998 7.998 7.984 0.014 19610 4009 1 20 . 1 1 19 19 SER N N 19 114.728 114.728 115.723 -0.995 19610 4010 1 20 . 1 1 19 19 SER HA H 19 4.113 4.113 4.136 -0.023 19610 4011 1 20 . 1 1 19 19 SER C C 19 175.912 175.912 176.525 -0.613 19610 4012 1 20 . 1 1 19 19 SER CA C 19 60.881 60.881 62.047 -1.166 19610 4013 1 20 . 1 1 19 19 SER CB C 19 63.043 63.043 62.626 0.417 19610 4014 1 20 . 1 1 19 19 SER H H 19 8.068 8.068 7.917 0.151 19610 4015 1 20 . 1 1 20 20 ASP N N 20 121.206 121.206 121.646 -0.440 19610 4016 1 20 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.295 0.153 19610 4017 1 20 . 1 1 20 20 ASP C C 20 177.598 177.598 178.271 -0.673 19610 4018 1 20 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.685 -0.690 19610 4019 1 20 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.536 0.003 19610 4020 1 20 . 1 1 20 20 ASP H H 20 8.301 8.301 7.705 0.596 19610 4021 1 20 . 1 1 21 21 LEU N N 21 119.944 119.944 119.796 0.148 19610 4022 1 20 . 1 1 21 21 LEU HA H 21 4.142 4.142 3.856 0.286 19610 4023 1 20 . 1 1 21 21 LEU C C 21 177.822 177.822 178.117 -0.295 19610 4024 1 20 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.296 1.143 19610 4025 1 20 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.165 1.087 19610 4026 1 20 . 1 1 21 21 LEU H H 21 7.807 7.807 7.940 -0.133 19610 4027 1 20 . 1 1 22 22 LEU N N 22 119.558 119.558 121.453 -1.895 19610 4028 1 20 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.006 0.070 19610 4029 1 20 . 1 1 22 22 LEU C C 22 177.131 177.131 178.306 -1.175 19610 4030 1 20 . 1 1 22 22 LEU CA C 22 56.055 56.055 57.864 -1.809 19610 4031 1 20 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.729 0.115 19610 4032 1 20 . 1 1 22 22 LEU H H 22 7.878 7.878 7.706 0.172 19610 4033 1 20 . 1 1 23 23 ASP N N 23 119.509 119.509 119.476 0.033 19610 4034 1 20 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.354 0.110 19610 4035 1 20 . 1 1 23 23 ASP C C 23 177.379 177.379 178.036 -0.657 19610 4036 1 20 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.335 -2.408 19610 4037 1 20 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.749 -0.010 19610 4038 1 20 . 1 1 23 23 ASP H H 23 7.990 7.990 7.741 0.249 19610 4039 1 20 . 1 1 24 24 PHE N N 24 121.219 121.219 116.485 4.734 19610 4040 1 20 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.527 -0.061 19610 4041 1 20 . 1 1 24 24 PHE C C 24 176.875 176.875 177.460 -0.585 19610 4042 1 20 . 1 1 24 24 PHE CA C 24 59.229 59.229 58.496 0.733 19610 4043 1 20 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.486 0.521 19610 4044 1 20 . 1 1 24 24 PHE H H 24 8.204 8.204 7.308 0.896 19610 4045 1 20 . 1 1 25 25 SER N N 25 115.500 115.500 117.213 -1.713 19610 4046 1 20 . 1 1 25 25 SER HA H 25 4.108 4.108 4.696 -0.588 19610 4047 1 20 . 1 1 25 25 SER C C 25 175.386 175.386 176.494 -1.108 19610 4048 1 20 . 1 1 25 25 SER CA C 25 60.758 60.758 61.606 -0.848 19610 4049 1 20 . 1 1 25 25 SER CB C 25 62.998 62.998 63.000 -0.002 19610 4050 1 20 . 1 1 25 25 SER H H 25 8.326 8.326 8.237 0.089 19610 4051 1 20 . 1 1 26 26 MET N N 26 119.723 119.723 117.630 2.093 19610 4052 1 20 . 1 1 26 26 MET HA H 26 4.363 4.363 4.482 -0.119 19610 4053 1 20 . 1 1 26 26 MET C C 26 176.450 176.450 177.358 -0.908 19610 4054 1 20 . 1 1 26 26 MET CA C 26 55.949 55.949 56.981 -1.032 19610 4055 1 20 . 1 1 26 26 MET CB C 26 31.868 31.868 32.740 -0.872 19610 4056 1 20 . 1 1 26 26 MET H H 26 7.889 7.889 8.029 -0.140 19610 4057 1 20 . 1 1 27 27 MET N N 27 117.872 117.872 119.058 -1.186 19610 4058 1 20 . 1 1 27 27 MET HA H 27 4.186 4.186 4.389 -0.203 19610 4059 1 20 . 1 1 27 27 MET C C 27 175.341 175.341 176.544 -1.203 19610 4060 1 20 . 1 1 27 27 MET CA C 27 56.102 56.102 55.783 0.319 19610 4061 1 20 . 1 1 27 27 MET CB C 27 33.161 33.161 32.852 0.309 19610 4062 1 20 . 1 1 27 27 MET H H 27 7.656 7.656 7.524 0.132 19610 4063 1 20 . 1 1 28 28 PHE N N 28 118.702 118.702 122.189 -3.487 19610 4064 1 20 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.373 0.431 19610 4065 1 20 . 1 1 28 28 PHE C C 28 173.132 173.132 175.058 -1.926 19610 4066 1 20 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.837 -3.042 19610 4067 1 20 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.289 0.440 19610 4068 1 20 . 1 1 28 28 PHE H H 28 7.682 7.682 7.818 -0.136 19610 4069 1 20 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.417 0.044 19610 4070 1 20 . 1 1 29 29 PRO C C 29 176.360 176.360 176.486 -0.126 19610 4071 1 20 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.201 -0.381 19610 4072 1 20 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.959 -0.378 19610 4073 1 20 . 1 1 30 30 LEU N N 30 123.391 123.391 121.644 1.747 19610 4074 1 20 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.503 0.036 19610 4075 1 20 . 1 1 30 30 LEU C C 30 175.365 175.365 175.923 -0.558 19610 4076 1 20 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.403 -0.492 19610 4077 1 20 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.759 -0.086 19610 4078 1 20 . 1 1 30 30 LEU H H 30 8.284 8.284 7.703 0.581 19610 4079 1 20 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.368 0.070 19610 4080 1 20 . 1 1 31 31 PRO C C 31 176.688 176.688 175.967 0.721 19610 4081 1 20 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.806 0.074 19610 4082 1 20 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.761 1.282 19610 4083 1 20 . 1 1 32 32 VAL N N 32 120.844 120.844 126.485 -5.641 19610 4084 1 20 . 1 1 32 32 VAL HA H 32 4.140 4.140 3.977 0.163 19610 4085 1 20 . 1 1 32 32 VAL C C 32 176.579 176.579 176.937 -0.358 19610 4086 1 20 . 1 1 32 32 VAL CA C 32 62.241 62.241 63.171 -0.930 19610 4087 1 20 . 1 1 32 32 VAL CB C 32 32.809 32.809 31.690 1.119 19610 4088 1 20 . 1 1 32 32 VAL H H 32 8.344 8.344 8.023 0.321 19610 4089 1 20 . 1 1 33 33 THR N N 33 118.041 118.041 118.770 -0.729 19610 4090 1 20 . 1 1 33 33 THR HA H 33 4.373 4.373 4.254 0.119 19610 4091 1 20 . 1 1 33 33 THR C C 33 174.172 174.172 174.721 -0.549 19610 4092 1 20 . 1 1 33 33 THR CA C 33 61.407 61.407 62.004 -0.597 19610 4093 1 20 . 1 1 33 33 THR CB C 33 69.891 69.891 69.264 0.627 19610 4094 1 20 . 1 1 33 33 THR H H 33 8.326 8.326 8.673 -0.347 19610 4095 1 20 . 1 1 34 34 ASN N N 34 121.367 121.367 115.432 5.935 19610 4096 1 20 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.460 0.249 19610 4097 1 20 . 1 1 34 34 ASN C C 34 175.639 175.639 175.659 -0.020 19610 4098 1 20 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.886 -0.668 19610 4099 1 20 . 1 1 34 34 ASN CB C 34 38.957 38.957 37.026 1.931 19610 4100 1 20 . 1 1 34 34 ASN H H 34 8.526 8.526 8.226 0.300 19610 4101 1 20 . 1 1 35 35 GLY N N 35 109.437 109.437 107.075 2.362 19610 4102 1 20 . 1 1 35 35 GLY C C 35 174.112 174.112 174.057 0.055 19610 4103 1 20 . 1 1 35 35 GLY CA C 35 45.370 45.370 46.171 -0.801 19610 4104 1 20 . 1 1 35 35 GLY H H 35 8.449 8.449 8.445 0.004 19610 4105 1 20 . 1 1 36 36 LYS N N 36 120.614 120.614 120.716 -0.102 19610 4106 1 20 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.426 -0.123 19610 4107 1 20 . 1 1 36 36 LYS C C 36 177.182 177.182 175.398 1.784 19610 4108 1 20 . 1 1 36 36 LYS CA C 36 56.300 56.300 56.344 -0.044 19610 4109 1 20 . 1 1 36 36 LYS CB C 36 32.895 32.895 33.080 -0.185 19610 4110 1 20 . 1 1 36 36 LYS H H 36 8.261 8.261 7.701 0.560 19610 4111 1 20 . 1 1 37 37 GLY N N 37 110.011 110.011 112.858 -2.847 19610 4112 1 20 . 1 1 37 37 GLY C C 37 173.463 173.463 174.400 -0.937 19610 4113 1 20 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.524 -0.402 19610 4114 1 20 . 1 1 37 37 GLY H H 37 8.484 8.484 8.516 -0.032 19610 4115 1 20 . 1 1 38 38 ARG N N 38 121.698 121.698 121.718 -0.020 19610 4116 1 20 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.717 -0.098 19610 4117 1 20 . 1 1 38 38 ARG C C 38 173.448 173.448 174.506 -1.058 19610 4118 1 20 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.648 -0.946 19610 4119 1 20 . 1 1 38 38 ARG CB C 38 30.121 30.121 31.135 -1.014 19610 4120 1 20 . 1 1 38 38 ARG H H 38 8.105 8.105 8.488 -0.383 19610 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 32 2.364 0.091 2.400 19610 2 1 1 "Average Difference" HA 37 0.206 -0.002 0.209 19610 3 1 1 "Average Difference" C 37 0.910 0.442 0.806 19610 4 1 1 "Average Difference" CA 37 1.151 0.620 0.983 19610 5 1 1 "Average Difference" CB 34 1.024 -0.304 0.993 19610 6 1 1 "Average Difference" HN 32 0.363 -0.211 0.301 19610 7 1 2 "Average Difference" N 32 2.326 -0.229 2.352 19610 8 1 2 "Average Difference" HA 37 0.180 0.002 0.182 19610 9 1 2 "Average Difference" C 37 0.951 0.394 0.877 19610 10 1 2 "Average Difference" CA 37 1.005 0.596 0.821 19610 11 1 2 "Average Difference" CB 34 0.837 -0.182 0.830 19610 12 1 2 "Average Difference" HN 32 0.400 -0.208 0.347 19610 13 1 3 "Average Difference" N 32 2.126 -0.416 2.118 19610 14 1 3 "Average Difference" HA 37 0.172 -0.001 0.174 19610 15 1 3 "Average Difference" C 37 0.940 0.383 0.870 19610 16 1 3 "Average Difference" CA 37 1.114 0.587 0.960 19610 17 1 3 "Average Difference" CB 34 0.830 -0.207 0.816 19610 18 1 3 "Average Difference" HN 32 0.422 -0.282 0.318 19610 19 1 4 "Average Difference" N 32 2.500 -0.340 2.516 19610 20 1 4 "Average Difference" HA 37 0.204 0.011 0.206 19610 21 1 4 "Average Difference" C 37 0.836 0.402 0.743 19610 22 1 4 "Average Difference" CA 37 1.165 0.526 1.054 19610 23 1 4 "Average Difference" CB 34 0.853 -0.265 0.823 19610 24 1 4 "Average Difference" HN 32 0.443 -0.286 0.344 19610 25 1 5 "Average Difference" N 32 2.421 -0.116 2.457 19610 26 1 5 "Average Difference" HA 37 0.178 -0.004 0.180 19610 27 1 5 "Average Difference" C 37 0.848 0.433 0.739 19610 28 1 5 "Average Difference" CA 37 1.170 0.623 1.004 19610 29 1 5 "Average Difference" CB 34 0.718 -0.185 0.705 19610 30 1 5 "Average Difference" HN 32 0.384 -0.235 0.309 19610 31 1 6 "Average Difference" N 32 2.875 -0.222 2.912 19610 32 1 6 "Average Difference" HA 37 0.189 -0.009 0.192 19610 33 1 6 "Average Difference" C 37 0.883 0.388 0.804 19610 34 1 6 "Average Difference" CA 37 1.175 0.595 1.027 19610 35 1 6 "Average Difference" CB 34 0.780 -0.268 0.744 19610 36 1 6 "Average Difference" HN 32 0.377 -0.194 0.329 19610 37 1 7 "Average Difference" N 32 2.475 0.112 2.512 19610 38 1 7 "Average Difference" HA 37 0.184 0.008 0.186 19610 39 1 7 "Average Difference" C 37 0.890 0.509 0.741 19610 40 1 7 "Average Difference" CA 37 1.204 0.605 1.056 19610 41 1 7 "Average Difference" CB 34 0.703 -0.269 0.659 19610 42 1 7 "Average Difference" HN 32 0.399 -0.226 0.333 19610 43 1 8 "Average Difference" N 32 2.490 -0.301 2.511 19610 44 1 8 "Average Difference" HA 37 0.212 -0.037 0.211 19610 45 1 8 "Average Difference" C 37 0.970 0.447 0.873 19610 46 1 8 "Average Difference" CA 37 1.146 0.693 0.925 19610 47 1 8 "Average Difference" CB 34 1.107 -0.334 1.072 19610 48 1 8 "Average Difference" HN 32 0.401 -0.245 0.323 19610 49 1 9 "Average Difference" N 32 2.101 -0.161 2.128 19610 50 1 9 "Average Difference" HA 37 0.214 0.029 0.215 19610 51 1 9 "Average Difference" C 37 0.973 0.497 0.848 19610 52 1 9 "Average Difference" CA 37 1.139 0.429 1.069 19610 53 1 9 "Average Difference" CB 34 0.808 -0.247 0.781 19610 54 1 9 "Average Difference" HN 32 0.400 -0.281 0.289 19610 55 1 10 "Average Difference" N 32 2.241 -0.589 2.196 19610 56 1 10 "Average Difference" HA 37 0.204 -0.013 0.206 19610 57 1 10 "Average Difference" C 37 0.926 0.467 0.810 19610 58 1 10 "Average Difference" CA 37 1.032 0.463 0.935 19610 59 1 10 "Average Difference" CB 34 0.889 -0.326 0.840 19610 60 1 10 "Average Difference" HN 32 0.407 -0.253 0.324 19610 61 1 11 "Average Difference" N 32 2.265 0.005 2.301 19610 62 1 11 "Average Difference" HA 37 0.159 0.007 0.161 19610 63 1 11 "Average Difference" C 37 0.924 0.437 0.826 19610 64 1 11 "Average Difference" CA 37 1.202 0.609 1.051 19610 65 1 11 "Average Difference" CB 34 0.925 -0.272 0.897 19610 66 1 11 "Average Difference" HN 32 0.335 -0.189 0.281 19610 67 1 12 "Average Difference" N 32 2.706 0.562 2.689 19610 68 1 12 "Average Difference" HA 37 0.195 0.015 0.197 19610 69 1 12 "Average Difference" C 37 0.962 0.514 0.824 19610 70 1 12 "Average Difference" CA 37 1.167 0.482 1.077 19610 71 1 12 "Average Difference" CB 34 0.952 -0.339 0.902 19610 72 1 12 "Average Difference" HN 32 0.424 -0.275 0.329 19610 73 1 13 "Average Difference" N 32 2.469 -0.251 2.496 19610 74 1 13 "Average Difference" HA 37 0.214 -0.010 0.216 19610 75 1 13 "Average Difference" C 37 1.039 0.493 0.928 19610 76 1 13 "Average Difference" CA 37 1.247 0.711 1.039 19610 77 1 13 "Average Difference" CB 34 0.821 -0.309 0.772 19610 78 1 13 "Average Difference" HN 32 0.392 -0.176 0.355 19610 79 1 14 "Average Difference" N 32 2.579 -0.134 2.617 19610 80 1 14 "Average Difference" HA 37 0.202 -0.030 0.202 19610 81 1 14 "Average Difference" C 37 0.901 0.446 0.794 19610 82 1 14 "Average Difference" CA 37 1.155 0.678 0.948 19610 83 1 14 "Average Difference" CB 34 0.762 -0.227 0.738 19610 84 1 14 "Average Difference" HN 32 0.387 -0.235 0.312 19610 85 1 15 "Average Difference" N 32 2.634 -0.055 2.676 19610 86 1 15 "Average Difference" HA 37 0.205 0.023 0.206 19610 87 1 15 "Average Difference" C 37 0.934 0.367 0.871 19610 88 1 15 "Average Difference" CA 37 1.096 0.619 0.917 19610 89 1 15 "Average Difference" CB 34 0.755 -0.193 0.740 19610 90 1 15 "Average Difference" HN 32 0.382 -0.185 0.340 19610 91 1 16 "Average Difference" N 32 2.329 -0.168 2.360 19610 92 1 16 "Average Difference" HA 37 0.211 0.029 0.211 19610 93 1 16 "Average Difference" C 37 0.904 0.370 0.836 19610 94 1 16 "Average Difference" CA 37 1.095 0.613 0.920 19610 95 1 16 "Average Difference" CB 34 0.980 -0.302 0.947 19610 96 1 16 "Average Difference" HN 32 0.374 -0.203 0.319 19610 97 1 17 "Average Difference" N 32 2.436 -0.123 2.472 19610 98 1 17 "Average Difference" HA 37 0.173 -0.022 0.174 19610 99 1 17 "Average Difference" C 37 0.974 0.370 0.914 19610 100 1 17 "Average Difference" CA 37 1.118 0.611 0.949 19610 101 1 17 "Average Difference" CB 34 0.739 -0.097 0.744 19610 102 1 17 "Average Difference" HN 32 0.391 -0.211 0.334 19610 103 1 18 "Average Difference" N 32 2.380 -0.514 2.361 19610 104 1 18 "Average Difference" HA 37 0.171 0.002 0.173 19610 105 1 18 "Average Difference" C 37 1.037 0.605 0.854 19610 106 1 18 "Average Difference" CA 37 1.242 0.728 1.020 19610 107 1 18 "Average Difference" CB 34 0.699 -0.268 0.656 19610 108 1 18 "Average Difference" HN 32 0.432 -0.313 0.304 19610 109 1 19 "Average Difference" N 32 2.265 -0.074 2.300 19610 110 1 19 "Average Difference" HA 37 0.179 0.024 0.180 19610 111 1 19 "Average Difference" C 37 0.943 0.519 0.798 19610 112 1 19 "Average Difference" CA 37 1.094 0.575 0.943 19610 113 1 19 "Average Difference" CB 34 0.769 -0.151 0.765 19610 114 1 19 "Average Difference" HN 32 0.377 -0.238 0.297 19610 115 1 20 "Average Difference" N 32 2.763 -0.273 2.794 19610 116 1 20 "Average Difference" HA 37 0.178 0.004 0.181 19610 117 1 20 "Average Difference" C 37 0.979 0.411 0.900 19610 118 1 20 "Average Difference" CA 37 1.156 0.578 1.014 19610 119 1 20 "Average Difference" CB 34 0.720 -0.275 0.675 19610 120 1 20 "Average Difference" HN 32 0.364 -0.178 0.323 19610 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 19610 _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 HA H 2 4.472 4.472 4.544 -0.072 19610 2 1 . 1 1 2 2 SER C C 2 174.628 174.628 174.624 0.004 19610 3 1 . 1 1 2 2 SER CA C 2 58.397 58.397 58.417 -0.020 19610 4 1 . 1 1 2 2 SER CB C 2 63.896 63.896 63.562 0.334 19610 5 1 . 1 1 3 3 MET N N 3 122.147 122.147 122.821 -0.674 19610 6 1 . 1 1 3 3 MET HA H 3 4.490 4.490 4.459 0.031 19610 7 1 . 1 1 3 3 MET C C 3 175.934 175.934 175.510 0.424 19610 8 1 . 1 1 3 3 MET CA C 3 55.552 55.552 55.225 0.327 19610 9 1 . 1 1 3 3 MET CB C 3 32.645 32.645 32.308 0.337 19610 10 1 . 1 1 3 3 MET H H 3 8.627 8.627 8.218 0.409 19610 11 1 . 1 1 4 4 ASN N N 4 119.930 119.930 121.385 -1.455 19610 12 1 . 1 1 4 4 ASN HA H 4 4.654 4.654 4.784 -0.130 19610 13 1 . 1 1 4 4 ASN C C 4 174.695 174.695 174.366 0.329 19610 14 1 . 1 1 4 4 ASN CA C 4 53.237 53.237 53.194 0.043 19610 15 1 . 1 1 4 4 ASN CB C 4 38.768 38.768 38.946 -0.178 19610 16 1 . 1 1 4 4 ASN H H 4 8.497 8.497 8.375 0.122 19610 17 1 . 1 1 5 5 GLN N N 5 121.523 121.523 123.028 -1.504 19610 18 1 . 1 1 5 5 GLN HA H 5 4.593 4.593 4.582 0.011 19610 19 1 . 1 1 5 5 GLN C C 5 173.849 173.849 174.506 -0.657 19610 20 1 . 1 1 5 5 GLN CA C 5 53.724 53.724 54.195 -0.471 19610 21 1 . 1 1 5 5 GLN CB C 5 28.914 28.914 28.605 0.309 19610 22 1 . 1 1 5 5 GLN H H 5 8.322 8.322 8.266 0.056 19610 23 1 . 1 1 6 6 PRO HA H 6 4.378 4.378 4.423 -0.045 19610 24 1 . 1 1 6 6 PRO C C 6 176.816 176.816 176.502 0.314 19610 25 1 . 1 1 6 6 PRO CA C 6 63.157 63.157 62.578 0.579 19610 26 1 . 1 1 6 6 PRO CB C 6 32.086 32.086 32.222 -0.136 19610 27 1 . 1 1 7 7 GLN N N 7 121.005 121.005 119.059 1.946 19610 28 1 . 1 1 7 7 GLN HA H 7 4.245 4.245 4.193 0.052 19610 29 1 . 1 1 7 7 GLN C C 7 175.941 175.941 175.919 0.022 19610 30 1 . 1 1 7 7 GLN CA C 7 55.785 55.785 55.771 0.014 19610 31 1 . 1 1 7 7 GLN CB C 7 29.495 29.495 29.159 0.336 19610 32 1 . 1 1 7 7 GLN H H 7 8.576 8.576 8.299 0.277 19610 33 1 . 1 1 8 8 ARG N N 8 122.928 122.928 121.702 1.226 19610 34 1 . 1 1 8 8 ARG HA H 8 4.287 4.287 4.236 0.051 19610 35 1 . 1 1 8 8 ARG C C 8 176.061 176.061 176.374 -0.313 19610 36 1 . 1 1 8 8 ARG CA C 8 55.996 55.996 56.219 -0.223 19610 37 1 . 1 1 8 8 ARG CB C 8 30.816 30.816 29.778 1.038 19610 38 1 . 1 1 8 8 ARG H H 8 8.449 8.449 8.532 -0.083 19610 39 1 . 1 1 9 9 MET N N 9 122.430 122.430 122.179 0.251 19610 40 1 . 1 1 9 9 MET HA H 9 4.450 4.450 4.537 -0.087 19610 41 1 . 1 1 9 9 MET C C 9 175.469 175.469 176.307 -0.838 19610 42 1 . 1 1 9 9 MET CA C 9 54.941 54.941 55.215 -0.274 19610 43 1 . 1 1 9 9 MET CB C 9 33.058 33.058 33.091 -0.033 19610 44 1 . 1 1 9 9 MET H H 9 8.471 8.471 8.265 0.206 19610 45 1 . 1 1 10 10 ALA N N 10 127.153 127.153 127.041 0.112 19610 46 1 . 1 1 10 10 ALA HA H 10 4.541 4.541 4.504 0.037 19610 47 1 . 1 1 10 10 ALA C C 10 175.353 175.353 176.626 -1.273 19610 48 1 . 1 1 10 10 ALA CA C 10 50.487 50.487 50.771 -0.284 19610 49 1 . 1 1 10 10 ALA CB C 10 18.031 18.031 18.596 -0.565 19610 50 1 . 1 1 10 10 ALA H H 10 8.398 8.398 8.353 0.045 19610 51 1 . 1 1 11 11 PRO HA H 11 4.438 4.438 4.400 0.038 19610 52 1 . 1 1 11 11 PRO C C 11 176.896 176.896 176.679 0.217 19610 53 1 . 1 1 11 11 PRO CA C 11 62.855 62.855 63.890 -1.035 19610 54 1 . 1 1 11 11 PRO CB C 11 32.021 32.021 32.231 -0.210 19610 55 1 . 1 1 12 12 VAL N N 12 120.652 120.652 116.656 3.996 19610 56 1 . 1 1 12 12 VAL HA H 12 4.090 4.090 4.248 -0.158 19610 57 1 . 1 1 12 12 VAL C C 12 176.825 176.825 174.876 1.949 19610 58 1 . 1 1 12 12 VAL CA C 12 62.403 62.403 61.389 1.014 19610 59 1 . 1 1 12 12 VAL CB C 12 32.901 32.901 33.933 -1.032 19610 60 1 . 1 1 12 12 VAL H H 12 8.373 8.373 7.569 0.804 19610 61 1 . 1 1 13 13 GLY N N 13 112.483 112.483 112.749 -0.266 19610 62 1 . 1 1 13 13 GLY C C 13 174.515 174.515 175.083 -0.568 19610 63 1 . 1 1 13 13 GLY CA C 13 45.328 45.328 46.018 -0.691 19610 64 1 . 1 1 13 13 GLY H H 13 8.605 8.605 8.350 0.255 19610 65 1 . 1 1 14 14 THR N N 14 113.531 113.531 116.954 -3.423 19610 66 1 . 1 1 14 14 THR HA H 14 4.309 4.309 4.261 0.048 19610 67 1 . 1 1 14 14 THR C C 14 174.742 174.742 175.526 -0.784 19610 68 1 . 1 1 14 14 THR CA C 14 62.130 62.130 64.299 -2.169 19610 69 1 . 1 1 14 14 THR CB C 14 69.981 69.981 68.776 1.205 19610 70 1 . 1 1 14 14 THR H H 14 8.164 8.164 8.136 0.028 19610 71 1 . 1 1 15 15 ASP N N 15 122.439 122.439 120.359 2.080 19610 72 1 . 1 1 15 15 ASP HA H 15 4.510 4.510 4.414 0.096 19610 73 1 . 1 1 15 15 ASP C C 15 177.216 177.216 178.269 -1.053 19610 74 1 . 1 1 15 15 ASP CA C 15 55.262 55.262 57.592 -2.330 19610 75 1 . 1 1 15 15 ASP CB C 15 40.693 40.693 40.754 -0.061 19610 76 1 . 1 1 15 15 ASP H H 15 8.537 8.537 8.652 -0.115 19610 77 1 . 1 1 16 16 LYS N N 16 122.807 122.807 118.356 4.451 19610 78 1 . 1 1 16 16 LYS HA H 16 4.118 4.118 4.114 0.004 19610 79 1 . 1 1 16 16 LYS C C 16 177.430 177.430 179.172 -1.742 19610 80 1 . 1 1 16 16 LYS CA C 16 57.893 57.893 58.515 -0.622 19610 81 1 . 1 1 16 16 LYS CB C 16 32.539 32.539 31.979 0.560 19610 82 1 . 1 1 16 16 LYS H H 16 8.288 8.288 7.548 0.741 19610 83 1 . 1 1 17 17 GLU N N 17 119.492 119.492 119.567 -0.075 19610 84 1 . 1 1 17 17 GLU HA H 17 4.112 4.112 4.131 -0.019 19610 85 1 . 1 1 17 17 GLU C C 17 178.007 178.007 179.097 -1.090 19610 86 1 . 1 1 17 17 GLU CA C 17 58.252 58.252 59.129 -0.877 19610 87 1 . 1 1 17 17 GLU CB C 17 29.647 29.647 29.540 0.107 19610 88 1 . 1 1 17 17 GLU H H 17 8.221 8.221 7.620 0.601 19610 89 1 . 1 1 18 18 LEU N N 18 119.493 119.493 117.095 2.398 19610 90 1 . 1 1 18 18 LEU HA H 18 4.147 4.147 4.223 -0.076 19610 91 1 . 1 1 18 18 LEU C C 18 178.359 178.359 179.104 -0.745 19610 92 1 . 1 1 18 18 LEU CA C 18 56.422 56.422 57.830 -1.408 19610 93 1 . 1 1 18 18 LEU CB C 18 41.760 41.760 41.157 0.603 19610 94 1 . 1 1 18 18 LEU H H 18 7.998 7.998 8.003 -0.005 19610 95 1 . 1 1 19 19 SER N N 19 114.728 114.728 114.963 -0.235 19610 96 1 . 1 1 19 19 SER HA H 19 4.113 4.113 4.132 -0.019 19610 97 1 . 1 1 19 19 SER C C 19 175.912 175.912 176.375 -0.463 19610 98 1 . 1 1 19 19 SER CA C 19 60.881 60.881 61.741 -0.860 19610 99 1 . 1 1 19 19 SER CB C 19 63.043 63.043 62.772 0.271 19610 100 1 . 1 1 19 19 SER H H 19 8.068 8.068 7.916 0.152 19610 101 1 . 1 1 20 20 ASP N N 20 121.206 121.206 121.887 -0.681 19610 102 1 . 1 1 20 20 ASP HA H 20 4.448 4.448 4.393 0.055 19610 103 1 . 1 1 20 20 ASP C C 20 177.598 177.598 178.330 -0.733 19610 104 1 . 1 1 20 20 ASP CA C 20 55.995 55.995 56.865 -0.870 19610 105 1 . 1 1 20 20 ASP CB C 20 40.539 40.539 40.977 -0.438 19610 106 1 . 1 1 20 20 ASP H H 20 8.301 8.301 7.739 0.562 19610 107 1 . 1 1 21 21 LEU N N 21 119.944 119.944 119.369 0.575 19610 108 1 . 1 1 21 21 LEU HA H 21 4.142 4.142 4.501 -0.359 19610 109 1 . 1 1 21 21 LEU C C 21 177.822 177.822 178.367 -0.545 19610 110 1 . 1 1 21 21 LEU CA C 21 56.439 56.439 55.846 0.593 19610 111 1 . 1 1 21 21 LEU CB C 21 42.252 42.252 41.337 0.915 19610 112 1 . 1 1 21 21 LEU H H 21 7.807 7.807 8.002 -0.195 19610 113 1 . 1 1 22 22 LEU N N 22 119.558 119.558 121.586 -2.028 19610 114 1 . 1 1 22 22 LEU HA H 22 4.076 4.076 4.027 0.049 19610 115 1 . 1 1 22 22 LEU C C 22 177.131 177.131 178.075 -0.944 19610 116 1 . 1 1 22 22 LEU CA C 22 56.055 56.055 58.042 -1.987 19610 117 1 . 1 1 22 22 LEU CB C 22 41.844 41.844 41.609 0.235 19610 118 1 . 1 1 22 22 LEU H H 22 7.878 7.878 7.741 0.137 19610 119 1 . 1 1 23 23 ASP N N 23 119.509 119.509 119.448 0.061 19610 120 1 . 1 1 23 23 ASP HA H 23 4.464 4.464 4.238 0.226 19610 121 1 . 1 1 23 23 ASP C C 23 177.379 177.379 178.406 -1.027 19610 122 1 . 1 1 23 23 ASP CA C 23 54.927 54.927 57.419 -2.492 19610 123 1 . 1 1 23 23 ASP CB C 23 40.739 40.739 40.449 0.290 19610 124 1 . 1 1 23 23 ASP H H 23 7.990 7.990 7.703 0.287 19610 125 1 . 1 1 24 24 PHE N N 24 121.219 121.219 117.157 4.062 19610 126 1 . 1 1 24 24 PHE HA H 24 4.466 4.466 4.313 0.153 19610 127 1 . 1 1 24 24 PHE C C 24 176.875 176.875 177.692 -0.817 19610 128 1 . 1 1 24 24 PHE CA C 24 59.229 59.229 59.711 -0.482 19610 129 1 . 1 1 24 24 PHE CB C 24 39.007 39.007 38.312 0.695 19610 130 1 . 1 1 24 24 PHE H H 24 8.204 8.204 7.387 0.817 19610 131 1 . 1 1 25 25 SER N N 25 115.500 115.500 116.401 -0.901 19610 132 1 . 1 1 25 25 SER HA H 25 4.108 4.108 4.656 -0.548 19610 133 1 . 1 1 25 25 SER C C 25 175.386 175.386 176.260 -0.874 19610 134 1 . 1 1 25 25 SER CA C 25 60.758 60.758 61.554 -0.796 19610 135 1 . 1 1 25 25 SER CB C 25 62.998 62.998 63.238 -0.240 19610 136 1 . 1 1 25 25 SER H H 25 8.326 8.326 7.945 0.381 19610 137 1 . 1 1 26 26 MET N N 26 119.723 119.723 117.451 2.272 19610 138 1 . 1 1 26 26 MET HA H 26 4.363 4.363 4.545 -0.182 19610 139 1 . 1 1 26 26 MET C C 26 176.450 176.450 177.418 -0.968 19610 140 1 . 1 1 26 26 MET CA C 26 55.949 55.949 56.851 -0.902 19610 141 1 . 1 1 26 26 MET CB C 26 31.868 31.868 32.514 -0.646 19610 142 1 . 1 1 26 26 MET H H 26 7.889 7.889 7.883 0.006 19610 143 1 . 1 1 27 27 MET N N 27 117.872 117.872 119.006 -1.134 19610 144 1 . 1 1 27 27 MET HA H 27 4.186 4.186 4.308 -0.122 19610 145 1 . 1 1 27 27 MET C C 27 175.341 175.341 176.735 -1.394 19610 146 1 . 1 1 27 27 MET CA C 27 56.102 56.102 56.845 -0.743 19610 147 1 . 1 1 27 27 MET CB C 27 33.161 33.161 33.235 -0.074 19610 148 1 . 1 1 27 27 MET H H 27 7.656 7.656 7.427 0.229 19610 149 1 . 1 1 28 28 PHE N N 28 118.702 118.702 121.195 -2.493 19610 150 1 . 1 1 28 28 PHE HA H 28 4.804 4.804 4.433 0.371 19610 151 1 . 1 1 28 28 PHE C C 28 173.132 173.132 175.099 -1.967 19610 152 1 . 1 1 28 28 PHE CA C 28 54.795 54.795 57.270 -2.475 19610 153 1 . 1 1 28 28 PHE CB C 28 38.729 38.729 38.389 0.340 19610 154 1 . 1 1 28 28 PHE H H 28 7.682 7.682 7.743 -0.061 19610 155 1 . 1 1 29 29 PRO HA H 29 4.461 4.461 4.455 0.006 19610 156 1 . 1 1 29 29 PRO C C 29 176.360 176.360 176.307 0.053 19610 157 1 . 1 1 29 29 PRO CA C 29 62.820 62.820 63.198 -0.378 19610 158 1 . 1 1 29 29 PRO CB C 29 31.581 31.581 31.951 -0.371 19610 159 1 . 1 1 30 30 LEU N N 30 123.391 123.391 121.848 1.543 19610 160 1 . 1 1 30 30 LEU HA H 30 4.539 4.539 4.560 -0.021 19610 161 1 . 1 1 30 30 LEU C C 30 175.365 175.365 176.086 -0.721 19610 162 1 . 1 1 30 30 LEU CA C 30 52.911 52.911 53.363 -0.452 19610 163 1 . 1 1 30 30 LEU CB C 30 41.673 41.673 41.892 -0.219 19610 164 1 . 1 1 30 30 LEU H H 30 8.284 8.284 7.703 0.580 19610 165 1 . 1 1 31 31 PRO HA H 31 4.438 4.438 4.438 -0.000 19610 166 1 . 1 1 31 31 PRO C C 31 176.688 176.688 175.884 0.804 19610 167 1 . 1 1 31 31 PRO CA C 31 62.880 62.880 62.609 0.271 19610 168 1 . 1 1 31 31 PRO CB C 31 32.043 32.043 30.486 1.557 19610 169 1 . 1 1 32 32 VAL N N 32 120.844 120.844 125.343 -4.499 19610 170 1 . 1 1 32 32 VAL HA H 32 4.140 4.140 4.004 0.136 19610 171 1 . 1 1 32 32 VAL C C 32 176.579 176.579 176.283 0.296 19610 172 1 . 1 1 32 32 VAL CA C 32 62.241 62.241 62.479 -0.238 19610 173 1 . 1 1 32 32 VAL CB C 32 32.809 32.809 31.696 1.113 19610 174 1 . 1 1 32 32 VAL H H 32 8.344 8.344 7.996 0.348 19610 175 1 . 1 1 33 33 THR N N 33 118.041 118.041 120.664 -2.623 19610 176 1 . 1 1 33 33 THR HA H 33 4.373 4.373 4.392 -0.019 19610 177 1 . 1 1 33 33 THR C C 33 174.172 174.172 174.889 -0.717 19610 178 1 . 1 1 33 33 THR CA C 33 61.407 61.407 62.208 -0.801 19610 179 1 . 1 1 33 33 THR CB C 33 69.891 69.891 68.656 1.235 19610 180 1 . 1 1 33 33 THR H H 33 8.326 8.326 8.337 -0.011 19610 181 1 . 1 1 34 34 ASN N N 34 121.367 121.367 118.976 2.391 19610 182 1 . 1 1 34 34 ASN HA H 34 4.709 4.709 4.605 0.104 19610 183 1 . 1 1 34 34 ASN C C 34 175.639 175.639 175.498 0.141 19610 184 1 . 1 1 34 34 ASN CA C 34 53.218 53.218 53.546 -0.328 19610 185 1 . 1 1 34 34 ASN CB C 34 38.957 38.957 38.317 0.640 19610 186 1 . 1 1 34 34 ASN H H 34 8.526 8.526 8.176 0.350 19610 187 1 . 1 1 35 35 GLY N N 35 109.437 109.437 108.641 0.796 19610 188 1 . 1 1 35 35 GLY C C 35 174.112 174.112 174.319 -0.207 19610 189 1 . 1 1 35 35 GLY CA C 35 45.370 45.370 45.349 0.021 19610 190 1 . 1 1 35 35 GLY H H 35 8.449 8.449 8.297 0.152 19610 191 1 . 1 1 36 36 LYS N N 36 120.614 120.614 121.494 -0.880 19610 192 1 . 1 1 36 36 LYS HA H 36 4.303 4.303 4.361 -0.058 19610 193 1 . 1 1 36 36 LYS C C 36 177.182 177.182 176.529 0.653 19610 194 1 . 1 1 36 36 LYS CA C 36 56.300 56.300 55.794 0.506 19610 195 1 . 1 1 36 36 LYS CB C 36 32.895 32.895 32.719 0.176 19610 196 1 . 1 1 36 36 LYS H H 36 8.261 8.261 7.914 0.347 19610 197 1 . 1 1 37 37 GLY N N 37 110.011 110.011 111.000 -0.989 19610 198 1 . 1 1 37 37 GLY C C 37 173.463 173.463 173.976 -0.513 19610 199 1 . 1 1 37 37 GLY CA C 37 45.122 45.122 45.278 -0.155 19610 200 1 . 1 1 37 37 GLY H H 37 8.484 8.484 8.496 -0.012 19610 201 1 . 1 1 38 38 ARG N N 38 121.698 121.698 120.886 0.812 19610 202 1 . 1 1 38 38 ARG HA H 38 4.619 4.619 4.513 0.106 19610 203 1 . 1 1 38 38 ARG C C 38 173.448 173.448 174.154 -0.706 19610 204 1 . 1 1 38 38 ARG CA C 38 53.702 53.702 54.802 -1.100 19610 205 1 . 1 1 38 38 ARG CB C 38 30.121 30.121 29.679 0.441 19610 206 1 . 1 1 38 38 ARG H H 38 8.105 8.105 8.115 -0.010 19610 stop_ save_