data_25289 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25289 _Entry.PDB_ID 2MVX 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 25289 _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 ALA N N 2 118.014 118.014 125.076 -7.062 25289 2 1 1 . 1 1 2 2 ALA C C 2 177.737 177.737 177.955 -0.218 25289 3 1 1 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.672 0.208 25289 4 1 1 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.740 -3.048 25289 5 1 1 . 1 1 3 3 GLU N N 3 121.987 121.987 121.494 0.493 25289 6 1 1 . 1 1 3 3 GLU C C 3 176.622 176.622 176.520 0.102 25289 7 1 1 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.537 3.967 25289 8 1 1 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.167 -0.544 25289 9 1 1 . 1 1 4 4 PHE N N 4 114.820 114.820 117.240 -2.420 25289 10 1 1 . 1 1 4 4 PHE C C 4 175.867 175.867 174.686 1.181 25289 11 1 1 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.001 -0.017 25289 12 1 1 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.557 1.143 25289 13 1 1 . 1 1 5 5 ARG N N 5 132.201 132.201 126.866 5.335 25289 14 1 1 . 1 1 5 5 ARG C C 5 173.318 173.318 175.666 -2.348 25289 15 1 1 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.505 -0.869 25289 16 1 1 . 1 1 5 5 ARG CB C 5 33.723 33.723 30.940 2.783 25289 17 1 1 . 1 1 6 6 HIS N N 6 126.106 126.106 124.650 1.456 25289 18 1 1 . 1 1 6 6 HIS C C 6 171.847 171.847 174.297 -2.450 25289 19 1 1 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.304 -5.136 25289 20 1 1 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.720 1.617 25289 21 1 1 . 1 1 7 7 ASP N N 7 129.834 129.834 126.864 2.970 25289 22 1 1 . 1 1 7 7 ASP C C 7 173.950 173.950 175.199 -1.249 25289 23 1 1 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.949 -1.526 25289 24 1 1 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.353 0.671 25289 25 1 1 . 1 1 8 8 SER N N 8 116.727 116.727 117.043 -0.316 25289 26 1 1 . 1 1 8 8 SER C C 8 175.357 175.357 175.042 0.315 25289 27 1 1 . 1 1 8 8 SER CA C 8 55.033 55.033 57.840 -2.808 25289 28 1 1 . 1 1 8 8 SER CB C 8 66.184 66.184 64.695 1.488 25289 29 1 1 . 1 1 9 9 GLY N N 9 112.188 112.188 108.361 3.827 25289 30 1 1 . 1 1 9 9 GLY C C 9 173.834 173.834 173.313 0.521 25289 31 1 1 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.545 1.651 25289 32 1 1 . 1 1 10 10 TYR N N 10 126.552 126.552 119.836 6.716 25289 33 1 1 . 1 1 10 10 TYR C C 10 172.647 172.647 173.922 -1.275 25289 34 1 1 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.050 0.981 25289 35 1 1 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.011 2.058 25289 36 1 1 . 1 1 11 11 GLU N N 11 130.897 130.897 127.975 2.922 25289 37 1 1 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.743 -0.915 25289 38 1 1 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.926 1.406 25289 39 1 1 . 1 1 12 12 VAL N N 12 126.150 126.150 125.727 0.423 25289 40 1 1 . 1 1 12 12 VAL C C 12 175.777 175.777 175.228 0.549 25289 41 1 1 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.220 -1.668 25289 42 1 1 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.184 1.682 25289 43 1 1 . 1 1 13 13 HIS N N 13 125.956 125.956 126.063 -0.107 25289 44 1 1 . 1 1 13 13 HIS C C 13 173.570 173.570 174.706 -1.136 25289 45 1 1 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.178 -4.734 25289 46 1 1 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.736 2.654 25289 47 1 1 . 1 1 14 14 HIS N N 14 118.068 118.068 123.194 -5.126 25289 48 1 1 . 1 1 14 14 HIS C C 14 173.557 173.557 174.282 -0.725 25289 49 1 1 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.823 -0.925 25289 50 1 1 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.451 0.518 25289 51 1 1 . 1 1 15 15 GLN N N 15 108.832 108.832 123.995 -15.163 25289 52 1 1 . 1 1 15 15 GLN C C 15 175.161 175.161 175.227 -0.066 25289 53 1 1 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.187 -0.452 25289 54 1 1 . 1 1 15 15 GLN CB C 15 33.033 33.033 29.908 3.125 25289 55 1 1 . 1 1 16 16 LYS N N 16 120.134 120.134 124.359 -4.225 25289 56 1 1 . 1 1 16 16 LYS C C 16 174.135 174.135 175.377 -1.242 25289 57 1 1 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.078 -0.917 25289 58 1 1 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.354 3.323 25289 59 1 1 . 1 1 17 17 LEU N N 17 128.053 128.053 127.008 1.045 25289 60 1 1 . 1 1 17 17 LEU C C 17 174.949 174.949 175.669 -0.720 25289 61 1 1 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.340 0.284 25289 62 1 1 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.329 2.367 25289 63 1 1 . 1 1 18 18 VAL N N 18 123.642 123.642 124.019 -0.377 25289 64 1 1 . 1 1 18 18 VAL C C 18 172.776 172.776 175.268 -2.492 25289 65 1 1 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.836 -0.079 25289 66 1 1 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.408 1.409 25289 67 1 1 . 1 1 19 19 PHE N N 19 129.487 129.487 126.429 3.058 25289 68 1 1 . 1 1 19 19 PHE C C 19 174.192 174.192 175.730 -1.538 25289 69 1 1 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.585 -0.010 25289 70 1 1 . 1 1 19 19 PHE CB C 19 42.431 42.431 40.155 2.276 25289 71 1 1 . 1 1 20 20 PHE N N 20 117.543 117.543 120.299 -2.756 25289 72 1 1 . 1 1 20 20 PHE C C 20 170.932 170.932 174.781 -3.849 25289 73 1 1 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.154 0.525 25289 74 1 1 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.121 -5.199 25289 75 1 1 . 1 1 21 21 ALA N N 21 115.079 115.079 123.989 -8.910 25289 76 1 1 . 1 1 21 21 ALA C C 21 177.230 177.230 177.028 0.202 25289 77 1 1 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.989 -2.997 25289 78 1 1 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.203 3.985 25289 79 1 1 . 1 1 22 22 ASP N N 22 118.083 118.083 123.722 -5.639 25289 80 1 1 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.831 0.638 25289 81 1 1 . 1 1 22 22 ASP CB C 22 39.067 39.067 41.169 -2.102 25289 82 1 1 . 1 1 23 23 VAL N N 23 118.167 118.167 122.336 -4.169 25289 83 1 1 . 1 1 23 23 VAL C C 23 177.102 177.102 176.632 0.470 25289 84 1 1 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.463 -3.105 25289 85 1 1 . 1 1 23 23 VAL CB C 23 36.811 36.811 33.774 3.037 25289 86 1 1 . 1 1 24 24 GLY N N 24 116.706 116.706 114.693 2.013 25289 87 1 1 . 1 1 24 24 GLY C C 24 175.652 175.652 174.883 0.769 25289 88 1 1 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.919 2.943 25289 89 1 1 . 1 1 25 25 SER N N 25 114.116 114.116 114.300 -0.184 25289 90 1 1 . 1 1 25 25 SER C C 25 171.430 171.430 173.082 -1.652 25289 91 1 1 . 1 1 25 25 SER CA C 25 57.801 57.801 58.605 -0.804 25289 92 1 1 . 1 1 25 25 SER CB C 25 66.227 66.227 64.672 1.555 25289 93 1 1 . 1 1 26 26 ASN N N 26 124.399 124.399 122.848 1.551 25289 94 1 1 . 1 1 26 26 ASN C C 26 174.397 174.397 174.564 -0.167 25289 95 1 1 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.351 -0.602 25289 96 1 1 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.606 1.220 25289 97 1 1 . 1 1 27 27 LYS N N 27 119.929 119.929 122.721 -2.792 25289 98 1 1 . 1 1 27 27 LYS C C 27 174.254 174.254 176.998 -2.744 25289 99 1 1 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.459 -0.669 25289 100 1 1 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.373 5.998 25289 101 1 1 . 1 1 28 28 GLY N N 28 110.364 110.364 108.906 1.458 25289 102 1 1 . 1 1 28 28 GLY C C 28 170.924 170.924 173.341 -2.417 25289 103 1 1 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.256 -0.270 25289 104 1 1 . 1 1 29 29 ALA N N 29 131.126 131.126 125.829 5.297 25289 105 1 1 . 1 1 29 29 ALA C C 29 174.741 174.741 176.512 -1.771 25289 106 1 1 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.728 -1.571 25289 107 1 1 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.555 0.627 25289 108 1 1 . 1 1 30 30 ILE N N 30 124.057 124.057 123.302 0.755 25289 109 1 1 . 1 1 30 30 ILE C C 30 174.412 174.412 175.117 -0.705 25289 110 1 1 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.294 -2.542 25289 111 1 1 . 1 1 30 30 ILE CB C 30 38.797 38.797 40.093 -1.296 25289 112 1 1 . 1 1 31 31 ILE N N 31 125.346 125.346 126.457 -1.111 25289 113 1 1 . 1 1 31 31 ILE C C 31 175.726 175.726 175.989 -0.263 25289 114 1 1 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.963 -2.525 25289 115 1 1 . 1 1 31 31 ILE CB C 31 41.749 41.749 39.662 2.087 25289 116 1 1 . 1 1 32 32 GLY N N 32 114.247 114.247 113.851 0.396 25289 117 1 1 . 1 1 32 32 GLY C C 32 171.545 171.545 173.468 -1.923 25289 118 1 1 . 1 1 32 32 GLY CA C 32 48.711 48.711 45.073 3.638 25289 119 1 1 . 1 1 33 33 LEU N N 33 125.458 125.458 119.495 5.963 25289 120 1 1 . 1 1 33 33 LEU C C 33 173.806 173.806 174.729 -0.923 25289 121 1 1 . 1 1 33 33 LEU CA C 33 54.124 54.124 55.145 -1.021 25289 122 1 1 . 1 1 33 33 LEU CB C 33 45.854 45.854 41.683 4.171 25289 123 1 1 . 1 1 34 34 MET N N 34 126.372 126.372 125.104 1.268 25289 124 1 1 . 1 1 34 34 MET C C 34 173.609 173.609 174.985 -1.376 25289 125 1 1 . 1 1 34 34 MET CA C 34 53.644 53.644 54.703 -1.059 25289 126 1 1 . 1 1 34 34 MET CB C 34 37.230 37.230 33.803 3.427 25289 127 1 1 . 1 1 35 35 VAL N N 35 125.387 125.387 124.442 0.945 25289 128 1 1 . 1 1 35 35 VAL C C 35 176.204 176.204 176.482 -0.278 25289 129 1 1 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.048 -3.331 25289 130 1 1 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.485 3.582 25289 131 1 1 . 1 1 36 36 GLY N N 36 117.182 117.182 114.102 3.080 25289 132 1 1 . 1 1 36 36 GLY C C 36 173.838 173.838 174.756 -0.918 25289 133 1 1 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.000 3.353 25289 134 1 1 . 1 1 37 37 GLY N N 37 105.656 105.656 106.266 -0.610 25289 135 1 1 . 1 1 37 37 GLY C C 37 169.824 169.824 172.585 -2.761 25289 136 1 1 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.458 0.516 25289 137 1 1 . 1 1 38 38 VAL N N 38 118.585 118.585 119.878 -1.293 25289 138 1 1 . 1 1 38 38 VAL C C 38 172.917 172.917 174.544 -1.627 25289 139 1 1 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.353 -0.808 25289 140 1 1 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.463 3.270 25289 141 1 2 . 1 1 2 2 ALA N N 2 118.014 118.014 124.090 -6.076 25289 142 1 2 . 1 1 2 2 ALA C C 2 177.737 177.737 178.685 -0.948 25289 143 1 2 . 1 1 2 2 ALA CA C 2 51.880 51.880 52.530 -0.650 25289 144 1 2 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.443 -3.751 25289 145 1 2 . 1 1 3 3 GLU N N 3 121.987 121.987 123.073 -1.086 25289 146 1 2 . 1 1 3 3 GLU C C 3 176.622 176.622 176.306 0.316 25289 147 1 2 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.233 4.271 25289 148 1 2 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.172 -0.549 25289 149 1 2 . 1 1 4 4 PHE N N 4 114.820 114.820 118.306 -3.486 25289 150 1 2 . 1 1 4 4 PHE C C 4 175.867 175.867 174.820 1.047 25289 151 1 2 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.843 0.141 25289 152 1 2 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.304 1.396 25289 153 1 2 . 1 1 5 5 ARG N N 5 132.201 132.201 126.842 5.359 25289 154 1 2 . 1 1 5 5 ARG C C 5 173.318 173.318 175.364 -2.046 25289 155 1 2 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.872 -1.236 25289 156 1 2 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.527 2.196 25289 157 1 2 . 1 1 6 6 HIS N N 6 126.106 126.106 123.951 2.155 25289 158 1 2 . 1 1 6 6 HIS C C 6 171.847 171.847 174.680 -2.833 25289 159 1 2 . 1 1 6 6 HIS CA C 6 51.169 51.169 55.995 -4.825 25289 160 1 2 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.671 1.666 25289 161 1 2 . 1 1 7 7 ASP N N 7 129.834 129.834 126.655 3.179 25289 162 1 2 . 1 1 7 7 ASP C C 7 173.950 173.950 175.068 -1.118 25289 163 1 2 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.835 -1.412 25289 164 1 2 . 1 1 7 7 ASP CB C 7 42.024 42.024 40.993 1.031 25289 165 1 2 . 1 1 8 8 SER N N 8 116.727 116.727 117.043 -0.316 25289 166 1 2 . 1 1 8 8 SER C C 8 175.357 175.357 174.903 0.454 25289 167 1 2 . 1 1 8 8 SER CA C 8 55.033 55.033 57.873 -2.840 25289 168 1 2 . 1 1 8 8 SER CB C 8 66.184 66.184 64.191 1.994 25289 169 1 2 . 1 1 9 9 GLY N N 9 112.188 112.188 109.695 2.493 25289 170 1 2 . 1 1 9 9 GLY C C 9 173.834 173.834 172.892 0.942 25289 171 1 2 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.507 1.689 25289 172 1 2 . 1 1 10 10 TYR N N 10 126.552 126.552 119.817 6.735 25289 173 1 2 . 1 1 10 10 TYR C C 10 172.647 172.647 173.901 -1.254 25289 174 1 2 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.329 0.702 25289 175 1 2 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.903 1.166 25289 176 1 2 . 1 1 11 11 GLU N N 11 130.897 130.897 127.374 3.523 25289 177 1 2 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.700 -0.872 25289 178 1 2 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.574 1.758 25289 179 1 2 . 1 1 12 12 VAL N N 12 126.150 126.150 125.078 1.072 25289 180 1 2 . 1 1 12 12 VAL C C 12 175.777 175.777 174.908 0.869 25289 181 1 2 . 1 1 12 12 VAL CA C 12 60.552 60.552 61.967 -1.415 25289 182 1 2 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.348 1.518 25289 183 1 2 . 1 1 13 13 HIS N N 13 125.956 125.956 125.681 0.275 25289 184 1 2 . 1 1 13 13 HIS C C 13 173.570 173.570 174.761 -1.191 25289 185 1 2 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.204 -4.760 25289 186 1 2 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.170 2.220 25289 187 1 2 . 1 1 14 14 HIS N N 14 118.068 118.068 122.706 -4.638 25289 188 1 2 . 1 1 14 14 HIS C C 14 173.557 173.557 174.441 -0.884 25289 189 1 2 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.790 -0.892 25289 190 1 2 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.160 0.809 25289 191 1 2 . 1 1 15 15 GLN N N 15 108.832 108.832 123.388 -14.556 25289 192 1 2 . 1 1 15 15 GLN C C 15 175.161 175.161 175.194 -0.033 25289 193 1 2 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.248 -0.513 25289 194 1 2 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.225 2.808 25289 195 1 2 . 1 1 16 16 LYS N N 16 120.134 120.134 124.783 -4.649 25289 196 1 2 . 1 1 16 16 LYS C C 16 174.135 174.135 175.201 -1.066 25289 197 1 2 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.097 -0.936 25289 198 1 2 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.080 3.597 25289 199 1 2 . 1 1 17 17 LEU N N 17 128.053 128.053 126.500 1.553 25289 200 1 2 . 1 1 17 17 LEU C C 17 174.949 174.949 175.583 -0.634 25289 201 1 2 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.316 0.308 25289 202 1 2 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.700 1.996 25289 203 1 2 . 1 1 18 18 VAL N N 18 123.642 123.642 124.095 -0.453 25289 204 1 2 . 1 1 18 18 VAL C C 18 172.776 172.776 175.229 -2.453 25289 205 1 2 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.426 0.331 25289 206 1 2 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.128 1.689 25289 207 1 2 . 1 1 19 19 PHE N N 19 129.487 129.487 126.568 2.919 25289 208 1 2 . 1 1 19 19 PHE C C 19 174.192 174.192 175.798 -1.606 25289 209 1 2 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.886 -0.311 25289 210 1 2 . 1 1 19 19 PHE CB C 19 42.431 42.431 39.456 2.975 25289 211 1 2 . 1 1 20 20 PHE N N 20 117.543 117.543 119.968 -2.425 25289 212 1 2 . 1 1 20 20 PHE C C 20 170.932 170.932 174.680 -3.748 25289 213 1 2 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.134 0.545 25289 214 1 2 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.906 -4.983 25289 215 1 2 . 1 1 21 21 ALA N N 21 115.079 115.079 123.515 -8.436 25289 216 1 2 . 1 1 21 21 ALA C C 21 177.230 177.230 176.982 0.248 25289 217 1 2 . 1 1 21 21 ALA CA C 21 48.992 48.992 52.120 -3.128 25289 218 1 2 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.454 3.733 25289 219 1 2 . 1 1 22 22 ASP N N 22 118.083 118.083 121.771 -3.688 25289 220 1 2 . 1 1 22 22 ASP CA C 22 55.469 55.469 55.098 0.371 25289 221 1 2 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.672 -1.605 25289 222 1 2 . 1 1 23 23 VAL N N 23 118.167 118.167 121.205 -3.038 25289 223 1 2 . 1 1 23 23 VAL C C 23 177.102 177.102 176.735 0.367 25289 224 1 2 . 1 1 23 23 VAL CA C 23 58.358 58.358 60.811 -2.453 25289 225 1 2 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.536 2.275 25289 226 1 2 . 1 1 24 24 GLY N N 24 116.706 116.706 115.665 1.041 25289 227 1 2 . 1 1 24 24 GLY C C 24 175.652 175.652 174.769 0.883 25289 228 1 2 . 1 1 24 24 GLY CA C 24 48.862 48.862 46.193 2.669 25289 229 1 2 . 1 1 25 25 SER N N 25 114.116 114.116 114.574 -0.458 25289 230 1 2 . 1 1 25 25 SER C C 25 171.430 171.430 173.216 -1.786 25289 231 1 2 . 1 1 25 25 SER CA C 25 57.801 57.801 58.295 -0.494 25289 232 1 2 . 1 1 25 25 SER CB C 25 66.227 66.227 64.972 1.255 25289 233 1 2 . 1 1 26 26 ASN N N 26 124.399 124.399 122.340 2.059 25289 234 1 2 . 1 1 26 26 ASN C C 26 174.397 174.397 174.528 -0.131 25289 235 1 2 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.066 -0.317 25289 236 1 2 . 1 1 26 26 ASN CB C 26 40.826 40.826 38.661 2.165 25289 237 1 2 . 1 1 27 27 LYS N N 27 119.929 119.929 122.039 -2.110 25289 238 1 2 . 1 1 27 27 LYS C C 27 174.254 174.254 176.927 -2.673 25289 239 1 2 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.378 -0.588 25289 240 1 2 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.815 5.556 25289 241 1 2 . 1 1 28 28 GLY N N 28 110.364 110.364 108.782 1.582 25289 242 1 2 . 1 1 28 28 GLY C C 28 170.924 170.924 173.241 -2.317 25289 243 1 2 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.196 -0.210 25289 244 1 2 . 1 1 29 29 ALA N N 29 131.126 131.126 125.275 5.851 25289 245 1 2 . 1 1 29 29 ALA C C 29 174.741 174.741 176.509 -1.768 25289 246 1 2 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.833 -1.675 25289 247 1 2 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.407 0.775 25289 248 1 2 . 1 1 30 30 ILE N N 30 124.057 124.057 123.571 0.486 25289 249 1 2 . 1 1 30 30 ILE C C 30 174.412 174.412 175.412 -1.000 25289 250 1 2 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.307 -3.555 25289 251 1 2 . 1 1 30 30 ILE CB C 30 38.797 38.797 40.077 -1.280 25289 252 1 2 . 1 1 31 31 ILE N N 31 125.346 125.346 127.305 -1.959 25289 253 1 2 . 1 1 31 31 ILE C C 31 175.726 175.726 176.055 -0.329 25289 254 1 2 . 1 1 31 31 ILE CA C 31 58.438 58.438 61.003 -2.565 25289 255 1 2 . 1 1 31 31 ILE CB C 31 41.749 41.749 39.178 2.571 25289 256 1 2 . 1 1 32 32 GLY N N 32 114.247 114.247 114.853 -0.606 25289 257 1 2 . 1 1 32 32 GLY C C 32 171.545 171.545 173.259 -1.714 25289 258 1 2 . 1 1 32 32 GLY CA C 32 48.711 48.711 44.730 3.981 25289 259 1 2 . 1 1 33 33 LEU N N 33 125.458 125.458 119.955 5.503 25289 260 1 2 . 1 1 33 33 LEU C C 33 173.806 173.806 174.943 -1.137 25289 261 1 2 . 1 1 33 33 LEU CA C 33 54.124 54.124 54.545 -0.421 25289 262 1 2 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.043 3.811 25289 263 1 2 . 1 1 34 34 MET N N 34 126.372 126.372 125.816 0.556 25289 264 1 2 . 1 1 34 34 MET C C 34 173.609 173.609 174.725 -1.116 25289 265 1 2 . 1 1 34 34 MET CA C 34 53.644 53.644 54.942 -1.298 25289 266 1 2 . 1 1 34 34 MET CB C 34 37.230 37.230 33.753 3.477 25289 267 1 2 . 1 1 35 35 VAL N N 35 125.387 125.387 124.889 0.498 25289 268 1 2 . 1 1 35 35 VAL C C 35 176.204 176.204 176.458 -0.254 25289 269 1 2 . 1 1 35 35 VAL CA C 35 58.717 58.717 61.990 -3.273 25289 270 1 2 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.584 3.483 25289 271 1 2 . 1 1 36 36 GLY N N 36 117.182 117.182 113.480 3.702 25289 272 1 2 . 1 1 36 36 GLY C C 36 173.838 173.838 174.843 -1.005 25289 273 1 2 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.157 3.196 25289 274 1 2 . 1 1 37 37 GLY N N 37 105.656 105.656 106.215 -0.559 25289 275 1 2 . 1 1 37 37 GLY C C 37 169.824 169.824 172.688 -2.864 25289 276 1 2 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.443 0.531 25289 277 1 2 . 1 1 38 38 VAL N N 38 118.585 118.585 120.728 -2.143 25289 278 1 2 . 1 1 38 38 VAL C C 38 172.917 172.917 174.811 -1.894 25289 279 1 2 . 1 1 38 38 VAL CA C 38 60.545 60.545 60.921 -0.376 25289 280 1 2 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.352 3.381 25289 281 1 3 . 1 1 2 2 ALA N N 2 118.014 118.014 126.031 -8.017 25289 282 1 3 . 1 1 2 2 ALA C C 2 177.737 177.737 178.016 -0.279 25289 283 1 3 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.440 0.440 25289 284 1 3 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.035 -3.343 25289 285 1 3 . 1 1 3 3 GLU N N 3 121.987 121.987 122.366 -0.379 25289 286 1 3 . 1 1 3 3 GLU C C 3 176.622 176.622 176.635 -0.013 25289 287 1 3 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.667 3.837 25289 288 1 3 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.043 -0.420 25289 289 1 3 . 1 1 4 4 PHE N N 4 114.820 114.820 117.800 -2.980 25289 290 1 3 . 1 1 4 4 PHE C C 4 175.867 175.867 175.008 0.859 25289 291 1 3 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.782 0.202 25289 292 1 3 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.660 1.040 25289 293 1 3 . 1 1 5 5 ARG N N 5 132.201 132.201 127.267 4.934 25289 294 1 3 . 1 1 5 5 ARG C C 5 173.318 173.318 175.308 -1.990 25289 295 1 3 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.269 -0.633 25289 296 1 3 . 1 1 5 5 ARG CB C 5 33.723 33.723 30.833 2.890 25289 297 1 3 . 1 1 6 6 HIS N N 6 126.106 126.106 123.692 2.414 25289 298 1 3 . 1 1 6 6 HIS C C 6 171.847 171.847 174.382 -2.535 25289 299 1 3 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.011 -4.841 25289 300 1 3 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.973 1.364 25289 301 1 3 . 1 1 7 7 ASP N N 7 129.834 129.834 125.324 4.510 25289 302 1 3 . 1 1 7 7 ASP C C 7 173.950 173.950 175.115 -1.165 25289 303 1 3 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.083 -1.660 25289 304 1 3 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.311 0.713 25289 305 1 3 . 1 1 8 8 SER N N 8 116.727 116.727 117.338 -0.611 25289 306 1 3 . 1 1 8 8 SER C C 8 175.357 175.357 174.978 0.379 25289 307 1 3 . 1 1 8 8 SER CA C 8 55.033 55.033 57.459 -2.426 25289 308 1 3 . 1 1 8 8 SER CB C 8 66.184 66.184 64.908 1.276 25289 309 1 3 . 1 1 9 9 GLY N N 9 112.188 112.188 107.570 4.618 25289 310 1 3 . 1 1 9 9 GLY C C 9 173.834 173.834 173.196 0.638 25289 311 1 3 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.268 1.928 25289 312 1 3 . 1 1 10 10 TYR N N 10 126.552 126.552 119.260 7.292 25289 313 1 3 . 1 1 10 10 TYR C C 10 172.647 172.647 173.896 -1.249 25289 314 1 3 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.201 0.830 25289 315 1 3 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.442 1.627 25289 316 1 3 . 1 1 11 11 GLU N N 11 130.897 130.897 127.616 3.281 25289 317 1 3 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.785 -0.957 25289 318 1 3 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.485 1.847 25289 319 1 3 . 1 1 12 12 VAL N N 12 126.150 126.150 122.015 4.135 25289 320 1 3 . 1 1 12 12 VAL C C 12 175.777 175.777 174.894 0.883 25289 321 1 3 . 1 1 12 12 VAL CA C 12 60.552 60.552 61.054 -0.502 25289 322 1 3 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.780 1.086 25289 323 1 3 . 1 1 13 13 HIS N N 13 125.956 125.956 124.543 1.413 25289 324 1 3 . 1 1 13 13 HIS C C 13 173.570 173.570 174.734 -1.164 25289 325 1 3 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.425 -4.981 25289 326 1 3 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.313 2.077 25289 327 1 3 . 1 1 14 14 HIS N N 14 118.068 118.068 123.165 -5.097 25289 328 1 3 . 1 1 14 14 HIS C C 14 173.557 173.557 174.484 -0.927 25289 329 1 3 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.828 -0.930 25289 330 1 3 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.881 1.089 25289 331 1 3 . 1 1 15 15 GLN N N 15 108.832 108.832 124.059 -15.227 25289 332 1 3 . 1 1 15 15 GLN C C 15 175.161 175.161 175.393 -0.232 25289 333 1 3 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.255 -0.520 25289 334 1 3 . 1 1 15 15 GLN CB C 15 33.033 33.033 29.880 3.154 25289 335 1 3 . 1 1 16 16 LYS N N 16 120.134 120.134 124.777 -4.643 25289 336 1 3 . 1 1 16 16 LYS C C 16 174.135 174.135 175.293 -1.158 25289 337 1 3 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.074 -0.913 25289 338 1 3 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.193 3.484 25289 339 1 3 . 1 1 17 17 LEU N N 17 128.053 128.053 126.838 1.215 25289 340 1 3 . 1 1 17 17 LEU C C 17 174.949 174.949 175.602 -0.653 25289 341 1 3 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.194 0.430 25289 342 1 3 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.447 2.249 25289 343 1 3 . 1 1 18 18 VAL N N 18 123.642 123.642 120.686 2.956 25289 344 1 3 . 1 1 18 18 VAL C C 18 172.776 172.776 175.063 -2.287 25289 345 1 3 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.355 0.402 25289 346 1 3 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.706 1.111 25289 347 1 3 . 1 1 19 19 PHE N N 19 129.487 129.487 125.843 3.644 25289 348 1 3 . 1 1 19 19 PHE C C 19 174.192 174.192 175.366 -1.174 25289 349 1 3 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.947 -0.372 25289 350 1 3 . 1 1 19 19 PHE CB C 19 42.431 42.431 39.901 2.530 25289 351 1 3 . 1 1 20 20 PHE N N 20 117.543 117.543 120.868 -3.325 25289 352 1 3 . 1 1 20 20 PHE C C 20 170.932 170.932 174.544 -3.612 25289 353 1 3 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.084 0.595 25289 354 1 3 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.386 -5.463 25289 355 1 3 . 1 1 21 21 ALA N N 21 115.079 115.079 124.574 -9.495 25289 356 1 3 . 1 1 21 21 ALA C C 21 177.230 177.230 176.588 0.642 25289 357 1 3 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.896 -2.904 25289 358 1 3 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.598 3.590 25289 359 1 3 . 1 1 22 22 ASP N N 22 118.083 118.083 122.460 -4.377 25289 360 1 3 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.955 0.514 25289 361 1 3 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.852 -1.785 25289 362 1 3 . 1 1 23 23 VAL N N 23 118.167 118.167 121.137 -2.970 25289 363 1 3 . 1 1 23 23 VAL C C 23 177.102 177.102 176.105 0.997 25289 364 1 3 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.242 -2.884 25289 365 1 3 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.488 2.323 25289 366 1 3 . 1 1 24 24 GLY N N 24 116.706 116.706 115.243 1.463 25289 367 1 3 . 1 1 24 24 GLY C C 24 175.652 175.652 174.743 0.909 25289 368 1 3 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.770 3.092 25289 369 1 3 . 1 1 25 25 SER N N 25 114.116 114.116 116.207 -2.091 25289 370 1 3 . 1 1 25 25 SER C C 25 171.430 171.430 173.068 -1.638 25289 371 1 3 . 1 1 25 25 SER CA C 25 57.801 57.801 58.226 -0.425 25289 372 1 3 . 1 1 25 25 SER CB C 25 66.227 66.227 64.781 1.446 25289 373 1 3 . 1 1 26 26 ASN N N 26 124.399 124.399 122.849 1.550 25289 374 1 3 . 1 1 26 26 ASN C C 26 174.397 174.397 174.424 -0.027 25289 375 1 3 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.204 -0.455 25289 376 1 3 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.347 1.479 25289 377 1 3 . 1 1 27 27 LYS N N 27 119.929 119.929 122.508 -2.579 25289 378 1 3 . 1 1 27 27 LYS C C 27 174.254 174.254 177.122 -2.868 25289 379 1 3 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.550 -0.760 25289 380 1 3 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.186 5.185 25289 381 1 3 . 1 1 28 28 GLY N N 28 110.364 110.364 108.640 1.724 25289 382 1 3 . 1 1 28 28 GLY C C 28 170.924 170.924 173.350 -2.426 25289 383 1 3 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.172 -0.186 25289 384 1 3 . 1 1 29 29 ALA N N 29 131.126 131.126 124.801 6.325 25289 385 1 3 . 1 1 29 29 ALA C C 29 174.741 174.741 176.673 -1.932 25289 386 1 3 . 1 1 29 29 ALA CA C 29 50.157 50.157 52.008 -1.851 25289 387 1 3 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.294 0.888 25289 388 1 3 . 1 1 30 30 ILE N N 30 124.057 124.057 124.053 0.004 25289 389 1 3 . 1 1 30 30 ILE C C 30 174.412 174.412 175.312 -0.900 25289 390 1 3 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.255 -3.503 25289 391 1 3 . 1 1 30 30 ILE CB C 30 38.797 38.797 40.138 -1.341 25289 392 1 3 . 1 1 31 31 ILE N N 31 125.346 125.346 125.712 -0.366 25289 393 1 3 . 1 1 31 31 ILE C C 31 175.726 175.726 175.747 -0.021 25289 394 1 3 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.956 -2.518 25289 395 1 3 . 1 1 31 31 ILE CB C 31 41.749 41.749 39.792 1.957 25289 396 1 3 . 1 1 32 32 GLY N N 32 114.247 114.247 114.406 -0.159 25289 397 1 3 . 1 1 32 32 GLY C C 32 171.545 171.545 174.014 -2.469 25289 398 1 3 . 1 1 32 32 GLY CA C 32 48.711 48.711 44.951 3.760 25289 399 1 3 . 1 1 33 33 LEU N N 33 125.458 125.458 121.109 4.349 25289 400 1 3 . 1 1 33 33 LEU C C 33 173.806 173.806 175.054 -1.248 25289 401 1 3 . 1 1 33 33 LEU CA C 33 54.124 54.124 55.017 -0.893 25289 402 1 3 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.402 3.452 25289 403 1 3 . 1 1 34 34 MET N N 34 126.372 126.372 124.809 1.563 25289 404 1 3 . 1 1 34 34 MET C C 34 173.609 173.609 175.026 -1.417 25289 405 1 3 . 1 1 34 34 MET CA C 34 53.644 53.644 54.768 -1.124 25289 406 1 3 . 1 1 34 34 MET CB C 34 37.230 37.230 34.267 2.963 25289 407 1 3 . 1 1 35 35 VAL N N 35 125.387 125.387 123.876 1.511 25289 408 1 3 . 1 1 35 35 VAL C C 35 176.204 176.204 176.601 -0.397 25289 409 1 3 . 1 1 35 35 VAL CA C 35 58.717 58.717 61.573 -2.856 25289 410 1 3 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.033 4.034 25289 411 1 3 . 1 1 36 36 GLY N N 36 117.182 117.182 113.962 3.220 25289 412 1 3 . 1 1 36 36 GLY C C 36 173.838 173.838 174.914 -1.076 25289 413 1 3 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.256 3.097 25289 414 1 3 . 1 1 37 37 GLY N N 37 105.656 105.656 107.142 -1.486 25289 415 1 3 . 1 1 37 37 GLY C C 37 169.824 169.824 173.794 -3.970 25289 416 1 3 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.570 0.404 25289 417 1 3 . 1 1 38 38 VAL N N 38 118.585 118.585 118.626 -0.041 25289 418 1 3 . 1 1 38 38 VAL C C 38 172.917 172.917 173.979 -1.062 25289 419 1 3 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.853 -1.308 25289 420 1 3 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.401 3.332 25289 421 1 4 . 1 1 2 2 ALA N N 2 118.014 118.014 126.536 -8.522 25289 422 1 4 . 1 1 2 2 ALA C C 2 177.737 177.737 177.891 -0.154 25289 423 1 4 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.603 0.277 25289 424 1 4 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.501 -3.809 25289 425 1 4 . 1 1 3 3 GLU N N 3 121.987 121.987 121.251 0.736 25289 426 1 4 . 1 1 3 3 GLU C C 3 176.622 176.622 176.168 0.454 25289 427 1 4 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.523 3.981 25289 428 1 4 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.063 -0.440 25289 429 1 4 . 1 1 4 4 PHE N N 4 114.820 114.820 117.323 -2.503 25289 430 1 4 . 1 1 4 4 PHE C C 4 175.867 175.867 174.976 0.891 25289 431 1 4 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.890 0.094 25289 432 1 4 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.723 0.977 25289 433 1 4 . 1 1 5 5 ARG N N 5 132.201 132.201 125.851 6.350 25289 434 1 4 . 1 1 5 5 ARG C C 5 173.318 173.318 175.239 -1.921 25289 435 1 4 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.830 -1.194 25289 436 1 4 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.661 2.062 25289 437 1 4 . 1 1 6 6 HIS N N 6 126.106 126.106 122.702 3.404 25289 438 1 4 . 1 1 6 6 HIS C C 6 171.847 171.847 174.676 -2.829 25289 439 1 4 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.134 -4.965 25289 440 1 4 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.930 1.407 25289 441 1 4 . 1 1 7 7 ASP N N 7 129.834 129.834 125.365 4.469 25289 442 1 4 . 1 1 7 7 ASP C C 7 173.950 173.950 175.092 -1.142 25289 443 1 4 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.369 -1.946 25289 444 1 4 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.393 0.631 25289 445 1 4 . 1 1 8 8 SER N N 8 116.727 116.727 116.746 -0.019 25289 446 1 4 . 1 1 8 8 SER C C 8 175.357 175.357 175.281 0.076 25289 447 1 4 . 1 1 8 8 SER CA C 8 55.033 55.033 58.133 -3.100 25289 448 1 4 . 1 1 8 8 SER CB C 8 66.184 66.184 64.435 1.749 25289 449 1 4 . 1 1 9 9 GLY N N 9 112.188 112.188 109.726 2.462 25289 450 1 4 . 1 1 9 9 GLY C C 9 173.834 173.834 172.997 0.837 25289 451 1 4 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.680 1.516 25289 452 1 4 . 1 1 10 10 TYR N N 10 126.552 126.552 119.606 6.946 25289 453 1 4 . 1 1 10 10 TYR C C 10 172.647 172.647 173.927 -1.280 25289 454 1 4 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.041 0.989 25289 455 1 4 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.704 1.365 25289 456 1 4 . 1 1 11 11 GLU N N 11 130.897 130.897 127.568 3.329 25289 457 1 4 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.768 -0.940 25289 458 1 4 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.198 2.134 25289 459 1 4 . 1 1 12 12 VAL N N 12 126.150 126.150 125.644 0.506 25289 460 1 4 . 1 1 12 12 VAL C C 12 175.777 175.777 174.559 1.218 25289 461 1 4 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.335 -1.783 25289 462 1 4 . 1 1 12 12 VAL CB C 12 34.866 34.866 34.060 0.805 25289 463 1 4 . 1 1 13 13 HIS N N 13 125.956 125.956 127.351 -1.395 25289 464 1 4 . 1 1 13 13 HIS C C 13 173.570 173.570 174.612 -1.042 25289 465 1 4 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.441 -4.997 25289 466 1 4 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.626 2.764 25289 467 1 4 . 1 1 14 14 HIS N N 14 118.068 118.068 123.172 -5.104 25289 468 1 4 . 1 1 14 14 HIS C C 14 173.557 173.557 174.431 -0.874 25289 469 1 4 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.600 -0.702 25289 470 1 4 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.891 1.078 25289 471 1 4 . 1 1 15 15 GLN N N 15 108.832 108.832 123.559 -14.727 25289 472 1 4 . 1 1 15 15 GLN C C 15 175.161 175.161 174.909 0.252 25289 473 1 4 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.479 -0.744 25289 474 1 4 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.615 2.418 25289 475 1 4 . 1 1 16 16 LYS N N 16 120.134 120.134 124.373 -4.239 25289 476 1 4 . 1 1 16 16 LYS C C 16 174.135 174.135 175.212 -1.077 25289 477 1 4 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.132 -0.971 25289 478 1 4 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.152 3.525 25289 479 1 4 . 1 1 17 17 LEU N N 17 128.053 128.053 125.196 2.857 25289 480 1 4 . 1 1 17 17 LEU C C 17 174.949 174.949 175.265 -0.316 25289 481 1 4 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.089 0.535 25289 482 1 4 . 1 1 17 17 LEU CB C 17 44.696 44.696 41.991 2.705 25289 483 1 4 . 1 1 18 18 VAL N N 18 123.642 123.642 124.380 -0.738 25289 484 1 4 . 1 1 18 18 VAL C C 18 172.776 172.776 175.252 -2.476 25289 485 1 4 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.815 -0.058 25289 486 1 4 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.240 1.577 25289 487 1 4 . 1 1 19 19 PHE N N 19 129.487 129.487 127.883 1.604 25289 488 1 4 . 1 1 19 19 PHE C C 19 174.192 174.192 175.226 -1.034 25289 489 1 4 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.900 -0.325 25289 490 1 4 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.079 4.352 25289 491 1 4 . 1 1 20 20 PHE N N 20 117.543 117.543 122.402 -4.859 25289 492 1 4 . 1 1 20 20 PHE C C 20 170.932 170.932 174.256 -3.324 25289 493 1 4 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.271 0.408 25289 494 1 4 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.970 -6.047 25289 495 1 4 . 1 1 21 21 ALA N N 21 115.079 115.079 126.791 -11.712 25289 496 1 4 . 1 1 21 21 ALA C C 21 177.230 177.230 176.418 0.812 25289 497 1 4 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.799 -2.807 25289 498 1 4 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.555 2.633 25289 499 1 4 . 1 1 22 22 ASP N N 22 118.083 118.083 121.283 -3.200 25289 500 1 4 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.866 0.603 25289 501 1 4 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.384 -1.317 25289 502 1 4 . 1 1 23 23 VAL N N 23 118.167 118.167 120.690 -2.523 25289 503 1 4 . 1 1 23 23 VAL C C 23 177.102 177.102 176.761 0.341 25289 504 1 4 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.393 -3.035 25289 505 1 4 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.373 2.438 25289 506 1 4 . 1 1 24 24 GLY N N 24 116.706 116.706 115.499 1.207 25289 507 1 4 . 1 1 24 24 GLY C C 24 175.652 175.652 174.389 1.263 25289 508 1 4 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.691 3.171 25289 509 1 4 . 1 1 25 25 SER N N 25 114.116 114.116 114.729 -0.613 25289 510 1 4 . 1 1 25 25 SER C C 25 171.430 171.430 173.077 -1.647 25289 511 1 4 . 1 1 25 25 SER CA C 25 57.801 57.801 57.965 -0.164 25289 512 1 4 . 1 1 25 25 SER CB C 25 66.227 66.227 65.037 1.190 25289 513 1 4 . 1 1 26 26 ASN N N 26 124.399 124.399 123.489 0.910 25289 514 1 4 . 1 1 26 26 ASN C C 26 174.397 174.397 174.451 -0.054 25289 515 1 4 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.067 -0.318 25289 516 1 4 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.241 1.585 25289 517 1 4 . 1 1 27 27 LYS N N 27 119.929 119.929 125.523 -5.594 25289 518 1 4 . 1 1 27 27 LYS C C 27 174.254 174.254 176.612 -2.358 25289 519 1 4 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.753 -0.963 25289 520 1 4 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.812 5.559 25289 521 1 4 . 1 1 28 28 GLY N N 28 110.364 110.364 111.572 -1.208 25289 522 1 4 . 1 1 28 28 GLY C C 28 170.924 170.924 173.835 -2.911 25289 523 1 4 . 1 1 28 28 GLY CA C 28 44.986 44.986 44.573 0.413 25289 524 1 4 . 1 1 29 29 ALA N N 29 131.126 131.126 125.083 6.043 25289 525 1 4 . 1 1 29 29 ALA C C 29 174.741 174.741 176.967 -2.226 25289 526 1 4 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.900 -1.743 25289 527 1 4 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.239 0.942 25289 528 1 4 . 1 1 30 30 ILE N N 30 124.057 124.057 123.637 0.420 25289 529 1 4 . 1 1 30 30 ILE C C 30 174.412 174.412 174.522 -0.110 25289 530 1 4 . 1 1 30 30 ILE CA C 30 57.752 57.752 59.957 -2.205 25289 531 1 4 . 1 1 30 30 ILE CB C 30 38.797 38.797 37.429 1.368 25289 532 1 4 . 1 1 31 31 ILE N N 31 125.346 125.346 126.342 -0.996 25289 533 1 4 . 1 1 31 31 ILE C C 31 175.726 175.726 176.436 -0.710 25289 534 1 4 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.748 -2.310 25289 535 1 4 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.796 0.953 25289 536 1 4 . 1 1 32 32 GLY N N 32 114.247 114.247 115.736 -1.489 25289 537 1 4 . 1 1 32 32 GLY C C 32 171.545 171.545 174.366 -2.821 25289 538 1 4 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.535 2.176 25289 539 1 4 . 1 1 33 33 LEU N N 33 125.458 125.458 116.337 9.121 25289 540 1 4 . 1 1 33 33 LEU C C 33 173.806 173.806 174.962 -1.156 25289 541 1 4 . 1 1 33 33 LEU CA C 33 54.124 54.124 54.238 -0.114 25289 542 1 4 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.758 3.095 25289 543 1 4 . 1 1 34 34 MET N N 34 126.372 126.372 121.578 4.794 25289 544 1 4 . 1 1 34 34 MET C C 34 173.609 173.609 175.220 -1.611 25289 545 1 4 . 1 1 34 34 MET CA C 34 53.644 53.644 54.989 -1.345 25289 546 1 4 . 1 1 34 34 MET CB C 34 37.230 37.230 34.021 3.209 25289 547 1 4 . 1 1 35 35 VAL N N 35 125.387 125.387 122.925 2.462 25289 548 1 4 . 1 1 35 35 VAL C C 35 176.204 176.204 176.905 -0.701 25289 549 1 4 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.535 -3.818 25289 550 1 4 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.248 3.819 25289 551 1 4 . 1 1 36 36 GLY N N 36 117.182 117.182 114.977 2.205 25289 552 1 4 . 1 1 36 36 GLY C C 36 173.838 173.838 175.019 -1.181 25289 553 1 4 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.933 3.420 25289 554 1 4 . 1 1 37 37 GLY N N 37 105.656 105.656 107.343 -1.687 25289 555 1 4 . 1 1 37 37 GLY C C 37 169.824 169.824 173.746 -3.922 25289 556 1 4 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.459 0.515 25289 557 1 4 . 1 1 38 38 VAL N N 38 118.585 118.585 118.348 0.237 25289 558 1 4 . 1 1 38 38 VAL C C 38 172.917 172.917 174.507 -1.590 25289 559 1 4 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.623 -1.078 25289 560 1 4 . 1 1 38 38 VAL CB C 38 36.733 36.733 34.235 2.498 25289 561 1 5 . 1 1 2 2 ALA N N 2 118.014 118.014 125.778 -7.764 25289 562 1 5 . 1 1 2 2 ALA C C 2 177.737 177.737 177.973 -0.236 25289 563 1 5 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.578 0.302 25289 564 1 5 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.970 -3.278 25289 565 1 5 . 1 1 3 3 GLU N N 3 121.987 121.987 121.644 0.343 25289 566 1 5 . 1 1 3 3 GLU C C 3 176.622 176.622 176.180 0.442 25289 567 1 5 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.426 4.078 25289 568 1 5 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.094 -0.471 25289 569 1 5 . 1 1 4 4 PHE N N 4 114.820 114.820 117.229 -2.409 25289 570 1 5 . 1 1 4 4 PHE C C 4 175.867 175.867 174.864 1.003 25289 571 1 5 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.911 0.073 25289 572 1 5 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.603 1.097 25289 573 1 5 . 1 1 5 5 ARG N N 5 132.201 132.201 125.861 6.340 25289 574 1 5 . 1 1 5 5 ARG C C 5 173.318 173.318 175.410 -2.092 25289 575 1 5 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.807 -1.171 25289 576 1 5 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.554 2.169 25289 577 1 5 . 1 1 6 6 HIS N N 6 126.106 126.106 123.270 2.836 25289 578 1 5 . 1 1 6 6 HIS C C 6 171.847 171.847 174.339 -2.492 25289 579 1 5 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.268 -5.099 25289 580 1 5 . 1 1 6 6 HIS CB C 6 32.337 32.337 31.006 1.331 25289 581 1 5 . 1 1 7 7 ASP N N 7 129.834 129.834 126.114 3.720 25289 582 1 5 . 1 1 7 7 ASP C C 7 173.950 173.950 175.011 -1.061 25289 583 1 5 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.170 -1.747 25289 584 1 5 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.268 0.756 25289 585 1 5 . 1 1 8 8 SER N N 8 116.727 116.727 116.531 0.196 25289 586 1 5 . 1 1 8 8 SER C C 8 175.357 175.357 175.170 0.187 25289 587 1 5 . 1 1 8 8 SER CA C 8 55.033 55.033 57.920 -2.888 25289 588 1 5 . 1 1 8 8 SER CB C 8 66.184 66.184 64.796 1.388 25289 589 1 5 . 1 1 9 9 GLY N N 9 112.188 112.188 108.288 3.900 25289 590 1 5 . 1 1 9 9 GLY C C 9 173.834 173.834 173.339 0.495 25289 591 1 5 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.618 1.578 25289 592 1 5 . 1 1 10 10 TYR N N 10 126.552 126.552 119.767 6.785 25289 593 1 5 . 1 1 10 10 TYR C C 10 172.647 172.647 173.940 -1.293 25289 594 1 5 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.055 0.976 25289 595 1 5 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.036 2.033 25289 596 1 5 . 1 1 11 11 GLU N N 11 130.897 130.897 127.693 3.204 25289 597 1 5 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.752 -0.923 25289 598 1 5 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.729 1.603 25289 599 1 5 . 1 1 12 12 VAL N N 12 126.150 126.150 125.176 0.974 25289 600 1 5 . 1 1 12 12 VAL C C 12 175.777 175.777 175.064 0.713 25289 601 1 5 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.065 -1.513 25289 602 1 5 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.390 1.476 25289 603 1 5 . 1 1 13 13 HIS N N 13 125.956 125.956 125.622 0.334 25289 604 1 5 . 1 1 13 13 HIS C C 13 173.570 173.570 174.785 -1.215 25289 605 1 5 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.160 -4.716 25289 606 1 5 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.179 2.211 25289 607 1 5 . 1 1 14 14 HIS N N 14 118.068 118.068 123.083 -5.015 25289 608 1 5 . 1 1 14 14 HIS C C 14 173.557 173.557 174.168 -0.611 25289 609 1 5 . 1 1 14 14 HIS CA C 14 54.898 54.898 56.018 -1.120 25289 610 1 5 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.106 0.863 25289 611 1 5 . 1 1 15 15 GLN N N 15 108.832 108.832 124.248 -15.416 25289 612 1 5 . 1 1 15 15 GLN C C 15 175.161 175.161 175.248 -0.087 25289 613 1 5 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.257 -0.522 25289 614 1 5 . 1 1 15 15 GLN CB C 15 33.033 33.033 29.908 3.125 25289 615 1 5 . 1 1 16 16 LYS N N 16 120.134 120.134 124.299 -4.165 25289 616 1 5 . 1 1 16 16 LYS C C 16 174.135 174.135 175.256 -1.121 25289 617 1 5 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.227 -1.066 25289 618 1 5 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.330 3.347 25289 619 1 5 . 1 1 17 17 LEU N N 17 128.053 128.053 127.175 0.878 25289 620 1 5 . 1 1 17 17 LEU C C 17 174.949 174.949 175.728 -0.779 25289 621 1 5 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.209 0.415 25289 622 1 5 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.577 2.119 25289 623 1 5 . 1 1 18 18 VAL N N 18 123.642 123.642 121.485 2.157 25289 624 1 5 . 1 1 18 18 VAL C C 18 172.776 172.776 175.351 -2.575 25289 625 1 5 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.041 0.716 25289 626 1 5 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.450 1.367 25289 627 1 5 . 1 1 19 19 PHE N N 19 129.487 129.487 127.482 2.005 25289 628 1 5 . 1 1 19 19 PHE C C 19 174.192 174.192 175.238 -1.046 25289 629 1 5 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.992 -0.417 25289 630 1 5 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.441 3.990 25289 631 1 5 . 1 1 20 20 PHE N N 20 117.543 117.543 121.810 -4.267 25289 632 1 5 . 1 1 20 20 PHE C C 20 170.932 170.932 174.522 -3.590 25289 633 1 5 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.916 0.763 25289 634 1 5 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.684 -4.761 25289 635 1 5 . 1 1 21 21 ALA N N 21 115.079 115.079 123.549 -8.470 25289 636 1 5 . 1 1 21 21 ALA C C 21 177.230 177.230 176.977 0.253 25289 637 1 5 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.922 -2.930 25289 638 1 5 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.186 3.002 25289 639 1 5 . 1 1 22 22 ASP N N 22 118.083 118.083 120.604 -2.521 25289 640 1 5 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.745 0.724 25289 641 1 5 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.118 -1.051 25289 642 1 5 . 1 1 23 23 VAL N N 23 118.167 118.167 119.780 -1.613 25289 643 1 5 . 1 1 23 23 VAL C C 23 177.102 177.102 176.705 0.397 25289 644 1 5 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.470 -3.112 25289 645 1 5 . 1 1 23 23 VAL CB C 23 36.811 36.811 33.847 2.964 25289 646 1 5 . 1 1 24 24 GLY N N 24 116.706 116.706 115.749 0.957 25289 647 1 5 . 1 1 24 24 GLY C C 24 175.652 175.652 174.730 0.922 25289 648 1 5 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.883 2.979 25289 649 1 5 . 1 1 25 25 SER N N 25 114.116 114.116 114.980 -0.864 25289 650 1 5 . 1 1 25 25 SER C C 25 171.430 171.430 173.243 -1.813 25289 651 1 5 . 1 1 25 25 SER CA C 25 57.801 57.801 58.348 -0.547 25289 652 1 5 . 1 1 25 25 SER CB C 25 66.227 66.227 65.049 1.178 25289 653 1 5 . 1 1 26 26 ASN N N 26 124.399 124.399 122.214 2.185 25289 654 1 5 . 1 1 26 26 ASN C C 26 174.397 174.397 174.712 -0.315 25289 655 1 5 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.175 -0.425 25289 656 1 5 . 1 1 26 26 ASN CB C 26 40.826 40.826 38.928 1.897 25289 657 1 5 . 1 1 27 27 LYS N N 27 119.929 119.929 124.055 -4.126 25289 658 1 5 . 1 1 27 27 LYS C C 27 174.254 174.254 176.712 -2.458 25289 659 1 5 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.124 -0.334 25289 660 1 5 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.773 5.598 25289 661 1 5 . 1 1 28 28 GLY N N 28 110.364 110.364 108.970 1.394 25289 662 1 5 . 1 1 28 28 GLY C C 28 170.924 170.924 173.680 -2.756 25289 663 1 5 . 1 1 28 28 GLY CA C 28 44.986 44.986 44.817 0.169 25289 664 1 5 . 1 1 29 29 ALA N N 29 131.126 131.126 125.514 5.612 25289 665 1 5 . 1 1 29 29 ALA C C 29 174.741 174.741 176.745 -2.004 25289 666 1 5 . 1 1 29 29 ALA CA C 29 50.157 50.157 52.128 -1.971 25289 667 1 5 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.192 0.990 25289 668 1 5 . 1 1 30 30 ILE N N 30 124.057 124.057 124.387 -0.330 25289 669 1 5 . 1 1 30 30 ILE C C 30 174.412 174.412 174.738 -0.326 25289 670 1 5 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.442 -3.690 25289 671 1 5 . 1 1 30 30 ILE CB C 30 38.797 38.797 38.874 -0.077 25289 672 1 5 . 1 1 31 31 ILE N N 31 125.346 125.346 126.649 -1.303 25289 673 1 5 . 1 1 31 31 ILE C C 31 175.726 175.726 175.853 -0.127 25289 674 1 5 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.453 -2.014 25289 675 1 5 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.791 0.958 25289 676 1 5 . 1 1 32 32 GLY N N 32 114.247 114.247 114.999 -0.752 25289 677 1 5 . 1 1 32 32 GLY C C 32 171.545 171.545 173.906 -2.361 25289 678 1 5 . 1 1 32 32 GLY CA C 32 48.711 48.711 45.912 2.799 25289 679 1 5 . 1 1 33 33 LEU N N 33 125.458 125.458 115.762 9.696 25289 680 1 5 . 1 1 33 33 LEU C C 33 173.806 173.806 174.908 -1.102 25289 681 1 5 . 1 1 33 33 LEU CA C 33 54.124 54.124 54.065 0.059 25289 682 1 5 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.585 3.269 25289 683 1 5 . 1 1 34 34 MET N N 34 126.372 126.372 121.810 4.562 25289 684 1 5 . 1 1 34 34 MET C C 34 173.609 173.609 175.232 -1.623 25289 685 1 5 . 1 1 34 34 MET CA C 34 53.644 53.644 54.847 -1.203 25289 686 1 5 . 1 1 34 34 MET CB C 34 37.230 37.230 33.984 3.246 25289 687 1 5 . 1 1 35 35 VAL N N 35 125.387 125.387 123.952 1.435 25289 688 1 5 . 1 1 35 35 VAL C C 35 176.204 176.204 176.831 -0.627 25289 689 1 5 . 1 1 35 35 VAL CA C 35 58.717 58.717 61.380 -2.663 25289 690 1 5 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.043 4.024 25289 691 1 5 . 1 1 36 36 GLY N N 36 117.182 117.182 114.507 2.675 25289 692 1 5 . 1 1 36 36 GLY C C 36 173.838 173.838 174.765 -0.927 25289 693 1 5 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.088 3.265 25289 694 1 5 . 1 1 37 37 GLY N N 37 105.656 105.656 106.417 -0.761 25289 695 1 5 . 1 1 37 37 GLY C C 37 169.824 169.824 172.732 -2.908 25289 696 1 5 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.258 0.716 25289 697 1 5 . 1 1 38 38 VAL N N 38 118.585 118.585 120.014 -1.429 25289 698 1 5 . 1 1 38 38 VAL C C 38 172.917 172.917 174.833 -1.916 25289 699 1 5 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.667 -1.122 25289 700 1 5 . 1 1 38 38 VAL CB C 38 36.733 36.733 32.907 3.826 25289 701 1 6 . 1 1 2 2 ALA N N 2 118.014 118.014 126.448 -8.434 25289 702 1 6 . 1 1 2 2 ALA C C 2 177.737 177.737 177.860 -0.123 25289 703 1 6 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.562 0.318 25289 704 1 6 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.037 -3.345 25289 705 1 6 . 1 1 3 3 GLU N N 3 121.987 121.987 122.149 -0.162 25289 706 1 6 . 1 1 3 3 GLU C C 3 176.622 176.622 176.528 0.094 25289 707 1 6 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.547 3.958 25289 708 1 6 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.159 -0.536 25289 709 1 6 . 1 1 4 4 PHE N N 4 114.820 114.820 117.503 -2.683 25289 710 1 6 . 1 1 4 4 PHE C C 4 175.867 175.867 175.054 0.813 25289 711 1 6 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.008 -0.024 25289 712 1 6 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.649 1.051 25289 713 1 6 . 1 1 5 5 ARG N N 5 132.201 132.201 125.575 6.626 25289 714 1 6 . 1 1 5 5 ARG C C 5 173.318 173.318 175.175 -1.857 25289 715 1 6 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.862 -1.226 25289 716 1 6 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.573 2.150 25289 717 1 6 . 1 1 6 6 HIS N N 6 126.106 126.106 122.162 3.944 25289 718 1 6 . 1 1 6 6 HIS C C 6 171.847 171.847 174.606 -2.759 25289 719 1 6 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.039 -4.870 25289 720 1 6 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.945 1.392 25289 721 1 6 . 1 1 7 7 ASP N N 7 129.834 129.834 125.199 4.635 25289 722 1 6 . 1 1 7 7 ASP C C 7 173.950 173.950 174.792 -0.842 25289 723 1 6 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.468 -2.045 25289 724 1 6 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.483 0.541 25289 725 1 6 . 1 1 8 8 SER N N 8 116.727 116.727 119.160 -2.433 25289 726 1 6 . 1 1 8 8 SER C C 8 175.357 175.357 175.412 -0.055 25289 727 1 6 . 1 1 8 8 SER CA C 8 55.033 55.033 57.680 -2.647 25289 728 1 6 . 1 1 8 8 SER CB C 8 66.184 66.184 64.914 1.270 25289 729 1 6 . 1 1 9 9 GLY N N 9 112.188 112.188 112.261 -0.073 25289 730 1 6 . 1 1 9 9 GLY C C 9 173.834 173.834 174.546 -0.712 25289 731 1 6 . 1 1 9 9 GLY CA C 9 47.196 47.196 46.171 1.025 25289 732 1 6 . 1 1 10 10 TYR N N 10 126.552 126.552 119.319 7.233 25289 733 1 6 . 1 1 10 10 TYR C C 10 172.647 172.647 174.237 -1.590 25289 734 1 6 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.508 0.523 25289 735 1 6 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.161 1.908 25289 736 1 6 . 1 1 11 11 GLU N N 11 130.897 130.897 126.219 4.678 25289 737 1 6 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.963 -1.135 25289 738 1 6 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.849 1.483 25289 739 1 6 . 1 1 12 12 VAL N N 12 126.150 126.150 124.886 1.264 25289 740 1 6 . 1 1 12 12 VAL C C 12 175.777 175.777 175.043 0.734 25289 741 1 6 . 1 1 12 12 VAL CA C 12 60.552 60.552 61.989 -1.437 25289 742 1 6 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.131 1.735 25289 743 1 6 . 1 1 13 13 HIS N N 13 125.956 125.956 124.744 1.212 25289 744 1 6 . 1 1 13 13 HIS C C 13 173.570 173.570 174.439 -0.869 25289 745 1 6 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.248 -4.804 25289 746 1 6 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.593 1.797 25289 747 1 6 . 1 1 14 14 HIS N N 14 118.068 118.068 121.901 -3.833 25289 748 1 6 . 1 1 14 14 HIS C C 14 173.557 173.557 174.231 -0.674 25289 749 1 6 . 1 1 14 14 HIS CA C 14 54.898 54.898 56.050 -1.152 25289 750 1 6 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.149 0.820 25289 751 1 6 . 1 1 15 15 GLN N N 15 108.832 108.832 122.710 -13.878 25289 752 1 6 . 1 1 15 15 GLN C C 15 175.161 175.161 174.940 0.221 25289 753 1 6 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.458 -0.723 25289 754 1 6 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.376 2.657 25289 755 1 6 . 1 1 16 16 LYS N N 16 120.134 120.134 124.921 -4.787 25289 756 1 6 . 1 1 16 16 LYS C C 16 174.135 174.135 175.132 -0.997 25289 757 1 6 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.070 -0.909 25289 758 1 6 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.309 3.369 25289 759 1 6 . 1 1 17 17 LEU N N 17 128.053 128.053 126.079 1.974 25289 760 1 6 . 1 1 17 17 LEU C C 17 174.949 174.949 175.883 -0.934 25289 761 1 6 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.161 0.463 25289 762 1 6 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.298 2.397 25289 763 1 6 . 1 1 18 18 VAL N N 18 123.642 123.642 120.530 3.112 25289 764 1 6 . 1 1 18 18 VAL C C 18 172.776 172.776 175.599 -2.823 25289 765 1 6 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.885 -0.127 25289 766 1 6 . 1 1 18 18 VAL CB C 18 33.817 33.817 33.002 0.815 25289 767 1 6 . 1 1 19 19 PHE N N 19 129.487 129.487 127.252 2.235 25289 768 1 6 . 1 1 19 19 PHE C C 19 174.192 174.192 175.377 -1.185 25289 769 1 6 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.851 -0.276 25289 770 1 6 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.357 4.074 25289 771 1 6 . 1 1 20 20 PHE N N 20 117.543 117.543 122.259 -4.716 25289 772 1 6 . 1 1 20 20 PHE C C 20 170.932 170.932 174.465 -3.533 25289 773 1 6 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.924 0.755 25289 774 1 6 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.323 -5.400 25289 775 1 6 . 1 1 21 21 ALA N N 21 115.079 115.079 126.568 -11.489 25289 776 1 6 . 1 1 21 21 ALA C C 21 177.230 177.230 176.436 0.794 25289 777 1 6 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.789 -2.797 25289 778 1 6 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.429 2.759 25289 779 1 6 . 1 1 22 22 ASP N N 22 118.083 118.083 122.277 -4.194 25289 780 1 6 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.756 0.713 25289 781 1 6 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.779 -1.712 25289 782 1 6 . 1 1 23 23 VAL N N 23 118.167 118.167 121.570 -3.403 25289 783 1 6 . 1 1 23 23 VAL C C 23 177.102 177.102 176.457 0.645 25289 784 1 6 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.349 -2.991 25289 785 1 6 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.470 2.341 25289 786 1 6 . 1 1 24 24 GLY N N 24 116.706 116.706 116.210 0.496 25289 787 1 6 . 1 1 24 24 GLY C C 24 175.652 175.652 174.574 1.078 25289 788 1 6 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.948 2.914 25289 789 1 6 . 1 1 25 25 SER N N 25 114.116 114.116 114.819 -0.703 25289 790 1 6 . 1 1 25 25 SER C C 25 171.430 171.430 173.324 -1.894 25289 791 1 6 . 1 1 25 25 SER CA C 25 57.801 57.801 58.193 -0.392 25289 792 1 6 . 1 1 25 25 SER CB C 25 66.227 66.227 65.277 0.950 25289 793 1 6 . 1 1 26 26 ASN N N 26 124.399 124.399 121.654 2.745 25289 794 1 6 . 1 1 26 26 ASN C C 26 174.397 174.397 174.665 -0.268 25289 795 1 6 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.131 -0.382 25289 796 1 6 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.043 1.783 25289 797 1 6 . 1 1 27 27 LYS N N 27 119.929 119.929 123.343 -3.414 25289 798 1 6 . 1 1 27 27 LYS C C 27 174.254 174.254 176.528 -2.274 25289 799 1 6 . 1 1 27 27 LYS CA C 27 54.790 54.790 54.829 -0.039 25289 800 1 6 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.694 5.677 25289 801 1 6 . 1 1 28 28 GLY N N 28 110.364 110.364 107.749 2.615 25289 802 1 6 . 1 1 28 28 GLY C C 28 170.924 170.924 173.618 -2.694 25289 803 1 6 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.013 -0.027 25289 804 1 6 . 1 1 29 29 ALA N N 29 131.126 131.126 125.417 5.709 25289 805 1 6 . 1 1 29 29 ALA C C 29 174.741 174.741 176.683 -1.942 25289 806 1 6 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.977 -1.820 25289 807 1 6 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.287 0.895 25289 808 1 6 . 1 1 30 30 ILE N N 30 124.057 124.057 124.653 -0.596 25289 809 1 6 . 1 1 30 30 ILE C C 30 174.412 174.412 174.706 -0.294 25289 810 1 6 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.325 -3.573 25289 811 1 6 . 1 1 30 30 ILE CB C 30 38.797 38.797 38.681 0.116 25289 812 1 6 . 1 1 31 31 ILE N N 31 125.346 125.346 126.771 -1.425 25289 813 1 6 . 1 1 31 31 ILE C C 31 175.726 175.726 175.913 -0.187 25289 814 1 6 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.427 -1.989 25289 815 1 6 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.380 1.369 25289 816 1 6 . 1 1 32 32 GLY N N 32 114.247 114.247 114.645 -0.398 25289 817 1 6 . 1 1 32 32 GLY C C 32 171.545 171.545 174.106 -2.561 25289 818 1 6 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.037 2.674 25289 819 1 6 . 1 1 33 33 LEU N N 33 125.458 125.458 115.793 9.665 25289 820 1 6 . 1 1 33 33 LEU C C 33 173.806 173.806 175.270 -1.464 25289 821 1 6 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.884 0.240 25289 822 1 6 . 1 1 33 33 LEU CB C 33 45.854 45.854 43.269 2.585 25289 823 1 6 . 1 1 34 34 MET N N 34 126.372 126.372 121.547 4.825 25289 824 1 6 . 1 1 34 34 MET C C 34 173.609 173.609 175.051 -1.442 25289 825 1 6 . 1 1 34 34 MET CA C 34 53.644 53.644 54.693 -1.049 25289 826 1 6 . 1 1 34 34 MET CB C 34 37.230 37.230 33.764 3.466 25289 827 1 6 . 1 1 35 35 VAL N N 35 125.387 125.387 123.544 1.843 25289 828 1 6 . 1 1 35 35 VAL C C 35 176.204 176.204 176.536 -0.332 25289 829 1 6 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.618 -3.901 25289 830 1 6 . 1 1 35 35 VAL CB C 35 36.067 36.067 31.742 4.325 25289 831 1 6 . 1 1 36 36 GLY N N 36 117.182 117.182 117.204 -0.022 25289 832 1 6 . 1 1 36 36 GLY C C 36 173.838 173.838 173.834 0.004 25289 833 1 6 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.832 3.521 25289 834 1 6 . 1 1 37 37 GLY N N 37 105.656 105.656 107.986 -2.330 25289 835 1 6 . 1 1 37 37 GLY C C 37 169.824 169.824 172.781 -2.957 25289 836 1 6 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.663 0.311 25289 837 1 6 . 1 1 38 38 VAL N N 38 118.585 118.585 120.793 -2.208 25289 838 1 6 . 1 1 38 38 VAL C C 38 172.917 172.917 175.102 -2.185 25289 839 1 6 . 1 1 38 38 VAL CA C 38 60.545 60.545 60.917 -0.372 25289 840 1 6 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.482 3.251 25289 841 1 7 . 1 1 2 2 ALA N N 2 118.014 118.014 125.712 -7.698 25289 842 1 7 . 1 1 2 2 ALA C C 2 177.737 177.737 177.822 -0.085 25289 843 1 7 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.763 0.117 25289 844 1 7 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.279 -3.587 25289 845 1 7 . 1 1 3 3 GLU N N 3 121.987 121.987 120.864 1.123 25289 846 1 7 . 1 1 3 3 GLU C C 3 176.622 176.622 176.313 0.309 25289 847 1 7 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.639 3.865 25289 848 1 7 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.094 -0.471 25289 849 1 7 . 1 1 4 4 PHE N N 4 114.820 114.820 117.580 -2.760 25289 850 1 7 . 1 1 4 4 PHE C C 4 175.867 175.867 174.567 1.300 25289 851 1 7 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.864 0.120 25289 852 1 7 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.351 1.349 25289 853 1 7 . 1 1 5 5 ARG N N 5 132.201 132.201 127.538 4.663 25289 854 1 7 . 1 1 5 5 ARG C C 5 173.318 173.318 175.349 -2.031 25289 855 1 7 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.661 -1.025 25289 856 1 7 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.399 2.324 25289 857 1 7 . 1 1 6 6 HIS N N 6 126.106 126.106 124.066 2.040 25289 858 1 7 . 1 1 6 6 HIS C C 6 171.847 171.847 174.521 -2.674 25289 859 1 7 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.127 -4.958 25289 860 1 7 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.775 1.562 25289 861 1 7 . 1 1 7 7 ASP N N 7 129.834 129.834 126.727 3.107 25289 862 1 7 . 1 1 7 7 ASP C C 7 173.950 173.950 174.898 -0.948 25289 863 1 7 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.866 -1.443 25289 864 1 7 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.362 0.662 25289 865 1 7 . 1 1 8 8 SER N N 8 116.727 116.727 117.679 -0.952 25289 866 1 7 . 1 1 8 8 SER C C 8 175.357 175.357 175.168 0.189 25289 867 1 7 . 1 1 8 8 SER CA C 8 55.033 55.033 56.795 -1.762 25289 868 1 7 . 1 1 8 8 SER CB C 8 66.184 66.184 65.217 0.967 25289 869 1 7 . 1 1 9 9 GLY N N 9 112.188 112.188 107.627 4.561 25289 870 1 7 . 1 1 9 9 GLY C C 9 173.834 173.834 173.723 0.111 25289 871 1 7 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.614 1.582 25289 872 1 7 . 1 1 10 10 TYR N N 10 126.552 126.552 115.505 11.047 25289 873 1 7 . 1 1 10 10 TYR C C 10 172.647 172.647 173.436 -0.789 25289 874 1 7 . 1 1 10 10 TYR CA C 10 58.031 58.031 55.390 2.641 25289 875 1 7 . 1 1 10 10 TYR CB C 10 42.069 42.069 39.221 2.848 25289 876 1 7 . 1 1 11 11 GLU N N 11 130.897 130.897 122.859 8.038 25289 877 1 7 . 1 1 11 11 GLU CA C 11 54.828 54.828 56.012 -1.184 25289 878 1 7 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.616 1.716 25289 879 1 7 . 1 1 12 12 VAL N N 12 126.150 126.150 125.680 0.470 25289 880 1 7 . 1 1 12 12 VAL C C 12 175.777 175.777 174.759 1.018 25289 881 1 7 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.160 -1.608 25289 882 1 7 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.522 1.345 25289 883 1 7 . 1 1 13 13 HIS N N 13 125.956 125.956 125.216 0.740 25289 884 1 7 . 1 1 13 13 HIS C C 13 173.570 173.570 174.482 -0.912 25289 885 1 7 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.296 -4.852 25289 886 1 7 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.561 1.829 25289 887 1 7 . 1 1 14 14 HIS N N 14 118.068 118.068 122.499 -4.431 25289 888 1 7 . 1 1 14 14 HIS C C 14 173.557 173.557 174.509 -0.952 25289 889 1 7 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.781 -0.883 25289 890 1 7 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.970 0.999 25289 891 1 7 . 1 1 15 15 GLN N N 15 108.832 108.832 122.474 -13.642 25289 892 1 7 . 1 1 15 15 GLN C C 15 175.161 175.161 175.046 0.115 25289 893 1 7 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.414 -0.679 25289 894 1 7 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.383 2.650 25289 895 1 7 . 1 1 16 16 LYS N N 16 120.134 120.134 123.951 -3.817 25289 896 1 7 . 1 1 16 16 LYS C C 16 174.135 174.135 175.264 -1.129 25289 897 1 7 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.073 -0.912 25289 898 1 7 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.563 3.114 25289 899 1 7 . 1 1 17 17 LEU N N 17 128.053 128.053 125.988 2.065 25289 900 1 7 . 1 1 17 17 LEU C C 17 174.949 174.949 175.448 -0.499 25289 901 1 7 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.117 0.507 25289 902 1 7 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.998 1.698 25289 903 1 7 . 1 1 18 18 VAL N N 18 123.642 123.642 121.295 2.347 25289 904 1 7 . 1 1 18 18 VAL C C 18 172.776 172.776 175.265 -2.489 25289 905 1 7 . 1 1 18 18 VAL CA C 18 61.757 61.757 60.982 0.775 25289 906 1 7 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.420 1.397 25289 907 1 7 . 1 1 19 19 PHE N N 19 129.487 129.487 126.551 2.936 25289 908 1 7 . 1 1 19 19 PHE C C 19 174.192 174.192 175.391 -1.199 25289 909 1 7 . 1 1 19 19 PHE CA C 19 55.575 55.575 56.048 -0.473 25289 910 1 7 . 1 1 19 19 PHE CB C 19 42.431 42.431 40.303 2.128 25289 911 1 7 . 1 1 20 20 PHE N N 20 117.543 117.543 117.909 -0.366 25289 912 1 7 . 1 1 20 20 PHE C C 20 170.932 170.932 174.701 -3.769 25289 913 1 7 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.217 0.462 25289 914 1 7 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.485 -4.562 25289 915 1 7 . 1 1 21 21 ALA N N 21 115.079 115.079 122.207 -7.128 25289 916 1 7 . 1 1 21 21 ALA C C 21 177.230 177.230 177.277 -0.047 25289 917 1 7 . 1 1 21 21 ALA CA C 21 48.992 48.992 52.284 -3.292 25289 918 1 7 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.918 3.270 25289 919 1 7 . 1 1 22 22 ASP N N 22 118.083 118.083 121.426 -3.343 25289 920 1 7 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.883 0.586 25289 921 1 7 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.271 -1.204 25289 922 1 7 . 1 1 23 23 VAL N N 23 118.167 118.167 118.394 -0.227 25289 923 1 7 . 1 1 23 23 VAL C C 23 177.102 177.102 176.287 0.815 25289 924 1 7 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.269 -2.911 25289 925 1 7 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.244 2.567 25289 926 1 7 . 1 1 24 24 GLY N N 24 116.706 116.706 114.960 1.746 25289 927 1 7 . 1 1 24 24 GLY C C 24 175.652 175.652 174.427 1.225 25289 928 1 7 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.709 3.153 25289 929 1 7 . 1 1 25 25 SER N N 25 114.116 114.116 114.510 -0.394 25289 930 1 7 . 1 1 25 25 SER C C 25 171.430 171.430 172.561 -1.131 25289 931 1 7 . 1 1 25 25 SER CA C 25 57.801 57.801 57.925 -0.124 25289 932 1 7 . 1 1 25 25 SER CB C 25 66.227 66.227 65.038 1.189 25289 933 1 7 . 1 1 26 26 ASN N N 26 124.399 124.399 121.573 2.826 25289 934 1 7 . 1 1 26 26 ASN C C 26 174.397 174.397 174.055 0.342 25289 935 1 7 . 1 1 26 26 ASN CA C 26 52.749 52.749 52.892 -0.143 25289 936 1 7 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.047 1.779 25289 937 1 7 . 1 1 27 27 LYS N N 27 119.929 119.929 122.043 -2.114 25289 938 1 7 . 1 1 27 27 LYS C C 27 174.254 174.254 176.946 -2.692 25289 939 1 7 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.516 -0.725 25289 940 1 7 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.752 5.619 25289 941 1 7 . 1 1 28 28 GLY N N 28 110.364 110.364 109.013 1.351 25289 942 1 7 . 1 1 28 28 GLY C C 28 170.924 170.924 173.197 -2.273 25289 943 1 7 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.064 -0.078 25289 944 1 7 . 1 1 29 29 ALA N N 29 131.126 131.126 125.208 5.918 25289 945 1 7 . 1 1 29 29 ALA C C 29 174.741 174.741 176.565 -1.824 25289 946 1 7 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.969 -1.812 25289 947 1 7 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.285 0.897 25289 948 1 7 . 1 1 30 30 ILE N N 30 124.057 124.057 123.153 0.904 25289 949 1 7 . 1 1 30 30 ILE C C 30 174.412 174.412 175.248 -0.836 25289 950 1 7 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.244 -3.492 25289 951 1 7 . 1 1 30 30 ILE CB C 30 38.797 38.797 40.323 -1.526 25289 952 1 7 . 1 1 31 31 ILE N N 31 125.346 125.346 125.488 -0.142 25289 953 1 7 . 1 1 31 31 ILE C C 31 175.726 175.726 176.195 -0.469 25289 954 1 7 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.697 -2.259 25289 955 1 7 . 1 1 31 31 ILE CB C 31 41.749 41.749 41.191 0.558 25289 956 1 7 . 1 1 32 32 GLY N N 32 114.247 114.247 115.204 -0.957 25289 957 1 7 . 1 1 32 32 GLY C C 32 171.545 171.545 174.282 -2.737 25289 958 1 7 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.003 2.708 25289 959 1 7 . 1 1 33 33 LEU N N 33 125.458 125.458 116.514 8.944 25289 960 1 7 . 1 1 33 33 LEU C C 33 173.806 173.806 175.045 -1.239 25289 961 1 7 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.900 0.224 25289 962 1 7 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.925 2.929 25289 963 1 7 . 1 1 34 34 MET N N 34 126.372 126.372 121.271 5.101 25289 964 1 7 . 1 1 34 34 MET C C 34 173.609 173.609 175.192 -1.583 25289 965 1 7 . 1 1 34 34 MET CA C 34 53.644 53.644 55.205 -1.561 25289 966 1 7 . 1 1 34 34 MET CB C 34 37.230 37.230 34.373 2.857 25289 967 1 7 . 1 1 35 35 VAL N N 35 125.387 125.387 123.356 2.031 25289 968 1 7 . 1 1 35 35 VAL C C 35 176.204 176.204 176.666 -0.462 25289 969 1 7 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.302 -3.585 25289 970 1 7 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.502 3.565 25289 971 1 7 . 1 1 36 36 GLY N N 36 117.182 117.182 114.223 2.959 25289 972 1 7 . 1 1 36 36 GLY C C 36 173.838 173.838 174.746 -0.908 25289 973 1 7 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.944 3.409 25289 974 1 7 . 1 1 37 37 GLY N N 37 105.656 105.656 106.105 -0.449 25289 975 1 7 . 1 1 37 37 GLY C C 37 169.824 169.824 172.620 -2.796 25289 976 1 7 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.479 0.495 25289 977 1 7 . 1 1 38 38 VAL N N 38 118.585 118.585 118.964 -0.379 25289 978 1 7 . 1 1 38 38 VAL C C 38 172.917 172.917 174.732 -1.815 25289 979 1 7 . 1 1 38 38 VAL CA C 38 60.545 60.545 62.072 -1.527 25289 980 1 7 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.583 3.150 25289 981 1 8 . 1 1 2 2 ALA N N 2 118.014 118.014 123.824 -5.810 25289 982 1 8 . 1 1 2 2 ALA C C 2 177.737 177.737 178.190 -0.453 25289 983 1 8 . 1 1 2 2 ALA CA C 2 51.880 51.880 52.842 -0.962 25289 984 1 8 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.431 -2.739 25289 985 1 8 . 1 1 3 3 GLU N N 3 121.987 121.987 121.313 0.674 25289 986 1 8 . 1 1 3 3 GLU C C 3 176.622 176.622 176.675 -0.053 25289 987 1 8 . 1 1 3 3 GLU CA C 3 62.504 62.504 57.768 4.736 25289 988 1 8 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.284 -0.661 25289 989 1 8 . 1 1 4 4 PHE N N 4 114.820 114.820 118.877 -4.057 25289 990 1 8 . 1 1 4 4 PHE C C 4 175.867 175.867 174.424 1.443 25289 991 1 8 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.119 -0.135 25289 992 1 8 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.490 1.210 25289 993 1 8 . 1 1 5 5 ARG N N 5 132.201 132.201 126.635 5.566 25289 994 1 8 . 1 1 5 5 ARG C C 5 173.318 173.318 175.597 -2.279 25289 995 1 8 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.615 -0.979 25289 996 1 8 . 1 1 5 5 ARG CB C 5 33.723 33.723 30.861 2.861 25289 997 1 8 . 1 1 6 6 HIS N N 6 126.106 126.106 123.762 2.344 25289 998 1 8 . 1 1 6 6 HIS C C 6 171.847 171.847 174.566 -2.719 25289 999 1 8 . 1 1 6 6 HIS CA C 6 51.169 51.169 55.999 -4.830 25289 1000 1 8 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.593 1.744 25289 1001 1 8 . 1 1 7 7 ASP N N 7 129.834 129.834 126.752 3.082 25289 1002 1 8 . 1 1 7 7 ASP C C 7 173.950 173.950 175.360 -1.410 25289 1003 1 8 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.291 -1.868 25289 1004 1 8 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.473 0.551 25289 1005 1 8 . 1 1 8 8 SER N N 8 116.727 116.727 117.212 -0.485 25289 1006 1 8 . 1 1 8 8 SER C C 8 175.357 175.357 175.177 0.180 25289 1007 1 8 . 1 1 8 8 SER CA C 8 55.033 55.033 58.231 -3.198 25289 1008 1 8 . 1 1 8 8 SER CB C 8 66.184 66.184 64.505 1.679 25289 1009 1 8 . 1 1 9 9 GLY N N 9 112.188 112.188 109.606 2.582 25289 1010 1 8 . 1 1 9 9 GLY C C 9 173.834 173.834 172.958 0.876 25289 1011 1 8 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.621 1.575 25289 1012 1 8 . 1 1 10 10 TYR N N 10 126.552 126.552 119.808 6.744 25289 1013 1 8 . 1 1 10 10 TYR C C 10 172.647 172.647 173.827 -1.180 25289 1014 1 8 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.180 0.851 25289 1015 1 8 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.954 1.115 25289 1016 1 8 . 1 1 11 11 GLU N N 11 130.897 130.897 127.918 2.979 25289 1017 1 8 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.847 -1.019 25289 1018 1 8 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.451 1.881 25289 1019 1 8 . 1 1 12 12 VAL N N 12 126.150 126.150 126.183 -0.033 25289 1020 1 8 . 1 1 12 12 VAL C C 12 175.777 175.777 175.106 0.671 25289 1021 1 8 . 1 1 12 12 VAL CA C 12 60.552 60.552 61.999 -1.447 25289 1022 1 8 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.193 1.673 25289 1023 1 8 . 1 1 13 13 HIS N N 13 125.956 125.956 125.849 0.107 25289 1024 1 8 . 1 1 13 13 HIS C C 13 173.570 173.570 174.468 -0.898 25289 1025 1 8 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.167 -4.723 25289 1026 1 8 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.806 2.584 25289 1027 1 8 . 1 1 14 14 HIS N N 14 118.068 118.068 123.365 -5.297 25289 1028 1 8 . 1 1 14 14 HIS C C 14 173.557 173.557 174.380 -0.823 25289 1029 1 8 . 1 1 14 14 HIS CA C 14 54.898 54.898 56.014 -1.116 25289 1030 1 8 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.812 1.157 25289 1031 1 8 . 1 1 15 15 GLN N N 15 108.832 108.832 123.387 -14.555 25289 1032 1 8 . 1 1 15 15 GLN C C 15 175.161 175.161 175.212 -0.051 25289 1033 1 8 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.424 -0.689 25289 1034 1 8 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.521 2.512 25289 1035 1 8 . 1 1 16 16 LYS N N 16 120.134 120.134 124.482 -4.348 25289 1036 1 8 . 1 1 16 16 LYS C C 16 174.135 174.135 175.290 -1.155 25289 1037 1 8 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.068 -0.907 25289 1038 1 8 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.061 3.616 25289 1039 1 8 . 1 1 17 17 LEU N N 17 128.053 128.053 126.805 1.248 25289 1040 1 8 . 1 1 17 17 LEU C C 17 174.949 174.949 175.863 -0.914 25289 1041 1 8 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.169 0.455 25289 1042 1 8 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.412 2.284 25289 1043 1 8 . 1 1 18 18 VAL N N 18 123.642 123.642 120.998 2.644 25289 1044 1 8 . 1 1 18 18 VAL C C 18 172.776 172.776 175.357 -2.581 25289 1045 1 8 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.346 0.411 25289 1046 1 8 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.718 1.099 25289 1047 1 8 . 1 1 19 19 PHE N N 19 129.487 129.487 127.265 2.222 25289 1048 1 8 . 1 1 19 19 PHE C C 19 174.192 174.192 175.203 -1.011 25289 1049 1 8 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.742 -0.168 25289 1050 1 8 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.295 4.136 25289 1051 1 8 . 1 1 20 20 PHE N N 20 117.543 117.543 121.673 -4.130 25289 1052 1 8 . 1 1 20 20 PHE C C 20 170.932 170.932 174.535 -3.603 25289 1053 1 8 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.760 0.919 25289 1054 1 8 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.680 -4.757 25289 1055 1 8 . 1 1 21 21 ALA N N 21 115.079 115.079 124.813 -9.734 25289 1056 1 8 . 1 1 21 21 ALA C C 21 177.230 177.230 176.795 0.435 25289 1057 1 8 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.866 -2.874 25289 1058 1 8 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.190 2.998 25289 1059 1 8 . 1 1 22 22 ASP N N 22 118.083 118.083 121.729 -3.646 25289 1060 1 8 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.874 0.595 25289 1061 1 8 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.650 -1.583 25289 1062 1 8 . 1 1 23 23 VAL N N 23 118.167 118.167 120.560 -2.393 25289 1063 1 8 . 1 1 23 23 VAL C C 23 177.102 177.102 176.532 0.570 25289 1064 1 8 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.098 -2.740 25289 1065 1 8 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.096 2.715 25289 1066 1 8 . 1 1 24 24 GLY N N 24 116.706 116.706 115.476 1.230 25289 1067 1 8 . 1 1 24 24 GLY C C 24 175.652 175.652 174.434 1.218 25289 1068 1 8 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.749 3.113 25289 1069 1 8 . 1 1 25 25 SER N N 25 114.116 114.116 114.540 -0.424 25289 1070 1 8 . 1 1 25 25 SER C C 25 171.430 171.430 173.049 -1.619 25289 1071 1 8 . 1 1 25 25 SER CA C 25 57.801 57.801 58.224 -0.423 25289 1072 1 8 . 1 1 25 25 SER CB C 25 66.227 66.227 64.963 1.264 25289 1073 1 8 . 1 1 26 26 ASN N N 26 124.399 124.399 122.577 1.822 25289 1074 1 8 . 1 1 26 26 ASN C C 26 174.397 174.397 174.751 -0.354 25289 1075 1 8 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.441 -0.692 25289 1076 1 8 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.190 1.636 25289 1077 1 8 . 1 1 27 27 LYS N N 27 119.929 119.929 125.263 -5.334 25289 1078 1 8 . 1 1 27 27 LYS C C 27 174.254 174.254 176.739 -2.485 25289 1079 1 8 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.172 -0.382 25289 1080 1 8 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.534 5.837 25289 1081 1 8 . 1 1 28 28 GLY N N 28 110.364 110.364 108.696 1.668 25289 1082 1 8 . 1 1 28 28 GLY C C 28 170.924 170.924 173.645 -2.721 25289 1083 1 8 . 1 1 28 28 GLY CA C 28 44.986 44.986 44.777 0.209 25289 1084 1 8 . 1 1 29 29 ALA N N 29 131.126 131.126 125.969 5.157 25289 1085 1 8 . 1 1 29 29 ALA C C 29 174.741 174.741 177.030 -2.289 25289 1086 1 8 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.871 -1.714 25289 1087 1 8 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.229 0.953 25289 1088 1 8 . 1 1 30 30 ILE N N 30 124.057 124.057 124.632 -0.575 25289 1089 1 8 . 1 1 30 30 ILE C C 30 174.412 174.412 174.991 -0.579 25289 1090 1 8 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.178 -2.426 25289 1091 1 8 . 1 1 30 30 ILE CB C 30 38.797 38.797 36.531 2.266 25289 1092 1 8 . 1 1 31 31 ILE N N 31 125.346 125.346 127.597 -2.251 25289 1093 1 8 . 1 1 31 31 ILE C C 31 175.726 175.726 175.792 -0.066 25289 1094 1 8 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.363 -1.925 25289 1095 1 8 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.223 1.526 25289 1096 1 8 . 1 1 32 32 GLY N N 32 114.247 114.247 114.902 -0.655 25289 1097 1 8 . 1 1 32 32 GLY C C 32 171.545 171.545 173.995 -2.450 25289 1098 1 8 . 1 1 32 32 GLY CA C 32 48.711 48.711 45.917 2.794 25289 1099 1 8 . 1 1 33 33 LEU N N 33 125.458 125.458 115.729 9.729 25289 1100 1 8 . 1 1 33 33 LEU C C 33 173.806 173.806 175.096 -1.290 25289 1101 1 8 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.846 0.278 25289 1102 1 8 . 1 1 33 33 LEU CB C 33 45.854 45.854 43.043 2.811 25289 1103 1 8 . 1 1 34 34 MET N N 34 126.372 126.372 121.430 4.942 25289 1104 1 8 . 1 1 34 34 MET C C 34 173.609 173.609 174.989 -1.380 25289 1105 1 8 . 1 1 34 34 MET CA C 34 53.644 53.644 54.993 -1.349 25289 1106 1 8 . 1 1 34 34 MET CB C 34 37.230 37.230 33.966 3.264 25289 1107 1 8 . 1 1 35 35 VAL N N 35 125.387 125.387 123.577 1.810 25289 1108 1 8 . 1 1 35 35 VAL C C 35 176.204 176.204 176.461 -0.257 25289 1109 1 8 . 1 1 35 35 VAL CA C 35 58.717 58.717 61.885 -3.168 25289 1110 1 8 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.369 3.698 25289 1111 1 8 . 1 1 36 36 GLY N N 36 117.182 117.182 113.878 3.304 25289 1112 1 8 . 1 1 36 36 GLY C C 36 173.838 173.838 174.768 -0.930 25289 1113 1 8 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.100 3.252 25289 1114 1 8 . 1 1 37 37 GLY N N 37 105.656 105.656 106.316 -0.660 25289 1115 1 8 . 1 1 37 37 GLY C C 37 169.824 169.824 172.981 -3.157 25289 1116 1 8 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.307 0.667 25289 1117 1 8 . 1 1 38 38 VAL N N 38 118.585 118.585 119.341 -0.756 25289 1118 1 8 . 1 1 38 38 VAL C C 38 172.917 172.917 174.526 -1.609 25289 1119 1 8 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.173 -0.628 25289 1120 1 8 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.286 3.447 25289 1121 1 9 . 1 1 2 2 ALA N N 2 118.014 118.014 123.240 -5.226 25289 1122 1 9 . 1 1 2 2 ALA C C 2 177.737 177.737 178.553 -0.816 25289 1123 1 9 . 1 1 2 2 ALA CA C 2 51.880 51.880 52.526 -0.646 25289 1124 1 9 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.071 -3.379 25289 1125 1 9 . 1 1 3 3 GLU N N 3 121.987 121.987 122.677 -0.690 25289 1126 1 9 . 1 1 3 3 GLU C C 3 176.622 176.622 176.187 0.435 25289 1127 1 9 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.110 4.394 25289 1128 1 9 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.137 -0.515 25289 1129 1 9 . 1 1 4 4 PHE N N 4 114.820 114.820 118.032 -3.212 25289 1130 1 9 . 1 1 4 4 PHE C C 4 175.867 175.867 174.913 0.954 25289 1131 1 9 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.807 0.177 25289 1132 1 9 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.543 1.157 25289 1133 1 9 . 1 1 5 5 ARG N N 5 132.201 132.201 126.354 5.847 25289 1134 1 9 . 1 1 5 5 ARG C C 5 173.318 173.318 175.151 -1.833 25289 1135 1 9 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.713 -1.077 25289 1136 1 9 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.435 2.288 25289 1137 1 9 . 1 1 6 6 HIS N N 6 126.106 126.106 122.141 3.965 25289 1138 1 9 . 1 1 6 6 HIS C C 6 171.847 171.847 174.546 -2.699 25289 1139 1 9 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.045 -4.876 25289 1140 1 9 . 1 1 6 6 HIS CB C 6 32.337 32.337 31.028 1.309 25289 1141 1 9 . 1 1 7 7 ASP N N 7 129.834 129.834 125.734 4.100 25289 1142 1 9 . 1 1 7 7 ASP C C 7 173.950 173.950 174.746 -0.796 25289 1143 1 9 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.388 -1.965 25289 1144 1 9 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.291 0.733 25289 1145 1 9 . 1 1 8 8 SER N N 8 116.727 116.727 118.763 -2.036 25289 1146 1 9 . 1 1 8 8 SER C C 8 175.357 175.357 175.158 0.199 25289 1147 1 9 . 1 1 8 8 SER CA C 8 55.033 55.033 57.679 -2.646 25289 1148 1 9 . 1 1 8 8 SER CB C 8 66.184 66.184 65.946 0.238 25289 1149 1 9 . 1 1 9 9 GLY N N 9 112.188 112.188 111.975 0.213 25289 1150 1 9 . 1 1 9 9 GLY C C 9 173.834 173.834 174.430 -0.596 25289 1151 1 9 . 1 1 9 9 GLY CA C 9 47.196 47.196 46.338 0.858 25289 1152 1 9 . 1 1 10 10 TYR N N 10 126.552 126.552 119.660 6.892 25289 1153 1 9 . 1 1 10 10 TYR C C 10 172.647 172.647 174.219 -1.572 25289 1154 1 9 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.008 1.022 25289 1155 1 9 . 1 1 10 10 TYR CB C 10 42.069 42.069 39.972 2.097 25289 1156 1 9 . 1 1 11 11 GLU N N 11 130.897 130.897 127.310 3.587 25289 1157 1 9 . 1 1 11 11 GLU CA C 11 54.828 54.828 56.074 -1.246 25289 1158 1 9 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.319 2.013 25289 1159 1 9 . 1 1 12 12 VAL N N 12 126.150 126.150 125.187 0.963 25289 1160 1 9 . 1 1 12 12 VAL C C 12 175.777 175.777 175.170 0.607 25289 1161 1 9 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.303 -1.751 25289 1162 1 9 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.718 1.148 25289 1163 1 9 . 1 1 13 13 HIS N N 13 125.956 125.956 125.880 0.076 25289 1164 1 9 . 1 1 13 13 HIS C C 13 173.570 173.570 174.453 -0.883 25289 1165 1 9 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.619 -5.175 25289 1166 1 9 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.776 2.614 25289 1167 1 9 . 1 1 14 14 HIS N N 14 118.068 118.068 123.303 -5.235 25289 1168 1 9 . 1 1 14 14 HIS C C 14 173.557 173.557 174.642 -1.085 25289 1169 1 9 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.523 -0.625 25289 1170 1 9 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.870 1.099 25289 1171 1 9 . 1 1 15 15 GLN N N 15 108.832 108.832 122.665 -13.833 25289 1172 1 9 . 1 1 15 15 GLN C C 15 175.161 175.161 175.057 0.104 25289 1173 1 9 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.218 -0.483 25289 1174 1 9 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.361 2.672 25289 1175 1 9 . 1 1 16 16 LYS N N 16 120.134 120.134 124.206 -4.072 25289 1176 1 9 . 1 1 16 16 LYS C C 16 174.135 174.135 175.193 -1.058 25289 1177 1 9 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.196 -1.035 25289 1178 1 9 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.449 3.228 25289 1179 1 9 . 1 1 17 17 LEU N N 17 128.053 128.053 126.107 1.946 25289 1180 1 9 . 1 1 17 17 LEU C C 17 174.949 174.949 175.812 -0.863 25289 1181 1 9 . 1 1 17 17 LEU CA C 17 54.624 54.624 53.819 0.805 25289 1182 1 9 . 1 1 17 17 LEU CB C 17 44.696 44.696 41.968 2.728 25289 1183 1 9 . 1 1 18 18 VAL N N 18 123.642 123.642 124.882 -1.240 25289 1184 1 9 . 1 1 18 18 VAL C C 18 172.776 172.776 175.471 -2.695 25289 1185 1 9 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.800 -0.043 25289 1186 1 9 . 1 1 18 18 VAL CB C 18 33.817 33.817 31.768 2.049 25289 1187 1 9 . 1 1 19 19 PHE N N 19 129.487 129.487 127.933 1.554 25289 1188 1 9 . 1 1 19 19 PHE C C 19 174.192 174.192 175.262 -1.070 25289 1189 1 9 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.620 -0.045 25289 1190 1 9 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.257 4.174 25289 1191 1 9 . 1 1 20 20 PHE N N 20 117.543 117.543 122.491 -4.948 25289 1192 1 9 . 1 1 20 20 PHE C C 20 170.932 170.932 174.395 -3.463 25289 1193 1 9 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.964 0.715 25289 1194 1 9 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.998 -5.075 25289 1195 1 9 . 1 1 21 21 ALA N N 21 115.079 115.079 125.859 -10.780 25289 1196 1 9 . 1 1 21 21 ALA C C 21 177.230 177.230 176.481 0.749 25289 1197 1 9 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.610 -2.618 25289 1198 1 9 . 1 1 21 21 ALA CB C 21 23.188 23.188 21.347 1.841 25289 1199 1 9 . 1 1 22 22 ASP N N 22 118.083 118.083 120.655 -2.572 25289 1200 1 9 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.900 0.569 25289 1201 1 9 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.321 -1.254 25289 1202 1 9 . 1 1 23 23 VAL N N 23 118.167 118.167 120.553 -2.386 25289 1203 1 9 . 1 1 23 23 VAL C C 23 177.102 177.102 176.436 0.666 25289 1204 1 9 . 1 1 23 23 VAL CA C 23 58.358 58.358 60.988 -2.630 25289 1205 1 9 . 1 1 23 23 VAL CB C 23 36.811 36.811 33.877 2.934 25289 1206 1 9 . 1 1 24 24 GLY N N 24 116.706 116.706 116.068 0.638 25289 1207 1 9 . 1 1 24 24 GLY C C 24 175.652 175.652 174.624 1.028 25289 1208 1 9 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.836 3.026 25289 1209 1 9 . 1 1 25 25 SER N N 25 114.116 114.116 114.299 -0.183 25289 1210 1 9 . 1 1 25 25 SER C C 25 171.430 171.430 173.038 -1.608 25289 1211 1 9 . 1 1 25 25 SER CA C 25 57.801 57.801 58.175 -0.374 25289 1212 1 9 . 1 1 25 25 SER CB C 25 66.227 66.227 64.867 1.360 25289 1213 1 9 . 1 1 26 26 ASN N N 26 124.399 124.399 122.600 1.799 25289 1214 1 9 . 1 1 26 26 ASN C C 26 174.397 174.397 174.653 -0.256 25289 1215 1 9 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.250 -0.501 25289 1216 1 9 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.191 1.635 25289 1217 1 9 . 1 1 27 27 LYS N N 27 119.929 119.929 124.699 -4.770 25289 1218 1 9 . 1 1 27 27 LYS C C 27 174.254 174.254 176.823 -2.569 25289 1219 1 9 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.645 -0.855 25289 1220 1 9 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.240 5.131 25289 1221 1 9 . 1 1 28 28 GLY N N 28 110.364 110.364 109.789 0.575 25289 1222 1 9 . 1 1 28 28 GLY C C 28 170.924 170.924 173.911 -2.987 25289 1223 1 9 . 1 1 28 28 GLY CA C 28 44.986 44.986 44.781 0.205 25289 1224 1 9 . 1 1 29 29 ALA N N 29 131.126 131.126 125.767 5.359 25289 1225 1 9 . 1 1 29 29 ALA C C 29 174.741 174.741 177.119 -2.378 25289 1226 1 9 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.697 -1.540 25289 1227 1 9 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.279 0.902 25289 1228 1 9 . 1 1 30 30 ILE N N 30 124.057 124.057 123.968 0.089 25289 1229 1 9 . 1 1 30 30 ILE C C 30 174.412 174.412 174.641 -0.229 25289 1230 1 9 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.054 -2.302 25289 1231 1 9 . 1 1 30 30 ILE CB C 30 38.797 38.797 36.926 1.871 25289 1232 1 9 . 1 1 31 31 ILE N N 31 125.346 125.346 127.053 -1.707 25289 1233 1 9 . 1 1 31 31 ILE C C 31 175.726 175.726 175.689 0.037 25289 1234 1 9 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.330 -1.892 25289 1235 1 9 . 1 1 31 31 ILE CB C 31 41.749 41.749 39.675 2.074 25289 1236 1 9 . 1 1 32 32 GLY N N 32 114.247 114.247 114.797 -0.550 25289 1237 1 9 . 1 1 32 32 GLY C C 32 171.545 171.545 173.904 -2.359 25289 1238 1 9 . 1 1 32 32 GLY CA C 32 48.711 48.711 45.981 2.729 25289 1239 1 9 . 1 1 33 33 LEU N N 33 125.458 125.458 115.663 9.795 25289 1240 1 9 . 1 1 33 33 LEU C C 33 173.806 173.806 175.152 -1.346 25289 1241 1 9 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.795 0.329 25289 1242 1 9 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.980 2.874 25289 1243 1 9 . 1 1 34 34 MET N N 34 126.372 126.372 121.305 5.067 25289 1244 1 9 . 1 1 34 34 MET C C 34 173.609 173.609 175.046 -1.437 25289 1245 1 9 . 1 1 34 34 MET CA C 34 53.644 53.644 54.915 -1.271 25289 1246 1 9 . 1 1 34 34 MET CB C 34 37.230 37.230 33.862 3.368 25289 1247 1 9 . 1 1 35 35 VAL N N 35 125.387 125.387 124.449 0.938 25289 1248 1 9 . 1 1 35 35 VAL C C 35 176.204 176.204 176.701 -0.497 25289 1249 1 9 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.219 -3.502 25289 1250 1 9 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.534 3.533 25289 1251 1 9 . 1 1 36 36 GLY N N 36 117.182 117.182 113.602 3.580 25289 1252 1 9 . 1 1 36 36 GLY C C 36 173.838 173.838 173.946 -0.108 25289 1253 1 9 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.614 2.739 25289 1254 1 9 . 1 1 37 37 GLY N N 37 105.656 105.656 105.813 -0.157 25289 1255 1 9 . 1 1 37 37 GLY C C 37 169.824 169.824 172.938 -3.114 25289 1256 1 9 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.464 0.510 25289 1257 1 9 . 1 1 38 38 VAL N N 38 118.585 118.585 117.488 1.097 25289 1258 1 9 . 1 1 38 38 VAL C C 38 172.917 172.917 174.989 -2.072 25289 1259 1 9 . 1 1 38 38 VAL CA C 38 60.545 60.545 59.007 1.538 25289 1260 1 9 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.863 2.870 25289 1261 1 10 . 1 1 2 2 ALA N N 2 118.014 118.014 124.539 -6.525 25289 1262 1 10 . 1 1 2 2 ALA C C 2 177.737 177.737 178.382 -0.645 25289 1263 1 10 . 1 1 2 2 ALA CA C 2 51.880 51.880 52.021 -0.141 25289 1264 1 10 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.947 -3.255 25289 1265 1 10 . 1 1 3 3 GLU N N 3 121.987 121.987 121.247 0.740 25289 1266 1 10 . 1 1 3 3 GLU C C 3 176.622 176.622 176.502 0.120 25289 1267 1 10 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.238 4.266 25289 1268 1 10 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.158 -0.535 25289 1269 1 10 . 1 1 4 4 PHE N N 4 114.820 114.820 117.679 -2.859 25289 1270 1 10 . 1 1 4 4 PHE C C 4 175.867 175.867 174.585 1.282 25289 1271 1 10 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.954 0.030 25289 1272 1 10 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.628 1.072 25289 1273 1 10 . 1 1 5 5 ARG N N 5 132.201 132.201 126.415 5.786 25289 1274 1 10 . 1 1 5 5 ARG C C 5 173.318 173.318 175.087 -1.769 25289 1275 1 10 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.538 -0.902 25289 1276 1 10 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.265 2.458 25289 1277 1 10 . 1 1 6 6 HIS N N 6 126.106 126.106 123.293 2.813 25289 1278 1 10 . 1 1 6 6 HIS C C 6 171.847 171.847 174.581 -2.734 25289 1279 1 10 . 1 1 6 6 HIS CA C 6 51.169 51.169 55.872 -4.703 25289 1280 1 10 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.573 1.764 25289 1281 1 10 . 1 1 7 7 ASP N N 7 129.834 129.834 126.988 2.846 25289 1282 1 10 . 1 1 7 7 ASP C C 7 173.950 173.950 175.117 -1.167 25289 1283 1 10 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.940 -1.516 25289 1284 1 10 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.186 0.838 25289 1285 1 10 . 1 1 8 8 SER N N 8 116.727 116.727 117.480 -0.753 25289 1286 1 10 . 1 1 8 8 SER C C 8 175.357 175.357 174.820 0.537 25289 1287 1 10 . 1 1 8 8 SER CA C 8 55.033 55.033 57.632 -2.599 25289 1288 1 10 . 1 1 8 8 SER CB C 8 66.184 66.184 65.169 1.015 25289 1289 1 10 . 1 1 9 9 GLY N N 9 112.188 112.188 107.775 4.413 25289 1290 1 10 . 1 1 9 9 GLY C C 9 173.834 173.834 173.607 0.227 25289 1291 1 10 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.502 1.694 25289 1292 1 10 . 1 1 10 10 TYR N N 10 126.552 126.552 120.094 6.458 25289 1293 1 10 . 1 1 10 10 TYR C C 10 172.647 172.647 174.211 -1.564 25289 1294 1 10 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.609 0.422 25289 1295 1 10 . 1 1 10 10 TYR CB C 10 42.069 42.069 39.625 2.444 25289 1296 1 10 . 1 1 11 11 GLU N N 11 130.897 130.897 125.788 5.109 25289 1297 1 10 . 1 1 11 11 GLU CA C 11 54.828 54.828 56.163 -1.335 25289 1298 1 10 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.282 2.050 25289 1299 1 10 . 1 1 12 12 VAL N N 12 126.150 126.150 124.681 1.469 25289 1300 1 10 . 1 1 12 12 VAL C C 12 175.777 175.777 174.807 0.970 25289 1301 1 10 . 1 1 12 12 VAL CA C 12 60.552 60.552 61.876 -1.324 25289 1302 1 10 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.367 1.499 25289 1303 1 10 . 1 1 13 13 HIS N N 13 125.956 125.956 125.432 0.524 25289 1304 1 10 . 1 1 13 13 HIS C C 13 173.570 173.570 174.808 -1.238 25289 1305 1 10 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.151 -4.707 25289 1306 1 10 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.087 2.303 25289 1307 1 10 . 1 1 14 14 HIS N N 14 118.068 118.068 122.744 -4.676 25289 1308 1 10 . 1 1 14 14 HIS C C 14 173.557 173.557 174.636 -1.079 25289 1309 1 10 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.646 -0.748 25289 1310 1 10 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.071 0.898 25289 1311 1 10 . 1 1 15 15 GLN N N 15 108.832 108.832 122.276 -13.444 25289 1312 1 10 . 1 1 15 15 GLN C C 15 175.161 175.161 175.052 0.109 25289 1313 1 10 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.321 -0.586 25289 1314 1 10 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.250 2.784 25289 1315 1 10 . 1 1 16 16 LYS N N 16 120.134 120.134 124.729 -4.595 25289 1316 1 10 . 1 1 16 16 LYS C C 16 174.135 174.135 175.095 -0.960 25289 1317 1 10 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.199 -1.038 25289 1318 1 10 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.315 3.362 25289 1319 1 10 . 1 1 17 17 LEU N N 17 128.053 128.053 126.316 1.737 25289 1320 1 10 . 1 1 17 17 LEU C C 17 174.949 174.949 175.427 -0.478 25289 1321 1 10 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.073 0.551 25289 1322 1 10 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.131 2.565 25289 1323 1 10 . 1 1 18 18 VAL N N 18 123.642 123.642 123.998 -0.356 25289 1324 1 10 . 1 1 18 18 VAL C C 18 172.776 172.776 175.635 -2.859 25289 1325 1 10 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.200 0.557 25289 1326 1 10 . 1 1 18 18 VAL CB C 18 33.817 33.817 31.491 2.325 25289 1327 1 10 . 1 1 19 19 PHE N N 19 129.487 129.487 127.355 2.132 25289 1328 1 10 . 1 1 19 19 PHE C C 19 174.192 174.192 175.644 -1.452 25289 1329 1 10 . 1 1 19 19 PHE CA C 19 55.575 55.575 56.053 -0.478 25289 1330 1 10 . 1 1 19 19 PHE CB C 19 42.431 42.431 39.592 2.839 25289 1331 1 10 . 1 1 20 20 PHE N N 20 117.543 117.543 118.269 -0.726 25289 1332 1 10 . 1 1 20 20 PHE C C 20 170.932 170.932 174.672 -3.740 25289 1333 1 10 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.220 0.459 25289 1334 1 10 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.319 -4.396 25289 1335 1 10 . 1 1 21 21 ALA N N 21 115.079 115.079 122.502 -7.423 25289 1336 1 10 . 1 1 21 21 ALA C C 21 177.230 177.230 177.265 -0.035 25289 1337 1 10 . 1 1 21 21 ALA CA C 21 48.992 48.992 52.269 -3.277 25289 1338 1 10 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.720 3.468 25289 1339 1 10 . 1 1 22 22 ASP N N 22 118.083 118.083 121.009 -2.926 25289 1340 1 10 . 1 1 22 22 ASP CA C 22 55.469 55.469 55.073 0.396 25289 1341 1 10 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.688 -1.621 25289 1342 1 10 . 1 1 23 23 VAL N N 23 118.167 118.167 119.467 -1.300 25289 1343 1 10 . 1 1 23 23 VAL C C 23 177.102 177.102 176.629 0.473 25289 1344 1 10 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.296 -2.938 25289 1345 1 10 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.794 2.017 25289 1346 1 10 . 1 1 24 24 GLY N N 24 116.706 116.706 114.671 2.035 25289 1347 1 10 . 1 1 24 24 GLY C C 24 175.652 175.652 174.618 1.034 25289 1348 1 10 . 1 1 24 24 GLY CA C 24 48.862 48.862 46.164 2.698 25289 1349 1 10 . 1 1 25 25 SER N N 25 114.116 114.116 113.408 0.708 25289 1350 1 10 . 1 1 25 25 SER C C 25 171.430 171.430 173.034 -1.604 25289 1351 1 10 . 1 1 25 25 SER CA C 25 57.801 57.801 58.575 -0.775 25289 1352 1 10 . 1 1 25 25 SER CB C 25 66.227 66.227 64.698 1.529 25289 1353 1 10 . 1 1 26 26 ASN N N 26 124.399 124.399 121.565 2.834 25289 1354 1 10 . 1 1 26 26 ASN C C 26 174.397 174.397 174.634 -0.237 25289 1355 1 10 . 1 1 26 26 ASN CA C 26 52.749 52.749 52.901 -0.152 25289 1356 1 10 . 1 1 26 26 ASN CB C 26 40.826 40.826 38.776 2.050 25289 1357 1 10 . 1 1 27 27 LYS N N 27 119.929 119.929 122.736 -2.807 25289 1358 1 10 . 1 1 27 27 LYS C C 27 174.254 174.254 177.103 -2.849 25289 1359 1 10 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.333 -0.543 25289 1360 1 10 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.559 4.811 25289 1361 1 10 . 1 1 28 28 GLY N N 28 110.364 110.364 109.606 0.758 25289 1362 1 10 . 1 1 28 28 GLY C C 28 170.924 170.924 173.668 -2.744 25289 1363 1 10 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.085 -0.099 25289 1364 1 10 . 1 1 29 29 ALA N N 29 131.126 131.126 125.335 5.791 25289 1365 1 10 . 1 1 29 29 ALA C C 29 174.741 174.741 176.513 -1.772 25289 1366 1 10 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.923 -1.766 25289 1367 1 10 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.294 0.887 25289 1368 1 10 . 1 1 30 30 ILE N N 30 124.057 124.057 123.273 0.784 25289 1369 1 10 . 1 1 30 30 ILE C C 30 174.412 174.412 175.234 -0.822 25289 1370 1 10 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.272 -3.520 25289 1371 1 10 . 1 1 30 30 ILE CB C 30 38.797 38.797 40.242 -1.445 25289 1372 1 10 . 1 1 31 31 ILE N N 31 125.346 125.346 125.934 -0.588 25289 1373 1 10 . 1 1 31 31 ILE C C 31 175.726 175.726 176.220 -0.494 25289 1374 1 10 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.721 -2.283 25289 1375 1 10 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.988 0.761 25289 1376 1 10 . 1 1 32 32 GLY N N 32 114.247 114.247 115.547 -1.300 25289 1377 1 10 . 1 1 32 32 GLY C C 32 171.545 171.545 174.282 -2.737 25289 1378 1 10 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.111 2.599 25289 1379 1 10 . 1 1 33 33 LEU N N 33 125.458 125.458 116.462 8.996 25289 1380 1 10 . 1 1 33 33 LEU C C 33 173.806 173.806 175.147 -1.341 25289 1381 1 10 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.763 0.361 25289 1382 1 10 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.971 2.883 25289 1383 1 10 . 1 1 34 34 MET N N 34 126.372 126.372 121.375 4.997 25289 1384 1 10 . 1 1 34 34 MET C C 34 173.609 173.609 175.229 -1.620 25289 1385 1 10 . 1 1 34 34 MET CA C 34 53.644 53.644 55.139 -1.495 25289 1386 1 10 . 1 1 34 34 MET CB C 34 37.230 37.230 34.182 3.048 25289 1387 1 10 . 1 1 35 35 VAL N N 35 125.387 125.387 123.657 1.730 25289 1388 1 10 . 1 1 35 35 VAL C C 35 176.204 176.204 176.437 -0.233 25289 1389 1 10 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.219 -3.502 25289 1390 1 10 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.413 3.654 25289 1391 1 10 . 1 1 36 36 GLY N N 36 117.182 117.182 113.510 3.672 25289 1392 1 10 . 1 1 36 36 GLY C C 36 173.838 173.838 174.819 -0.981 25289 1393 1 10 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.132 3.221 25289 1394 1 10 . 1 1 37 37 GLY N N 37 105.656 105.656 107.247 -1.591 25289 1395 1 10 . 1 1 37 37 GLY C C 37 169.824 169.824 173.724 -3.900 25289 1396 1 10 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.347 0.627 25289 1397 1 10 . 1 1 38 38 VAL N N 38 118.585 118.585 118.303 0.282 25289 1398 1 10 . 1 1 38 38 VAL C C 38 172.917 172.917 174.051 -1.134 25289 1399 1 10 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.757 -1.212 25289 1400 1 10 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.197 3.536 25289 1401 1 11 . 1 1 2 2 ALA N N 2 118.014 118.014 127.132 -9.118 25289 1402 1 11 . 1 1 2 2 ALA C C 2 177.737 177.737 178.007 -0.270 25289 1403 1 11 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.479 0.401 25289 1404 1 11 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.987 -3.295 25289 1405 1 11 . 1 1 3 3 GLU N N 3 121.987 121.987 122.740 -0.753 25289 1406 1 11 . 1 1 3 3 GLU C C 3 176.622 176.622 176.433 0.189 25289 1407 1 11 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.618 3.886 25289 1408 1 11 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.064 -0.441 25289 1409 1 11 . 1 1 4 4 PHE N N 4 114.820 114.820 117.554 -2.734 25289 1410 1 11 . 1 1 4 4 PHE C C 4 175.867 175.867 174.673 1.194 25289 1411 1 11 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.987 -0.003 25289 1412 1 11 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.668 1.032 25289 1413 1 11 . 1 1 5 5 ARG N N 5 132.201 132.201 127.115 5.086 25289 1414 1 11 . 1 1 5 5 ARG C C 5 173.318 173.318 175.318 -2.000 25289 1415 1 11 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.858 -1.222 25289 1416 1 11 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.507 2.216 25289 1417 1 11 . 1 1 6 6 HIS N N 6 126.106 126.106 124.048 2.058 25289 1418 1 11 . 1 1 6 6 HIS C C 6 171.847 171.847 174.652 -2.805 25289 1419 1 11 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.039 -4.870 25289 1420 1 11 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.676 1.661 25289 1421 1 11 . 1 1 7 7 ASP N N 7 129.834 129.834 126.357 3.477 25289 1422 1 11 . 1 1 7 7 ASP C C 7 173.950 173.950 175.008 -1.058 25289 1423 1 11 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.840 -1.417 25289 1424 1 11 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.079 0.945 25289 1425 1 11 . 1 1 8 8 SER N N 8 116.727 116.727 117.531 -0.804 25289 1426 1 11 . 1 1 8 8 SER C C 8 175.357 175.357 174.791 0.566 25289 1427 1 11 . 1 1 8 8 SER CA C 8 55.033 55.033 57.710 -2.677 25289 1428 1 11 . 1 1 8 8 SER CB C 8 66.184 66.184 64.376 1.808 25289 1429 1 11 . 1 1 9 9 GLY N N 9 112.188 112.188 109.788 2.400 25289 1430 1 11 . 1 1 9 9 GLY C C 9 173.834 173.834 172.858 0.976 25289 1431 1 11 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.497 1.699 25289 1432 1 11 . 1 1 10 10 TYR N N 10 126.552 126.552 119.862 6.690 25289 1433 1 11 . 1 1 10 10 TYR C C 10 172.647 172.647 173.835 -1.188 25289 1434 1 11 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.439 0.592 25289 1435 1 11 . 1 1 10 10 TYR CB C 10 42.069 42.069 41.031 1.038 25289 1436 1 11 . 1 1 11 11 GLU N N 11 130.897 130.897 127.750 3.147 25289 1437 1 11 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.927 -1.099 25289 1438 1 11 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.416 1.917 25289 1439 1 11 . 1 1 12 12 VAL N N 12 126.150 126.150 125.816 0.334 25289 1440 1 11 . 1 1 12 12 VAL C C 12 175.777 175.777 174.985 0.792 25289 1441 1 11 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.096 -1.544 25289 1442 1 11 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.338 1.528 25289 1443 1 11 . 1 1 13 13 HIS N N 13 125.956 125.956 125.652 0.304 25289 1444 1 11 . 1 1 13 13 HIS C C 13 173.570 173.570 174.525 -0.955 25289 1445 1 11 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.176 -4.732 25289 1446 1 11 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.928 2.462 25289 1447 1 11 . 1 1 14 14 HIS N N 14 118.068 118.068 122.729 -4.661 25289 1448 1 11 . 1 1 14 14 HIS C C 14 173.557 173.557 174.545 -0.988 25289 1449 1 11 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.638 -0.740 25289 1450 1 11 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.220 0.749 25289 1451 1 11 . 1 1 15 15 GLN N N 15 108.832 108.832 122.372 -13.540 25289 1452 1 11 . 1 1 15 15 GLN C C 15 175.161 175.161 175.054 0.107 25289 1453 1 11 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.300 -0.565 25289 1454 1 11 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.207 2.826 25289 1455 1 11 . 1 1 16 16 LYS N N 16 120.134 120.134 124.787 -4.653 25289 1456 1 11 . 1 1 16 16 LYS C C 16 174.135 174.135 175.083 -0.948 25289 1457 1 11 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.147 -0.986 25289 1458 1 11 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.270 3.408 25289 1459 1 11 . 1 1 17 17 LEU N N 17 128.053 128.053 126.167 1.886 25289 1460 1 11 . 1 1 17 17 LEU C C 17 174.949 174.949 175.365 -0.416 25289 1461 1 11 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.057 0.567 25289 1462 1 11 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.076 2.620 25289 1463 1 11 . 1 1 18 18 VAL N N 18 123.642 123.642 123.939 -0.297 25289 1464 1 11 . 1 1 18 18 VAL C C 18 172.776 172.776 175.124 -2.348 25289 1465 1 11 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.819 -0.062 25289 1466 1 11 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.134 1.683 25289 1467 1 11 . 1 1 19 19 PHE N N 19 129.487 129.487 127.190 2.297 25289 1468 1 11 . 1 1 19 19 PHE C C 19 174.192 174.192 175.677 -1.485 25289 1469 1 11 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.811 -0.236 25289 1470 1 11 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.968 3.462 25289 1471 1 11 . 1 1 20 20 PHE N N 20 117.543 117.543 122.166 -4.623 25289 1472 1 11 . 1 1 20 20 PHE C C 20 170.932 170.932 174.557 -3.625 25289 1473 1 11 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.809 0.870 25289 1474 1 11 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.125 -5.202 25289 1475 1 11 . 1 1 21 21 ALA N N 21 115.079 115.079 125.867 -10.788 25289 1476 1 11 . 1 1 21 21 ALA C C 21 177.230 177.230 176.714 0.516 25289 1477 1 11 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.937 -2.945 25289 1478 1 11 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.595 3.593 25289 1479 1 11 . 1 1 22 22 ASP N N 22 118.083 118.083 122.990 -4.907 25289 1480 1 11 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.654 0.815 25289 1481 1 11 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.668 -1.601 25289 1482 1 11 . 1 1 23 23 VAL N N 23 118.167 118.167 121.962 -3.795 25289 1483 1 11 . 1 1 23 23 VAL C C 23 177.102 177.102 177.013 0.089 25289 1484 1 11 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.251 -2.893 25289 1485 1 11 . 1 1 23 23 VAL CB C 23 36.811 36.811 32.782 4.029 25289 1486 1 11 . 1 1 24 24 GLY N N 24 116.706 116.706 116.021 0.685 25289 1487 1 11 . 1 1 24 24 GLY C C 24 175.652 175.652 174.411 1.241 25289 1488 1 11 . 1 1 24 24 GLY CA C 24 48.862 48.862 46.132 2.731 25289 1489 1 11 . 1 1 25 25 SER N N 25 114.116 114.116 115.860 -1.744 25289 1490 1 11 . 1 1 25 25 SER C C 25 171.430 171.430 173.389 -1.959 25289 1491 1 11 . 1 1 25 25 SER CA C 25 57.801 57.801 57.849 -0.048 25289 1492 1 11 . 1 1 25 25 SER CB C 25 66.227 66.227 64.854 1.373 25289 1493 1 11 . 1 1 26 26 ASN N N 26 124.399 124.399 122.931 1.468 25289 1494 1 11 . 1 1 26 26 ASN C C 26 174.397 174.397 174.449 -0.052 25289 1495 1 11 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.212 -0.462 25289 1496 1 11 . 1 1 26 26 ASN CB C 26 40.826 40.826 38.899 1.927 25289 1497 1 11 . 1 1 27 27 LYS N N 27 119.929 119.929 124.603 -4.674 25289 1498 1 11 . 1 1 27 27 LYS C C 27 174.254 174.254 176.743 -2.489 25289 1499 1 11 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.825 -1.036 25289 1500 1 11 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.059 5.312 25289 1501 1 11 . 1 1 28 28 GLY N N 28 110.364 110.364 111.679 -1.315 25289 1502 1 11 . 1 1 28 28 GLY C C 28 170.924 170.924 173.761 -2.837 25289 1503 1 11 . 1 1 28 28 GLY CA C 28 44.986 44.986 44.718 0.268 25289 1504 1 11 . 1 1 29 29 ALA N N 29 131.126 131.126 125.527 5.599 25289 1505 1 11 . 1 1 29 29 ALA C C 29 174.741 174.741 177.067 -2.326 25289 1506 1 11 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.858 -1.701 25289 1507 1 11 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.259 0.923 25289 1508 1 11 . 1 1 30 30 ILE N N 30 124.057 124.057 123.753 0.304 25289 1509 1 11 . 1 1 30 30 ILE C C 30 174.412 174.412 174.435 -0.023 25289 1510 1 11 . 1 1 30 30 ILE CA C 30 57.752 57.752 59.999 -2.247 25289 1511 1 11 . 1 1 30 30 ILE CB C 30 38.797 38.797 37.092 1.705 25289 1512 1 11 . 1 1 31 31 ILE N N 31 125.346 125.346 126.585 -1.239 25289 1513 1 11 . 1 1 31 31 ILE C C 31 175.726 175.726 175.568 0.158 25289 1514 1 11 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.221 -1.784 25289 1515 1 11 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.404 1.345 25289 1516 1 11 . 1 1 32 32 GLY N N 32 114.247 114.247 113.642 0.605 25289 1517 1 11 . 1 1 32 32 GLY C C 32 171.545 171.545 173.463 -1.918 25289 1518 1 11 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.205 2.506 25289 1519 1 11 . 1 1 33 33 LEU N N 33 125.458 125.458 115.689 9.769 25289 1520 1 11 . 1 1 33 33 LEU C C 33 173.806 173.806 174.708 -0.902 25289 1521 1 11 . 1 1 33 33 LEU CA C 33 54.124 54.124 54.585 -0.461 25289 1522 1 11 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.704 3.150 25289 1523 1 11 . 1 1 34 34 MET N N 34 126.372 126.372 121.886 4.486 25289 1524 1 11 . 1 1 34 34 MET C C 34 173.609 173.609 174.766 -1.157 25289 1525 1 11 . 1 1 34 34 MET CA C 34 53.644 53.644 54.803 -1.159 25289 1526 1 11 . 1 1 34 34 MET CB C 34 37.230 37.230 33.146 4.084 25289 1527 1 11 . 1 1 35 35 VAL N N 35 125.387 125.387 124.852 0.535 25289 1528 1 11 . 1 1 35 35 VAL C C 35 176.204 176.204 175.958 0.246 25289 1529 1 11 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.367 -3.650 25289 1530 1 11 . 1 1 35 35 VAL CB C 35 36.067 36.067 33.494 2.573 25289 1531 1 11 . 1 1 36 36 GLY N N 36 117.182 117.182 114.578 2.604 25289 1532 1 11 . 1 1 36 36 GLY C C 36 173.838 173.838 174.534 -0.696 25289 1533 1 11 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.065 3.288 25289 1534 1 11 . 1 1 37 37 GLY N N 37 105.656 105.656 106.612 -0.956 25289 1535 1 11 . 1 1 37 37 GLY C C 37 169.824 169.824 172.917 -3.093 25289 1536 1 11 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.475 0.499 25289 1537 1 11 . 1 1 38 38 VAL N N 38 118.585 118.585 118.350 0.235 25289 1538 1 11 . 1 1 38 38 VAL C C 38 172.917 172.917 175.554 -2.637 25289 1539 1 11 . 1 1 38 38 VAL CA C 38 60.545 60.545 60.653 -0.108 25289 1540 1 11 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.743 2.990 25289 1541 1 12 . 1 1 2 2 ALA N N 2 118.014 118.014 126.310 -8.296 25289 1542 1 12 . 1 1 2 2 ALA C C 2 177.737 177.737 178.017 -0.280 25289 1543 1 12 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.563 0.317 25289 1544 1 12 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.216 -3.524 25289 1545 1 12 . 1 1 3 3 GLU N N 3 121.987 121.987 121.613 0.374 25289 1546 1 12 . 1 1 3 3 GLU C C 3 176.622 176.622 176.168 0.454 25289 1547 1 12 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.553 3.950 25289 1548 1 12 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.093 -0.470 25289 1549 1 12 . 1 1 4 4 PHE N N 4 114.820 114.820 117.251 -2.431 25289 1550 1 12 . 1 1 4 4 PHE C C 4 175.867 175.867 174.935 0.932 25289 1551 1 12 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.846 0.138 25289 1552 1 12 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.635 1.065 25289 1553 1 12 . 1 1 5 5 ARG N N 5 132.201 132.201 125.798 6.403 25289 1554 1 12 . 1 1 5 5 ARG C C 5 173.318 173.318 175.347 -2.029 25289 1555 1 12 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.995 -1.359 25289 1556 1 12 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.655 2.068 25289 1557 1 12 . 1 1 6 6 HIS N N 6 126.106 126.106 123.415 2.691 25289 1558 1 12 . 1 1 6 6 HIS C C 6 171.847 171.847 174.588 -2.741 25289 1559 1 12 . 1 1 6 6 HIS CA C 6 51.169 51.169 55.930 -4.761 25289 1560 1 12 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.554 1.783 25289 1561 1 12 . 1 1 7 7 ASP N N 7 129.834 129.834 126.368 3.466 25289 1562 1 12 . 1 1 7 7 ASP C C 7 173.950 173.950 175.244 -1.294 25289 1563 1 12 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.996 -1.573 25289 1564 1 12 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.118 0.906 25289 1565 1 12 . 1 1 8 8 SER N N 8 116.727 116.727 117.584 -0.857 25289 1566 1 12 . 1 1 8 8 SER C C 8 175.357 175.357 174.718 0.639 25289 1567 1 12 . 1 1 8 8 SER CA C 8 55.033 55.033 57.742 -2.709 25289 1568 1 12 . 1 1 8 8 SER CB C 8 66.184 66.184 64.276 1.908 25289 1569 1 12 . 1 1 9 9 GLY N N 9 112.188 112.188 109.456 2.732 25289 1570 1 12 . 1 1 9 9 GLY C C 9 173.834 173.834 173.083 0.751 25289 1571 1 12 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.506 1.690 25289 1572 1 12 . 1 1 10 10 TYR N N 10 126.552 126.552 119.852 6.700 25289 1573 1 12 . 1 1 10 10 TYR C C 10 172.647 172.647 174.175 -1.528 25289 1574 1 12 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.495 0.536 25289 1575 1 12 . 1 1 10 10 TYR CB C 10 42.069 42.069 41.435 0.634 25289 1576 1 12 . 1 1 11 11 GLU N N 11 130.897 130.897 126.126 4.771 25289 1577 1 12 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.827 -0.999 25289 1578 1 12 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.480 1.851 25289 1579 1 12 . 1 1 12 12 VAL N N 12 126.150 126.150 125.462 0.688 25289 1580 1 12 . 1 1 12 12 VAL C C 12 175.777 175.777 174.963 0.814 25289 1581 1 12 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.250 -1.698 25289 1582 1 12 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.344 1.522 25289 1583 1 12 . 1 1 13 13 HIS N N 13 125.956 125.956 125.490 0.466 25289 1584 1 12 . 1 1 13 13 HIS C C 13 173.570 173.570 174.635 -1.065 25289 1585 1 12 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.247 -4.803 25289 1586 1 12 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.995 2.395 25289 1587 1 12 . 1 1 14 14 HIS N N 14 118.068 118.068 123.178 -5.110 25289 1588 1 12 . 1 1 14 14 HIS C C 14 173.557 173.557 174.418 -0.861 25289 1589 1 12 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.827 -0.929 25289 1590 1 12 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.790 1.179 25289 1591 1 12 . 1 1 15 15 GLN N N 15 108.832 108.832 122.918 -14.086 25289 1592 1 12 . 1 1 15 15 GLN C C 15 175.161 175.161 175.096 0.065 25289 1593 1 12 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.332 -0.597 25289 1594 1 12 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.247 2.786 25289 1595 1 12 . 1 1 16 16 LYS N N 16 120.134 120.134 124.838 -4.704 25289 1596 1 12 . 1 1 16 16 LYS C C 16 174.135 174.135 175.120 -0.985 25289 1597 1 12 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.178 -1.016 25289 1598 1 12 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.375 3.302 25289 1599 1 12 . 1 1 17 17 LEU N N 17 128.053 128.053 126.082 1.971 25289 1600 1 12 . 1 1 17 17 LEU C C 17 174.949 174.949 175.899 -0.950 25289 1601 1 12 . 1 1 17 17 LEU CA C 17 54.624 54.624 53.970 0.654 25289 1602 1 12 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.152 2.544 25289 1603 1 12 . 1 1 18 18 VAL N N 18 123.642 123.642 124.804 -1.162 25289 1604 1 12 . 1 1 18 18 VAL C C 18 172.776 172.776 175.504 -2.728 25289 1605 1 12 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.919 -0.162 25289 1606 1 12 . 1 1 18 18 VAL CB C 18 33.817 33.817 31.977 1.840 25289 1607 1 12 . 1 1 19 19 PHE N N 19 129.487 129.487 128.126 1.361 25289 1608 1 12 . 1 1 19 19 PHE C C 19 174.192 174.192 175.232 -1.040 25289 1609 1 12 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.600 -0.025 25289 1610 1 12 . 1 1 19 19 PHE CB C 19 42.431 42.431 37.910 4.521 25289 1611 1 12 . 1 1 20 20 PHE N N 20 117.543 117.543 122.541 -4.998 25289 1612 1 12 . 1 1 20 20 PHE C C 20 170.932 170.932 174.419 -3.487 25289 1613 1 12 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.947 0.732 25289 1614 1 12 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.242 -5.319 25289 1615 1 12 . 1 1 21 21 ALA N N 21 115.079 115.079 125.894 -10.815 25289 1616 1 12 . 1 1 21 21 ALA C C 21 177.230 177.230 176.515 0.715 25289 1617 1 12 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.752 -2.760 25289 1618 1 12 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.770 2.417 25289 1619 1 12 . 1 1 22 22 ASP N N 22 118.083 118.083 120.711 -2.628 25289 1620 1 12 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.839 0.630 25289 1621 1 12 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.594 -1.527 25289 1622 1 12 . 1 1 23 23 VAL N N 23 118.167 118.167 120.951 -2.784 25289 1623 1 12 . 1 1 23 23 VAL C C 23 177.102 177.102 176.791 0.311 25289 1624 1 12 . 1 1 23 23 VAL CA C 23 58.358 58.358 60.976 -2.618 25289 1625 1 12 . 1 1 23 23 VAL CB C 23 36.811 36.811 33.914 2.897 25289 1626 1 12 . 1 1 24 24 GLY N N 24 116.706 116.706 115.507 1.199 25289 1627 1 12 . 1 1 24 24 GLY C C 24 175.652 175.652 174.687 0.965 25289 1628 1 12 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.931 2.931 25289 1629 1 12 . 1 1 25 25 SER N N 25 114.116 114.116 113.850 0.266 25289 1630 1 12 . 1 1 25 25 SER C C 25 171.430 171.430 173.047 -1.617 25289 1631 1 12 . 1 1 25 25 SER CA C 25 57.801 57.801 58.080 -0.279 25289 1632 1 12 . 1 1 25 25 SER CB C 25 66.227 66.227 64.377 1.850 25289 1633 1 12 . 1 1 26 26 ASN N N 26 124.399 124.399 122.154 2.245 25289 1634 1 12 . 1 1 26 26 ASN C C 26 174.397 174.397 174.410 -0.013 25289 1635 1 12 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.041 -0.292 25289 1636 1 12 . 1 1 26 26 ASN CB C 26 40.826 40.826 38.966 1.860 25289 1637 1 12 . 1 1 27 27 LYS N N 27 119.929 119.929 124.261 -4.332 25289 1638 1 12 . 1 1 27 27 LYS C C 27 174.254 174.254 176.960 -2.706 25289 1639 1 12 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.609 -0.819 25289 1640 1 12 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.411 4.960 25289 1641 1 12 . 1 1 28 28 GLY N N 28 110.364 110.364 110.610 -0.246 25289 1642 1 12 . 1 1 28 28 GLY C C 28 170.924 170.924 173.682 -2.758 25289 1643 1 12 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.252 -0.266 25289 1644 1 12 . 1 1 29 29 ALA N N 29 131.126 131.126 126.267 4.859 25289 1645 1 12 . 1 1 29 29 ALA C C 29 174.741 174.741 176.774 -2.033 25289 1646 1 12 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.361 -1.204 25289 1647 1 12 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.465 0.716 25289 1648 1 12 . 1 1 30 30 ILE N N 30 124.057 124.057 121.654 2.403 25289 1649 1 12 . 1 1 30 30 ILE C C 30 174.412 174.412 174.667 -0.255 25289 1650 1 12 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.479 -2.727 25289 1651 1 12 . 1 1 30 30 ILE CB C 30 38.797 38.797 38.252 0.545 25289 1652 1 12 . 1 1 31 31 ILE N N 31 125.346 125.346 125.576 -0.230 25289 1653 1 12 . 1 1 31 31 ILE C C 31 175.726 175.726 175.783 -0.057 25289 1654 1 12 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.227 -1.789 25289 1655 1 12 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.367 1.381 25289 1656 1 12 . 1 1 32 32 GLY N N 32 114.247 114.247 114.328 -0.081 25289 1657 1 12 . 1 1 32 32 GLY C C 32 171.545 171.545 173.942 -2.397 25289 1658 1 12 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.017 2.694 25289 1659 1 12 . 1 1 33 33 LEU N N 33 125.458 125.458 115.541 9.917 25289 1660 1 12 . 1 1 33 33 LEU C C 33 173.806 173.806 175.066 -1.260 25289 1661 1 12 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.792 0.332 25289 1662 1 12 . 1 1 33 33 LEU CB C 33 45.854 45.854 43.134 2.720 25289 1663 1 12 . 1 1 34 34 MET N N 34 126.372 126.372 120.933 5.439 25289 1664 1 12 . 1 1 34 34 MET C C 34 173.609 173.609 174.880 -1.271 25289 1665 1 12 . 1 1 34 34 MET CA C 34 53.644 53.644 55.191 -1.547 25289 1666 1 12 . 1 1 34 34 MET CB C 34 37.230 37.230 33.910 3.320 25289 1667 1 12 . 1 1 35 35 VAL N N 35 125.387 125.387 123.975 1.412 25289 1668 1 12 . 1 1 35 35 VAL C C 35 176.204 176.204 176.064 0.140 25289 1669 1 12 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.204 -3.487 25289 1670 1 12 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.498 3.569 25289 1671 1 12 . 1 1 36 36 GLY N N 36 117.182 117.182 113.802 3.380 25289 1672 1 12 . 1 1 36 36 GLY C C 36 173.838 173.838 174.663 -0.825 25289 1673 1 12 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.879 3.474 25289 1674 1 12 . 1 1 37 37 GLY N N 37 105.656 105.656 107.226 -1.570 25289 1675 1 12 . 1 1 37 37 GLY C C 37 169.824 169.824 173.152 -3.328 25289 1676 1 12 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.393 0.581 25289 1677 1 12 . 1 1 38 38 VAL N N 38 118.585 118.585 118.394 0.191 25289 1678 1 12 . 1 1 38 38 VAL C C 38 172.917 172.917 174.496 -1.579 25289 1679 1 12 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.515 -0.970 25289 1680 1 12 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.889 2.845 25289 1681 1 13 . 1 1 2 2 ALA N N 2 118.014 118.014 126.867 -8.853 25289 1682 1 13 . 1 1 2 2 ALA C C 2 177.737 177.737 177.948 -0.211 25289 1683 1 13 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.606 0.274 25289 1684 1 13 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.980 -3.288 25289 1685 1 13 . 1 1 3 3 GLU N N 3 121.987 121.987 121.503 0.484 25289 1686 1 13 . 1 1 3 3 GLU C C 3 176.622 176.622 176.291 0.331 25289 1687 1 13 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.760 3.744 25289 1688 1 13 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.193 -0.570 25289 1689 1 13 . 1 1 4 4 PHE N N 4 114.820 114.820 117.269 -2.449 25289 1690 1 13 . 1 1 4 4 PHE C C 4 175.867 175.867 174.919 0.948 25289 1691 1 13 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.005 -0.021 25289 1692 1 13 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.884 0.816 25289 1693 1 13 . 1 1 5 5 ARG N N 5 132.201 132.201 126.112 6.089 25289 1694 1 13 . 1 1 5 5 ARG C C 5 173.318 173.318 175.103 -1.785 25289 1695 1 13 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.743 -1.107 25289 1696 1 13 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.569 2.154 25289 1697 1 13 . 1 1 6 6 HIS N N 6 126.106 126.106 122.551 3.555 25289 1698 1 13 . 1 1 6 6 HIS C C 6 171.847 171.847 174.436 -2.589 25289 1699 1 13 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.373 -5.204 25289 1700 1 13 . 1 1 6 6 HIS CB C 6 32.337 32.337 31.432 0.905 25289 1701 1 13 . 1 1 7 7 ASP N N 7 129.834 129.834 124.952 4.882 25289 1702 1 13 . 1 1 7 7 ASP C C 7 173.950 173.950 175.171 -1.221 25289 1703 1 13 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.478 -2.055 25289 1704 1 13 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.406 0.618 25289 1705 1 13 . 1 1 8 8 SER N N 8 116.727 116.727 116.738 -0.011 25289 1706 1 13 . 1 1 8 8 SER C C 8 175.357 175.357 175.238 0.119 25289 1707 1 13 . 1 1 8 8 SER CA C 8 55.033 55.033 57.831 -2.798 25289 1708 1 13 . 1 1 8 8 SER CB C 8 66.184 66.184 64.604 1.580 25289 1709 1 13 . 1 1 9 9 GLY N N 9 112.188 112.188 108.355 3.833 25289 1710 1 13 . 1 1 9 9 GLY C C 9 173.834 173.834 173.062 0.772 25289 1711 1 13 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.801 1.395 25289 1712 1 13 . 1 1 10 10 TYR N N 10 126.552 126.552 119.225 7.327 25289 1713 1 13 . 1 1 10 10 TYR C C 10 172.647 172.647 174.097 -1.450 25289 1714 1 13 . 1 1 10 10 TYR CA C 10 58.031 58.031 56.457 1.574 25289 1715 1 13 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.291 1.778 25289 1716 1 13 . 1 1 11 11 GLU N N 11 130.897 130.897 127.221 3.676 25289 1717 1 13 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.950 -1.121 25289 1718 1 13 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.461 1.871 25289 1719 1 13 . 1 1 12 12 VAL N N 12 126.150 126.150 124.729 1.421 25289 1720 1 13 . 1 1 12 12 VAL C C 12 175.777 175.777 174.905 0.872 25289 1721 1 13 . 1 1 12 12 VAL CA C 12 60.552 60.552 61.943 -1.391 25289 1722 1 13 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.163 1.703 25289 1723 1 13 . 1 1 13 13 HIS N N 13 125.956 125.956 124.993 0.963 25289 1724 1 13 . 1 1 13 13 HIS C C 13 173.570 173.570 174.096 -0.526 25289 1725 1 13 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.825 -5.381 25289 1726 1 13 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.206 2.184 25289 1727 1 13 . 1 1 14 14 HIS N N 14 118.068 118.068 121.949 -3.881 25289 1728 1 13 . 1 1 14 14 HIS C C 14 173.557 173.557 174.613 -1.056 25289 1729 1 13 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.848 -0.950 25289 1730 1 13 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.446 0.523 25289 1731 1 13 . 1 1 15 15 GLN N N 15 108.832 108.832 122.659 -13.827 25289 1732 1 13 . 1 1 15 15 GLN C C 15 175.161 175.161 175.282 -0.121 25289 1733 1 13 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.340 -0.605 25289 1734 1 13 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.362 2.671 25289 1735 1 13 . 1 1 16 16 LYS N N 16 120.134 120.134 124.463 -4.329 25289 1736 1 13 . 1 1 16 16 LYS C C 16 174.135 174.135 175.275 -1.140 25289 1737 1 13 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.066 -0.906 25289 1738 1 13 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.151 3.526 25289 1739 1 13 . 1 1 17 17 LEU N N 17 128.053 128.053 126.676 1.377 25289 1740 1 13 . 1 1 17 17 LEU C C 17 174.949 174.949 175.514 -0.565 25289 1741 1 13 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.255 0.369 25289 1742 1 13 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.496 2.200 25289 1743 1 13 . 1 1 18 18 VAL N N 18 123.642 123.642 124.023 -0.381 25289 1744 1 13 . 1 1 18 18 VAL C C 18 172.776 172.776 175.624 -2.848 25289 1745 1 13 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.177 0.580 25289 1746 1 13 . 1 1 18 18 VAL CB C 18 33.817 33.817 31.536 2.281 25289 1747 1 13 . 1 1 19 19 PHE N N 19 129.487 129.487 127.330 2.157 25289 1748 1 13 . 1 1 19 19 PHE C C 19 174.192 174.192 175.632 -1.440 25289 1749 1 13 . 1 1 19 19 PHE CA C 19 55.575 55.575 56.059 -0.484 25289 1750 1 13 . 1 1 19 19 PHE CB C 19 42.431 42.431 39.611 2.820 25289 1751 1 13 . 1 1 20 20 PHE N N 20 117.543 117.543 119.069 -1.526 25289 1752 1 13 . 1 1 20 20 PHE C C 20 170.932 170.932 174.679 -3.747 25289 1753 1 13 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.053 0.626 25289 1754 1 13 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.133 -4.210 25289 1755 1 13 . 1 1 21 21 ALA N N 21 115.079 115.079 122.221 -7.142 25289 1756 1 13 . 1 1 21 21 ALA C C 21 177.230 177.230 177.509 -0.279 25289 1757 1 13 . 1 1 21 21 ALA CA C 21 48.992 48.992 52.330 -3.338 25289 1758 1 13 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.583 3.605 25289 1759 1 13 . 1 1 22 22 ASP N N 22 118.083 118.083 122.170 -4.087 25289 1760 1 13 . 1 1 22 22 ASP CA C 22 55.469 55.469 55.110 0.359 25289 1761 1 13 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.471 -1.404 25289 1762 1 13 . 1 1 23 23 VAL N N 23 118.167 118.167 118.650 -0.483 25289 1763 1 13 . 1 1 23 23 VAL C C 23 177.102 177.102 176.303 0.799 25289 1764 1 13 . 1 1 23 23 VAL CA C 23 58.358 58.358 60.937 -2.579 25289 1765 1 13 . 1 1 23 23 VAL CB C 23 36.811 36.811 33.992 2.819 25289 1766 1 13 . 1 1 24 24 GLY N N 24 116.706 116.706 114.732 1.974 25289 1767 1 13 . 1 1 24 24 GLY C C 24 175.652 175.652 174.586 1.066 25289 1768 1 13 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.643 3.219 25289 1769 1 13 . 1 1 25 25 SER N N 25 114.116 114.116 116.565 -2.449 25289 1770 1 13 . 1 1 25 25 SER C C 25 171.430 171.430 173.564 -2.134 25289 1771 1 13 . 1 1 25 25 SER CA C 25 57.801 57.801 58.064 -0.263 25289 1772 1 13 . 1 1 25 25 SER CB C 25 66.227 66.227 65.284 0.943 25289 1773 1 13 . 1 1 26 26 ASN N N 26 124.399 124.399 122.007 2.392 25289 1774 1 13 . 1 1 26 26 ASN C C 26 174.397 174.397 174.191 0.206 25289 1775 1 13 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.186 -0.437 25289 1776 1 13 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.129 1.697 25289 1777 1 13 . 1 1 27 27 LYS N N 27 119.929 119.929 122.204 -2.275 25289 1778 1 13 . 1 1 27 27 LYS C C 27 174.254 174.254 176.830 -2.576 25289 1779 1 13 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.654 -0.864 25289 1780 1 13 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.856 5.515 25289 1781 1 13 . 1 1 28 28 GLY N N 28 110.364 110.364 108.795 1.569 25289 1782 1 13 . 1 1 28 28 GLY C C 28 170.924 170.924 173.257 -2.333 25289 1783 1 13 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.353 -0.367 25289 1784 1 13 . 1 1 29 29 ALA N N 29 131.126 131.126 125.628 5.498 25289 1785 1 13 . 1 1 29 29 ALA C C 29 174.741 174.741 176.364 -1.623 25289 1786 1 13 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.710 -1.553 25289 1787 1 13 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.558 0.624 25289 1788 1 13 . 1 1 30 30 ILE N N 30 124.057 124.057 123.537 0.520 25289 1789 1 13 . 1 1 30 30 ILE C C 30 174.412 174.412 175.180 -0.768 25289 1790 1 13 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.389 -3.637 25289 1791 1 13 . 1 1 30 30 ILE CB C 30 38.797 38.797 39.693 -0.896 25289 1792 1 13 . 1 1 31 31 ILE N N 31 125.346 125.346 126.396 -1.050 25289 1793 1 13 . 1 1 31 31 ILE C C 31 175.726 175.726 176.173 -0.447 25289 1794 1 13 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.727 -2.289 25289 1795 1 13 . 1 1 31 31 ILE CB C 31 41.749 41.749 41.041 0.708 25289 1796 1 13 . 1 1 32 32 GLY N N 32 114.247 114.247 115.258 -1.011 25289 1797 1 13 . 1 1 32 32 GLY C C 32 171.545 171.545 174.270 -2.725 25289 1798 1 13 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.051 2.660 25289 1799 1 13 . 1 1 33 33 LEU N N 33 125.458 125.458 116.466 8.992 25289 1800 1 13 . 1 1 33 33 LEU C C 33 173.806 173.806 175.036 -1.230 25289 1801 1 13 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.873 0.251 25289 1802 1 13 . 1 1 33 33 LEU CB C 33 45.854 45.854 43.029 2.825 25289 1803 1 13 . 1 1 34 34 MET N N 34 126.372 126.372 121.175 5.197 25289 1804 1 13 . 1 1 34 34 MET C C 34 173.609 173.609 175.082 -1.473 25289 1805 1 13 . 1 1 34 34 MET CA C 34 53.644 53.644 55.230 -1.586 25289 1806 1 13 . 1 1 34 34 MET CB C 34 37.230 37.230 34.392 2.838 25289 1807 1 13 . 1 1 35 35 VAL N N 35 125.387 125.387 122.713 2.674 25289 1808 1 13 . 1 1 35 35 VAL C C 35 176.204 176.204 176.540 -0.336 25289 1809 1 13 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.305 -3.588 25289 1810 1 13 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.660 3.407 25289 1811 1 13 . 1 1 36 36 GLY N N 36 117.182 117.182 113.152 4.030 25289 1812 1 13 . 1 1 36 36 GLY C C 36 173.838 173.838 174.261 -0.423 25289 1813 1 13 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.200 3.153 25289 1814 1 13 . 1 1 37 37 GLY N N 37 105.656 105.656 106.749 -1.093 25289 1815 1 13 . 1 1 37 37 GLY C C 37 169.824 169.824 173.187 -3.363 25289 1816 1 13 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.453 0.521 25289 1817 1 13 . 1 1 38 38 VAL N N 38 118.585 118.585 117.528 1.057 25289 1818 1 13 . 1 1 38 38 VAL C C 38 172.917 172.917 174.902 -1.985 25289 1819 1 13 . 1 1 38 38 VAL CA C 38 60.545 60.545 60.208 0.337 25289 1820 1 13 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.196 3.537 25289 1821 1 14 . 1 1 2 2 ALA N N 2 118.014 118.014 125.107 -7.093 25289 1822 1 14 . 1 1 2 2 ALA C C 2 177.737 177.737 177.794 -0.057 25289 1823 1 14 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.820 0.060 25289 1824 1 14 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.632 -3.940 25289 1825 1 14 . 1 1 3 3 GLU N N 3 121.987 121.987 122.596 -0.609 25289 1826 1 14 . 1 1 3 3 GLU C C 3 176.622 176.622 176.366 0.256 25289 1827 1 14 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.239 4.265 25289 1828 1 14 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.174 -0.551 25289 1829 1 14 . 1 1 4 4 PHE N N 4 114.820 114.820 117.512 -2.692 25289 1830 1 14 . 1 1 4 4 PHE C C 4 175.867 175.867 174.985 0.882 25289 1831 1 14 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.020 -0.036 25289 1832 1 14 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.730 0.971 25289 1833 1 14 . 1 1 5 5 ARG N N 5 132.201 132.201 126.373 5.828 25289 1834 1 14 . 1 1 5 5 ARG C C 5 173.318 173.318 175.198 -1.880 25289 1835 1 14 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.787 -1.151 25289 1836 1 14 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.417 2.306 25289 1837 1 14 . 1 1 6 6 HIS N N 6 126.106 126.106 122.778 3.328 25289 1838 1 14 . 1 1 6 6 HIS C C 6 171.847 171.847 174.579 -2.732 25289 1839 1 14 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.173 -5.004 25289 1840 1 14 . 1 1 6 6 HIS CB C 6 32.337 32.337 31.047 1.290 25289 1841 1 14 . 1 1 7 7 ASP N N 7 129.834 129.834 125.083 4.751 25289 1842 1 14 . 1 1 7 7 ASP C C 7 173.950 173.950 174.739 -0.789 25289 1843 1 14 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.169 -1.746 25289 1844 1 14 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.502 0.522 25289 1845 1 14 . 1 1 8 8 SER N N 8 116.727 116.727 116.801 -0.074 25289 1846 1 14 . 1 1 8 8 SER C C 8 175.357 175.357 174.884 0.473 25289 1847 1 14 . 1 1 8 8 SER CA C 8 55.033 55.033 57.447 -2.414 25289 1848 1 14 . 1 1 8 8 SER CB C 8 66.184 66.184 64.957 1.227 25289 1849 1 14 . 1 1 9 9 GLY N N 9 112.188 112.188 108.269 3.919 25289 1850 1 14 . 1 1 9 9 GLY C C 9 173.834 173.834 173.029 0.805 25289 1851 1 14 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.455 1.741 25289 1852 1 14 . 1 1 10 10 TYR N N 10 126.552 126.552 119.401 7.151 25289 1853 1 14 . 1 1 10 10 TYR C C 10 172.647 172.647 173.965 -1.318 25289 1854 1 14 . 1 1 10 10 TYR CA C 10 58.031 58.031 56.975 1.056 25289 1855 1 14 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.550 1.518 25289 1856 1 14 . 1 1 11 11 GLU N N 11 130.897 130.897 127.582 3.315 25289 1857 1 14 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.742 -0.914 25289 1858 1 14 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.645 1.687 25289 1859 1 14 . 1 1 12 12 VAL N N 12 126.150 126.150 125.119 1.031 25289 1860 1 14 . 1 1 12 12 VAL C C 12 175.777 175.777 174.931 0.846 25289 1861 1 14 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.117 -1.565 25289 1862 1 14 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.468 1.398 25289 1863 1 14 . 1 1 13 13 HIS N N 13 125.956 125.956 125.398 0.558 25289 1864 1 14 . 1 1 13 13 HIS C C 13 173.570 173.570 174.603 -1.033 25289 1865 1 14 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.207 -4.763 25289 1866 1 14 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.238 2.152 25289 1867 1 14 . 1 1 14 14 HIS N N 14 118.068 118.068 123.273 -5.205 25289 1868 1 14 . 1 1 14 14 HIS C C 14 173.557 173.557 174.220 -0.663 25289 1869 1 14 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.993 -1.095 25289 1870 1 14 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.455 0.514 25289 1871 1 14 . 1 1 15 15 GLN N N 15 108.832 108.832 123.894 -15.062 25289 1872 1 14 . 1 1 15 15 GLN C C 15 175.161 175.161 175.061 0.100 25289 1873 1 14 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.366 -0.631 25289 1874 1 14 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.145 2.888 25289 1875 1 14 . 1 1 16 16 LYS N N 16 120.134 120.134 124.445 -4.311 25289 1876 1 14 . 1 1 16 16 LYS C C 16 174.135 174.135 175.220 -1.085 25289 1877 1 14 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.171 -1.010 25289 1878 1 14 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.480 3.197 25289 1879 1 14 . 1 1 17 17 LEU N N 17 128.053 128.053 127.146 0.907 25289 1880 1 14 . 1 1 17 17 LEU C C 17 174.949 174.949 175.829 -0.880 25289 1881 1 14 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.158 0.466 25289 1882 1 14 . 1 1 17 17 LEU CB C 17 44.696 44.696 41.960 2.736 25289 1883 1 14 . 1 1 18 18 VAL N N 18 123.642 123.642 121.186 2.456 25289 1884 1 14 . 1 1 18 18 VAL C C 18 172.776 172.776 175.290 -2.514 25289 1885 1 14 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.319 0.438 25289 1886 1 14 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.717 1.100 25289 1887 1 14 . 1 1 19 19 PHE N N 19 129.487 129.487 126.898 2.589 25289 1888 1 14 . 1 1 19 19 PHE C C 19 174.192 174.192 175.185 -0.993 25289 1889 1 14 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.678 -0.103 25289 1890 1 14 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.505 3.926 25289 1891 1 14 . 1 1 20 20 PHE N N 20 117.543 117.543 121.652 -4.109 25289 1892 1 14 . 1 1 20 20 PHE C C 20 170.932 170.932 174.642 -3.710 25289 1893 1 14 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.752 0.927 25289 1894 1 14 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.442 -4.519 25289 1895 1 14 . 1 1 21 21 ALA N N 21 115.079 115.079 124.446 -9.367 25289 1896 1 14 . 1 1 21 21 ALA C C 21 177.230 177.230 177.032 0.198 25289 1897 1 14 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.963 -2.971 25289 1898 1 14 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.079 3.109 25289 1899 1 14 . 1 1 22 22 ASP N N 22 118.083 118.083 121.582 -3.499 25289 1900 1 14 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.754 0.715 25289 1901 1 14 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.261 -1.194 25289 1902 1 14 . 1 1 23 23 VAL N N 23 118.167 118.167 120.572 -2.405 25289 1903 1 14 . 1 1 23 23 VAL C C 23 177.102 177.102 176.633 0.469 25289 1904 1 14 . 1 1 23 23 VAL CA C 23 58.358 58.358 60.859 -2.501 25289 1905 1 14 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.134 2.677 25289 1906 1 14 . 1 1 24 24 GLY N N 24 116.706 116.706 115.165 1.541 25289 1907 1 14 . 1 1 24 24 GLY C C 24 175.652 175.652 174.705 0.947 25289 1908 1 14 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.673 3.189 25289 1909 1 14 . 1 1 25 25 SER N N 25 114.116 114.116 114.748 -0.632 25289 1910 1 14 . 1 1 25 25 SER C C 25 171.430 171.430 173.088 -1.658 25289 1911 1 14 . 1 1 25 25 SER CA C 25 57.801 57.801 58.096 -0.295 25289 1912 1 14 . 1 1 25 25 SER CB C 25 66.227 66.227 64.651 1.576 25289 1913 1 14 . 1 1 26 26 ASN N N 26 124.399 124.399 122.261 2.138 25289 1914 1 14 . 1 1 26 26 ASN C C 26 174.397 174.397 174.342 0.055 25289 1915 1 14 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.183 -0.434 25289 1916 1 14 . 1 1 26 26 ASN CB C 26 40.826 40.826 38.943 1.883 25289 1917 1 14 . 1 1 27 27 LYS N N 27 119.929 119.929 123.462 -3.533 25289 1918 1 14 . 1 1 27 27 LYS C C 27 174.254 174.254 176.893 -2.639 25289 1919 1 14 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.466 -0.676 25289 1920 1 14 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.704 5.667 25289 1921 1 14 . 1 1 28 28 GLY N N 28 110.364 110.364 109.875 0.489 25289 1922 1 14 . 1 1 28 28 GLY C C 28 170.924 170.924 173.532 -2.608 25289 1923 1 14 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.184 -0.198 25289 1924 1 14 . 1 1 29 29 ALA N N 29 131.126 131.126 125.525 5.601 25289 1925 1 14 . 1 1 29 29 ALA C C 29 174.741 174.741 176.589 -1.848 25289 1926 1 14 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.624 -1.467 25289 1927 1 14 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.625 0.557 25289 1928 1 14 . 1 1 30 30 ILE N N 30 124.057 124.057 123.637 0.420 25289 1929 1 14 . 1 1 30 30 ILE C C 30 174.412 174.412 174.886 -0.474 25289 1930 1 14 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.250 -3.498 25289 1931 1 14 . 1 1 30 30 ILE CB C 30 38.797 38.797 38.651 0.146 25289 1932 1 14 . 1 1 31 31 ILE N N 31 125.346 125.346 127.214 -1.868 25289 1933 1 14 . 1 1 31 31 ILE C C 31 175.726 175.726 175.988 -0.262 25289 1934 1 14 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.593 -2.155 25289 1935 1 14 . 1 1 31 31 ILE CB C 31 41.749 41.749 39.951 1.798 25289 1936 1 14 . 1 1 32 32 GLY N N 32 114.247 114.247 115.050 -0.803 25289 1937 1 14 . 1 1 32 32 GLY C C 32 171.545 171.545 173.862 -2.317 25289 1938 1 14 . 1 1 32 32 GLY CA C 32 48.711 48.711 45.844 2.867 25289 1939 1 14 . 1 1 33 33 LEU N N 33 125.458 125.458 115.806 9.652 25289 1940 1 14 . 1 1 33 33 LEU C C 33 173.806 173.806 175.061 -1.255 25289 1941 1 14 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.756 0.368 25289 1942 1 14 . 1 1 33 33 LEU CB C 33 45.854 45.854 43.066 2.788 25289 1943 1 14 . 1 1 34 34 MET N N 34 126.372 126.372 121.098 5.274 25289 1944 1 14 . 1 1 34 34 MET C C 34 173.609 173.609 174.763 -1.154 25289 1945 1 14 . 1 1 34 34 MET CA C 34 53.644 53.644 54.978 -1.334 25289 1946 1 14 . 1 1 34 34 MET CB C 34 37.230 37.230 34.000 3.230 25289 1947 1 14 . 1 1 35 35 VAL N N 35 125.387 125.387 123.639 1.748 25289 1948 1 14 . 1 1 35 35 VAL C C 35 176.204 176.204 176.272 -0.068 25289 1949 1 14 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.896 -4.179 25289 1950 1 14 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.326 3.741 25289 1951 1 14 . 1 1 36 36 GLY N N 36 117.182 117.182 114.911 2.271 25289 1952 1 14 . 1 1 36 36 GLY C C 36 173.838 173.838 174.598 -0.760 25289 1953 1 14 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.942 3.411 25289 1954 1 14 . 1 1 37 37 GLY N N 37 105.656 105.656 107.381 -1.725 25289 1955 1 14 . 1 1 37 37 GLY C C 37 169.824 169.824 173.708 -3.884 25289 1956 1 14 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.422 0.552 25289 1957 1 14 . 1 1 38 38 VAL N N 38 118.585 118.585 118.046 0.539 25289 1958 1 14 . 1 1 38 38 VAL C C 38 172.917 172.917 174.001 -1.084 25289 1959 1 14 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.958 -1.413 25289 1960 1 14 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.258 3.475 25289 1961 1 15 . 1 1 2 2 ALA N N 2 118.014 118.014 126.054 -8.040 25289 1962 1 15 . 1 1 2 2 ALA C C 2 177.737 177.737 177.867 -0.130 25289 1963 1 15 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.458 0.423 25289 1964 1 15 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.985 -3.293 25289 1965 1 15 . 1 1 3 3 GLU N N 3 121.987 121.987 121.796 0.191 25289 1966 1 15 . 1 1 3 3 GLU C C 3 176.622 176.622 176.309 0.313 25289 1967 1 15 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.437 4.067 25289 1968 1 15 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.099 -0.476 25289 1969 1 15 . 1 1 4 4 PHE N N 4 114.820 114.820 117.352 -2.532 25289 1970 1 15 . 1 1 4 4 PHE C C 4 175.867 175.867 174.738 1.129 25289 1971 1 15 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.025 -0.041 25289 1972 1 15 . 1 1 4 4 PHE CB C 4 41.700 41.700 41.029 0.672 25289 1973 1 15 . 1 1 5 5 ARG N N 5 132.201 132.201 125.414 6.787 25289 1974 1 15 . 1 1 5 5 ARG C C 5 173.318 173.318 175.117 -1.799 25289 1975 1 15 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.806 -1.170 25289 1976 1 15 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.738 1.985 25289 1977 1 15 . 1 1 6 6 HIS N N 6 126.106 126.106 121.950 4.156 25289 1978 1 15 . 1 1 6 6 HIS C C 6 171.847 171.847 174.635 -2.788 25289 1979 1 15 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.046 -4.877 25289 1980 1 15 . 1 1 6 6 HIS CB C 6 32.337 32.337 31.025 1.312 25289 1981 1 15 . 1 1 7 7 ASP N N 7 129.834 129.834 124.580 5.254 25289 1982 1 15 . 1 1 7 7 ASP C C 7 173.950 173.950 174.806 -0.856 25289 1983 1 15 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.145 -1.722 25289 1984 1 15 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.020 1.004 25289 1985 1 15 . 1 1 8 8 SER N N 8 116.727 116.727 118.512 -1.785 25289 1986 1 15 . 1 1 8 8 SER C C 8 175.357 175.357 175.391 -0.034 25289 1987 1 15 . 1 1 8 8 SER CA C 8 55.033 55.033 57.672 -2.639 25289 1988 1 15 . 1 1 8 8 SER CB C 8 66.184 66.184 65.258 0.926 25289 1989 1 15 . 1 1 9 9 GLY N N 9 112.188 112.188 109.514 2.674 25289 1990 1 15 . 1 1 9 9 GLY C C 9 173.834 173.834 174.235 -0.401 25289 1991 1 15 . 1 1 9 9 GLY CA C 9 47.196 47.196 46.271 0.925 25289 1992 1 15 . 1 1 10 10 TYR N N 10 126.552 126.552 119.881 6.671 25289 1993 1 15 . 1 1 10 10 TYR C C 10 172.647 172.647 174.034 -1.387 25289 1994 1 15 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.212 0.819 25289 1995 1 15 . 1 1 10 10 TYR CB C 10 42.069 42.069 39.701 2.368 25289 1996 1 15 . 1 1 11 11 GLU N N 11 130.897 130.897 128.123 2.774 25289 1997 1 15 . 1 1 11 11 GLU CA C 11 54.828 54.828 56.314 -1.486 25289 1998 1 15 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.758 1.574 25289 1999 1 15 . 1 1 12 12 VAL N N 12 126.150 126.150 125.332 0.818 25289 2000 1 15 . 1 1 12 12 VAL C C 12 175.777 175.777 174.625 1.152 25289 2001 1 15 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.291 -1.739 25289 2002 1 15 . 1 1 12 12 VAL CB C 12 34.866 34.866 34.175 0.691 25289 2003 1 15 . 1 1 13 13 HIS N N 13 125.956 125.956 126.245 -0.289 25289 2004 1 15 . 1 1 13 13 HIS C C 13 173.570 173.570 174.700 -1.130 25289 2005 1 15 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.539 -5.095 25289 2006 1 15 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.492 2.898 25289 2007 1 15 . 1 1 14 14 HIS N N 14 118.068 118.068 122.897 -4.829 25289 2008 1 15 . 1 1 14 14 HIS C C 14 173.557 173.557 174.718 -1.161 25289 2009 1 15 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.543 -0.645 25289 2010 1 15 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.971 0.998 25289 2011 1 15 . 1 1 15 15 GLN N N 15 108.832 108.832 123.052 -14.220 25289 2012 1 15 . 1 1 15 15 GLN C C 15 175.161 175.161 174.977 0.184 25289 2013 1 15 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.223 -0.488 25289 2014 1 15 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.258 2.775 25289 2015 1 15 . 1 1 16 16 LYS N N 16 120.134 120.134 124.941 -4.807 25289 2016 1 15 . 1 1 16 16 LYS C C 16 174.135 174.135 174.920 -0.785 25289 2017 1 15 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.060 -0.899 25289 2018 1 15 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.373 3.304 25289 2019 1 15 . 1 1 17 17 LEU N N 17 128.053 128.053 125.597 2.456 25289 2020 1 15 . 1 1 17 17 LEU C C 17 174.949 174.949 175.911 -0.962 25289 2021 1 15 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.410 0.214 25289 2022 1 15 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.831 1.865 25289 2023 1 15 . 1 1 18 18 VAL N N 18 123.642 123.642 124.317 -0.675 25289 2024 1 15 . 1 1 18 18 VAL C C 18 172.776 172.776 175.438 -2.662 25289 2025 1 15 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.861 -0.104 25289 2026 1 15 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.407 1.410 25289 2027 1 15 . 1 1 19 19 PHE N N 19 129.487 129.487 128.243 1.244 25289 2028 1 15 . 1 1 19 19 PHE C C 19 174.192 174.192 175.303 -1.111 25289 2029 1 15 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.703 -0.128 25289 2030 1 15 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.040 4.391 25289 2031 1 15 . 1 1 20 20 PHE N N 20 117.543 117.543 122.545 -5.002 25289 2032 1 15 . 1 1 20 20 PHE C C 20 170.932 170.932 174.372 -3.440 25289 2033 1 15 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.014 0.665 25289 2034 1 15 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.278 -5.355 25289 2035 1 15 . 1 1 21 21 ALA N N 21 115.079 115.079 126.322 -11.243 25289 2036 1 15 . 1 1 21 21 ALA C C 21 177.230 177.230 176.706 0.524 25289 2037 1 15 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.611 -2.619 25289 2038 1 15 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.949 2.239 25289 2039 1 15 . 1 1 22 22 ASP N N 22 118.083 118.083 120.897 -2.814 25289 2040 1 15 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.700 0.769 25289 2041 1 15 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.643 -1.576 25289 2042 1 15 . 1 1 23 23 VAL N N 23 118.167 118.167 120.969 -2.802 25289 2043 1 15 . 1 1 23 23 VAL C C 23 177.102 177.102 176.755 0.347 25289 2044 1 15 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.067 -2.709 25289 2045 1 15 . 1 1 23 23 VAL CB C 23 36.811 36.811 33.290 3.521 25289 2046 1 15 . 1 1 24 24 GLY N N 24 116.706 116.706 115.621 1.085 25289 2047 1 15 . 1 1 24 24 GLY C C 24 175.652 175.652 174.703 0.949 25289 2048 1 15 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.956 2.906 25289 2049 1 15 . 1 1 25 25 SER N N 25 114.116 114.116 113.786 0.330 25289 2050 1 15 . 1 1 25 25 SER C C 25 171.430 171.430 173.034 -1.604 25289 2051 1 15 . 1 1 25 25 SER CA C 25 57.801 57.801 58.059 -0.258 25289 2052 1 15 . 1 1 25 25 SER CB C 25 66.227 66.227 64.358 1.869 25289 2053 1 15 . 1 1 26 26 ASN N N 26 124.399 124.399 121.931 2.468 25289 2054 1 15 . 1 1 26 26 ASN C C 26 174.397 174.397 174.441 -0.044 25289 2055 1 15 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.047 -0.298 25289 2056 1 15 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.002 1.824 25289 2057 1 15 . 1 1 27 27 LYS N N 27 119.929 119.929 123.130 -3.201 25289 2058 1 15 . 1 1 27 27 LYS C C 27 174.254 174.254 177.158 -2.904 25289 2059 1 15 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.730 -0.940 25289 2060 1 15 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.586 4.785 25289 2061 1 15 . 1 1 28 28 GLY N N 28 110.364 110.364 110.038 0.326 25289 2062 1 15 . 1 1 28 28 GLY C C 28 170.924 170.924 173.613 -2.689 25289 2063 1 15 . 1 1 28 28 GLY CA C 28 44.986 44.986 44.954 0.032 25289 2064 1 15 . 1 1 29 29 ALA N N 29 131.126 131.126 126.214 4.912 25289 2065 1 15 . 1 1 29 29 ALA C C 29 174.741 174.741 176.728 -1.987 25289 2066 1 15 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.652 -1.495 25289 2067 1 15 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.230 0.952 25289 2068 1 15 . 1 1 30 30 ILE N N 30 124.057 124.057 121.585 2.472 25289 2069 1 15 . 1 1 30 30 ILE C C 30 174.412 174.412 174.545 -0.133 25289 2070 1 15 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.514 -2.762 25289 2071 1 15 . 1 1 30 30 ILE CB C 30 38.797 38.797 38.280 0.517 25289 2072 1 15 . 1 1 31 31 ILE N N 31 125.346 125.346 125.850 -0.504 25289 2073 1 15 . 1 1 31 31 ILE C C 31 175.726 175.726 175.837 -0.111 25289 2074 1 15 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.225 -1.788 25289 2075 1 15 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.274 1.475 25289 2076 1 15 . 1 1 32 32 GLY N N 32 114.247 114.247 114.615 -0.368 25289 2077 1 15 . 1 1 32 32 GLY C C 32 171.545 171.545 174.029 -2.484 25289 2078 1 15 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.169 2.542 25289 2079 1 15 . 1 1 33 33 LEU N N 33 125.458 125.458 115.797 9.661 25289 2080 1 15 . 1 1 33 33 LEU C C 33 173.806 173.806 175.068 -1.262 25289 2081 1 15 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.800 0.324 25289 2082 1 15 . 1 1 33 33 LEU CB C 33 45.854 45.854 43.161 2.693 25289 2083 1 15 . 1 1 34 34 MET N N 34 126.372 126.372 121.031 5.341 25289 2084 1 15 . 1 1 34 34 MET C C 34 173.609 173.609 175.021 -1.412 25289 2085 1 15 . 1 1 34 34 MET CA C 34 53.644 53.644 55.201 -1.557 25289 2086 1 15 . 1 1 34 34 MET CB C 34 37.230 37.230 34.071 3.159 25289 2087 1 15 . 1 1 35 35 VAL N N 35 125.387 125.387 123.444 1.943 25289 2088 1 15 . 1 1 35 35 VAL C C 35 176.204 176.204 176.338 -0.134 25289 2089 1 15 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.284 -3.567 25289 2090 1 15 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.630 3.437 25289 2091 1 15 . 1 1 36 36 GLY N N 36 117.182 117.182 113.436 3.746 25289 2092 1 15 . 1 1 36 36 GLY C C 36 173.838 173.838 174.812 -0.974 25289 2093 1 15 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.986 3.367 25289 2094 1 15 . 1 1 37 37 GLY N N 37 105.656 105.656 106.285 -0.629 25289 2095 1 15 . 1 1 37 37 GLY C C 37 169.824 169.824 173.105 -3.281 25289 2096 1 15 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.444 0.529 25289 2097 1 15 . 1 1 38 38 VAL N N 38 118.585 118.585 118.412 0.173 25289 2098 1 15 . 1 1 38 38 VAL C C 38 172.917 172.917 174.800 -1.883 25289 2099 1 15 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.542 -0.997 25289 2100 1 15 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.923 2.810 25289 2101 1 16 . 1 1 2 2 ALA N N 2 118.014 118.014 124.207 -6.193 25289 2102 1 16 . 1 1 2 2 ALA C C 2 177.737 177.737 178.283 -0.546 25289 2103 1 16 . 1 1 2 2 ALA CA C 2 51.880 51.880 52.460 -0.580 25289 2104 1 16 . 1 1 2 2 ALA CB C 2 15.692 15.692 18.587 -2.895 25289 2105 1 16 . 1 1 3 3 GLU N N 3 121.987 121.987 121.717 0.270 25289 2106 1 16 . 1 1 3 3 GLU C C 3 176.622 176.622 176.364 0.258 25289 2107 1 16 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.680 3.824 25289 2108 1 16 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.187 -0.564 25289 2109 1 16 . 1 1 4 4 PHE N N 4 114.820 114.820 117.196 -2.376 25289 2110 1 16 . 1 1 4 4 PHE C C 4 175.867 175.867 175.204 0.663 25289 2111 1 16 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.029 -0.045 25289 2112 1 16 . 1 1 4 4 PHE CB C 4 41.700 41.700 41.036 0.664 25289 2113 1 16 . 1 1 5 5 ARG N N 5 132.201 132.201 126.745 5.456 25289 2114 1 16 . 1 1 5 5 ARG C C 5 173.318 173.318 175.026 -1.708 25289 2115 1 16 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.747 -1.111 25289 2116 1 16 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.261 2.462 25289 2117 1 16 . 1 1 6 6 HIS N N 6 126.106 126.106 123.680 2.426 25289 2118 1 16 . 1 1 6 6 HIS C C 6 171.847 171.847 174.269 -2.422 25289 2119 1 16 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.339 -5.170 25289 2120 1 16 . 1 1 6 6 HIS CB C 6 32.337 32.337 31.141 1.196 25289 2121 1 16 . 1 1 7 7 ASP N N 7 129.834 129.834 125.567 4.267 25289 2122 1 16 . 1 1 7 7 ASP C C 7 173.950 173.950 174.933 -0.983 25289 2123 1 16 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.128 -1.705 25289 2124 1 16 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.091 0.933 25289 2125 1 16 . 1 1 8 8 SER N N 8 116.727 116.727 116.662 0.065 25289 2126 1 16 . 1 1 8 8 SER C C 8 175.357 175.357 175.135 0.222 25289 2127 1 16 . 1 1 8 8 SER CA C 8 55.033 55.033 57.949 -2.916 25289 2128 1 16 . 1 1 8 8 SER CB C 8 66.184 66.184 65.008 1.176 25289 2129 1 16 . 1 1 9 9 GLY N N 9 112.188 112.188 108.507 3.681 25289 2130 1 16 . 1 1 9 9 GLY C C 9 173.834 173.834 173.081 0.753 25289 2131 1 16 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.773 1.423 25289 2132 1 16 . 1 1 10 10 TYR N N 10 126.552 126.552 119.393 7.159 25289 2133 1 16 . 1 1 10 10 TYR C C 10 172.647 172.647 174.120 -1.473 25289 2134 1 16 . 1 1 10 10 TYR CA C 10 58.031 58.031 56.330 1.701 25289 2135 1 16 . 1 1 10 10 TYR CB C 10 42.069 42.069 39.977 2.092 25289 2136 1 16 . 1 1 11 11 GLU N N 11 130.897 130.897 127.458 3.439 25289 2137 1 16 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.761 -0.933 25289 2138 1 16 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.502 1.830 25289 2139 1 16 . 1 1 12 12 VAL N N 12 126.150 126.150 124.747 1.403 25289 2140 1 16 . 1 1 12 12 VAL C C 12 175.777 175.777 175.022 0.755 25289 2141 1 16 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.103 -1.551 25289 2142 1 16 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.224 1.642 25289 2143 1 16 . 1 1 13 13 HIS N N 13 125.956 125.956 124.713 1.243 25289 2144 1 16 . 1 1 13 13 HIS C C 13 173.570 173.570 174.626 -1.056 25289 2145 1 16 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.270 -4.826 25289 2146 1 16 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.513 1.877 25289 2147 1 16 . 1 1 14 14 HIS N N 14 118.068 118.068 122.338 -4.270 25289 2148 1 16 . 1 1 14 14 HIS C C 14 173.557 173.557 174.336 -0.779 25289 2149 1 16 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.931 -1.033 25289 2150 1 16 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.731 1.238 25289 2151 1 16 . 1 1 15 15 GLN N N 15 108.832 108.832 123.419 -14.587 25289 2152 1 16 . 1 1 15 15 GLN C C 15 175.161 175.161 175.225 -0.064 25289 2153 1 16 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.367 -0.632 25289 2154 1 16 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.500 2.533 25289 2155 1 16 . 1 1 16 16 LYS N N 16 120.134 120.134 124.481 -4.347 25289 2156 1 16 . 1 1 16 16 LYS C C 16 174.135 174.135 175.265 -1.130 25289 2157 1 16 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.009 -0.848 25289 2158 1 16 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.095 3.582 25289 2159 1 16 . 1 1 17 17 LEU N N 17 128.053 128.053 126.667 1.386 25289 2160 1 16 . 1 1 17 17 LEU C C 17 174.949 174.949 175.511 -0.562 25289 2161 1 16 . 1 1 17 17 LEU CA C 17 54.624 54.624 53.764 0.860 25289 2162 1 16 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.087 2.609 25289 2163 1 16 . 1 1 18 18 VAL N N 18 123.642 123.642 121.315 2.327 25289 2164 1 16 . 1 1 18 18 VAL C C 18 172.776 172.776 175.241 -2.465 25289 2165 1 16 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.017 0.740 25289 2166 1 16 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.479 1.338 25289 2167 1 16 . 1 1 19 19 PHE N N 19 129.487 129.487 127.584 1.903 25289 2168 1 16 . 1 1 19 19 PHE C C 19 174.192 174.192 175.112 -0.920 25289 2169 1 16 . 1 1 19 19 PHE CA C 19 55.575 55.575 56.030 -0.455 25289 2170 1 16 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.514 3.917 25289 2171 1 16 . 1 1 20 20 PHE N N 20 117.543 117.543 121.720 -4.177 25289 2172 1 16 . 1 1 20 20 PHE C C 20 170.932 170.932 174.401 -3.469 25289 2173 1 16 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.179 0.500 25289 2174 1 16 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.464 -5.541 25289 2175 1 16 . 1 1 21 21 ALA N N 21 115.079 115.079 124.141 -9.062 25289 2176 1 16 . 1 1 21 21 ALA C C 21 177.230 177.230 176.955 0.275 25289 2177 1 16 . 1 1 21 21 ALA CA C 21 48.992 48.992 52.004 -3.012 25289 2178 1 16 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.941 3.247 25289 2179 1 16 . 1 1 22 22 ASP N N 22 118.083 118.083 121.998 -3.915 25289 2180 1 16 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.841 0.628 25289 2181 1 16 . 1 1 22 22 ASP CB C 22 39.067 39.067 39.877 -0.810 25289 2182 1 16 . 1 1 23 23 VAL N N 23 118.167 118.167 119.547 -1.380 25289 2183 1 16 . 1 1 23 23 VAL C C 23 177.102 177.102 176.888 0.214 25289 2184 1 16 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.558 -3.200 25289 2185 1 16 . 1 1 23 23 VAL CB C 23 36.811 36.811 33.096 3.716 25289 2186 1 16 . 1 1 24 24 GLY N N 24 116.706 116.706 113.889 2.817 25289 2187 1 16 . 1 1 24 24 GLY C C 24 175.652 175.652 174.848 0.804 25289 2188 1 16 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.711 3.151 25289 2189 1 16 . 1 1 25 25 SER N N 25 114.116 114.116 114.737 -0.621 25289 2190 1 16 . 1 1 25 25 SER C C 25 171.430 171.430 173.204 -1.774 25289 2191 1 16 . 1 1 25 25 SER CA C 25 57.801 57.801 58.416 -0.615 25289 2192 1 16 . 1 1 25 25 SER CB C 25 66.227 66.227 65.105 1.122 25289 2193 1 16 . 1 1 26 26 ASN N N 26 124.399 124.399 123.694 0.705 25289 2194 1 16 . 1 1 26 26 ASN C C 26 174.397 174.397 174.504 -0.107 25289 2195 1 16 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.178 -0.429 25289 2196 1 16 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.197 1.629 25289 2197 1 16 . 1 1 27 27 LYS N N 27 119.929 119.929 124.851 -4.922 25289 2198 1 16 . 1 1 27 27 LYS C C 27 174.254 174.254 176.848 -2.594 25289 2199 1 16 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.735 -0.945 25289 2200 1 16 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.921 5.450 25289 2201 1 16 . 1 1 28 28 GLY N N 28 110.364 110.364 111.298 -0.934 25289 2202 1 16 . 1 1 28 28 GLY C C 28 170.924 170.924 173.504 -2.580 25289 2203 1 16 . 1 1 28 28 GLY CA C 28 44.986 44.986 44.739 0.247 25289 2204 1 16 . 1 1 29 29 ALA N N 29 131.126 131.126 125.706 5.420 25289 2205 1 16 . 1 1 29 29 ALA C C 29 174.741 174.741 176.833 -2.092 25289 2206 1 16 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.427 -1.270 25289 2207 1 16 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.344 0.838 25289 2208 1 16 . 1 1 30 30 ILE N N 30 124.057 124.057 121.425 2.632 25289 2209 1 16 . 1 1 30 30 ILE C C 30 174.412 174.412 174.654 -0.242 25289 2210 1 16 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.343 -2.591 25289 2211 1 16 . 1 1 30 30 ILE CB C 30 38.797 38.797 38.229 0.568 25289 2212 1 16 . 1 1 31 31 ILE N N 31 125.346 125.346 126.197 -0.851 25289 2213 1 16 . 1 1 31 31 ILE C C 31 175.726 175.726 177.245 -1.519 25289 2214 1 16 . 1 1 31 31 ILE CA C 31 58.438 58.438 61.227 -2.789 25289 2215 1 16 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.831 0.918 25289 2216 1 16 . 1 1 32 32 GLY N N 32 114.247 114.247 116.135 -1.888 25289 2217 1 16 . 1 1 32 32 GLY C C 32 171.545 171.545 174.364 -2.819 25289 2218 1 16 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.775 1.936 25289 2219 1 16 . 1 1 33 33 LEU N N 33 125.458 125.458 116.344 9.114 25289 2220 1 16 . 1 1 33 33 LEU C C 33 173.806 173.806 174.905 -1.099 25289 2221 1 16 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.830 0.294 25289 2222 1 16 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.776 3.078 25289 2223 1 16 . 1 1 34 34 MET N N 34 126.372 126.372 121.733 4.639 25289 2224 1 16 . 1 1 34 34 MET C C 34 173.609 173.609 174.848 -1.239 25289 2225 1 16 . 1 1 34 34 MET CA C 34 53.644 53.644 55.066 -1.422 25289 2226 1 16 . 1 1 34 34 MET CB C 34 37.230 37.230 33.986 3.244 25289 2227 1 16 . 1 1 35 35 VAL N N 35 125.387 125.387 124.110 1.277 25289 2228 1 16 . 1 1 35 35 VAL C C 35 176.204 176.204 176.536 -0.332 25289 2229 1 16 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.534 -3.817 25289 2230 1 16 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.513 3.554 25289 2231 1 16 . 1 1 36 36 GLY N N 36 117.182 117.182 114.871 2.311 25289 2232 1 16 . 1 1 36 36 GLY C C 36 173.838 173.838 175.054 -1.216 25289 2233 1 16 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.845 3.508 25289 2234 1 16 . 1 1 37 37 GLY N N 37 105.656 105.656 107.621 -1.965 25289 2235 1 16 . 1 1 37 37 GLY C C 37 169.824 169.824 173.768 -3.944 25289 2236 1 16 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.461 0.513 25289 2237 1 16 . 1 1 38 38 VAL N N 38 118.585 118.585 117.819 0.766 25289 2238 1 16 . 1 1 38 38 VAL C C 38 172.917 172.917 174.211 -1.294 25289 2239 1 16 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.857 -1.312 25289 2240 1 16 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.712 3.021 25289 2241 1 17 . 1 1 2 2 ALA N N 2 118.014 118.014 126.996 -8.982 25289 2242 1 17 . 1 1 2 2 ALA C C 2 177.737 177.737 178.757 -1.020 25289 2243 1 17 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.790 0.090 25289 2244 1 17 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.309 -3.617 25289 2245 1 17 . 1 1 3 3 GLU N N 3 121.987 121.987 121.956 0.031 25289 2246 1 17 . 1 1 3 3 GLU C C 3 176.622 176.622 176.460 0.162 25289 2247 1 17 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.059 4.445 25289 2248 1 17 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.236 -0.613 25289 2249 1 17 . 1 1 4 4 PHE N N 4 114.820 114.820 117.945 -3.125 25289 2250 1 17 . 1 1 4 4 PHE C C 4 175.867 175.867 174.677 1.190 25289 2251 1 17 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.900 0.084 25289 2252 1 17 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.403 1.297 25289 2253 1 17 . 1 1 5 5 ARG N N 5 132.201 132.201 127.005 5.196 25289 2254 1 17 . 1 1 5 5 ARG C C 5 173.318 173.318 175.559 -2.241 25289 2255 1 17 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.416 -0.780 25289 2256 1 17 . 1 1 5 5 ARG CB C 5 33.723 33.723 30.565 3.158 25289 2257 1 17 . 1 1 6 6 HIS N N 6 126.106 126.106 123.509 2.597 25289 2258 1 17 . 1 1 6 6 HIS C C 6 171.847 171.847 174.275 -2.428 25289 2259 1 17 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.261 -5.092 25289 2260 1 17 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.937 1.400 25289 2261 1 17 . 1 1 7 7 ASP N N 7 129.834 129.834 127.487 2.347 25289 2262 1 17 . 1 1 7 7 ASP C C 7 173.950 173.950 174.934 -0.984 25289 2263 1 17 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.967 -1.544 25289 2264 1 17 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.834 0.190 25289 2265 1 17 . 1 1 8 8 SER N N 8 116.727 116.727 119.056 -2.329 25289 2266 1 17 . 1 1 8 8 SER C C 8 175.357 175.357 175.404 -0.047 25289 2267 1 17 . 1 1 8 8 SER CA C 8 55.033 55.033 57.724 -2.691 25289 2268 1 17 . 1 1 8 8 SER CB C 8 66.184 66.184 65.480 0.704 25289 2269 1 17 . 1 1 9 9 GLY N N 9 112.188 112.188 111.253 0.935 25289 2270 1 17 . 1 1 9 9 GLY C C 9 173.834 173.834 174.381 -0.547 25289 2271 1 17 . 1 1 9 9 GLY CA C 9 47.196 47.196 46.529 0.667 25289 2272 1 17 . 1 1 10 10 TYR N N 10 126.552 126.552 119.623 6.929 25289 2273 1 17 . 1 1 10 10 TYR C C 10 172.647 172.647 174.113 -1.466 25289 2274 1 17 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.868 0.163 25289 2275 1 17 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.433 1.636 25289 2276 1 17 . 1 1 11 11 GLU N N 11 130.897 130.897 127.040 3.857 25289 2277 1 17 . 1 1 11 11 GLU CA C 11 54.828 54.828 56.120 -1.292 25289 2278 1 17 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.229 2.103 25289 2279 1 17 . 1 1 12 12 VAL N N 12 126.150 126.150 124.054 2.096 25289 2280 1 17 . 1 1 12 12 VAL C C 12 175.777 175.777 175.050 0.727 25289 2281 1 17 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.189 -1.637 25289 2282 1 17 . 1 1 12 12 VAL CB C 12 34.866 34.866 34.537 0.329 25289 2283 1 17 . 1 1 13 13 HIS N N 13 125.956 125.956 124.594 1.362 25289 2284 1 17 . 1 1 13 13 HIS C C 13 173.570 173.570 174.512 -0.942 25289 2285 1 17 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.594 -5.150 25289 2286 1 17 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.041 2.349 25289 2287 1 17 . 1 1 14 14 HIS N N 14 118.068 118.068 123.126 -5.058 25289 2288 1 17 . 1 1 14 14 HIS C C 14 173.557 173.557 174.625 -1.068 25289 2289 1 17 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.618 -0.720 25289 2290 1 17 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.841 1.128 25289 2291 1 17 . 1 1 15 15 GLN N N 15 108.832 108.832 122.612 -13.780 25289 2292 1 17 . 1 1 15 15 GLN C C 15 175.161 175.161 174.879 0.282 25289 2293 1 17 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.424 -0.689 25289 2294 1 17 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.509 2.524 25289 2295 1 17 . 1 1 16 16 LYS N N 16 120.134 120.134 124.345 -4.211 25289 2296 1 17 . 1 1 16 16 LYS C C 16 174.135 174.135 175.197 -1.062 25289 2297 1 17 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.016 -0.855 25289 2298 1 17 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.389 3.288 25289 2299 1 17 . 1 1 17 17 LEU N N 17 128.053 128.053 126.015 2.038 25289 2300 1 17 . 1 1 17 17 LEU C C 17 174.949 174.949 175.441 -0.492 25289 2301 1 17 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.024 0.600 25289 2302 1 17 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.118 2.578 25289 2303 1 17 . 1 1 18 18 VAL N N 18 123.642 123.642 124.083 -0.441 25289 2304 1 17 . 1 1 18 18 VAL C C 18 172.776 172.776 175.589 -2.813 25289 2305 1 17 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.185 0.572 25289 2306 1 17 . 1 1 18 18 VAL CB C 18 33.817 33.817 31.532 2.284 25289 2307 1 17 . 1 1 19 19 PHE N N 19 129.487 129.487 127.313 2.174 25289 2308 1 17 . 1 1 19 19 PHE C C 19 174.192 174.192 175.591 -1.399 25289 2309 1 17 . 1 1 19 19 PHE CA C 19 55.575 55.575 56.058 -0.483 25289 2310 1 17 . 1 1 19 19 PHE CB C 19 42.431 42.431 39.529 2.902 25289 2311 1 17 . 1 1 20 20 PHE N N 20 117.543 117.543 118.476 -0.933 25289 2312 1 17 . 1 1 20 20 PHE C C 20 170.932 170.932 174.694 -3.762 25289 2313 1 17 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.168 0.511 25289 2314 1 17 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.334 -4.411 25289 2315 1 17 . 1 1 21 21 ALA N N 21 115.079 115.079 122.861 -7.782 25289 2316 1 17 . 1 1 21 21 ALA C C 21 177.230 177.230 177.217 0.013 25289 2317 1 17 . 1 1 21 21 ALA CA C 21 48.992 48.992 52.203 -3.211 25289 2318 1 17 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.625 3.563 25289 2319 1 17 . 1 1 22 22 ASP N N 22 118.083 118.083 121.646 -3.563 25289 2320 1 17 . 1 1 22 22 ASP CA C 22 55.469 55.469 55.071 0.398 25289 2321 1 17 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.101 -1.034 25289 2322 1 17 . 1 1 23 23 VAL N N 23 118.167 118.167 119.723 -1.556 25289 2323 1 17 . 1 1 23 23 VAL C C 23 177.102 177.102 177.014 0.088 25289 2324 1 17 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.342 -2.984 25289 2325 1 17 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.687 2.124 25289 2326 1 17 . 1 1 24 24 GLY N N 24 116.706 116.706 114.368 2.338 25289 2327 1 17 . 1 1 24 24 GLY C C 24 175.652 175.652 174.617 1.035 25289 2328 1 17 . 1 1 24 24 GLY CA C 24 48.862 48.862 46.251 2.611 25289 2329 1 17 . 1 1 25 25 SER N N 25 114.116 114.116 113.582 0.534 25289 2330 1 17 . 1 1 25 25 SER C C 25 171.430 171.430 172.950 -1.520 25289 2331 1 17 . 1 1 25 25 SER CA C 25 57.801 57.801 58.660 -0.859 25289 2332 1 17 . 1 1 25 25 SER CB C 25 66.227 66.227 64.419 1.808 25289 2333 1 17 . 1 1 26 26 ASN N N 26 124.399 124.399 122.079 2.320 25289 2334 1 17 . 1 1 26 26 ASN C C 26 174.397 174.397 174.645 -0.248 25289 2335 1 17 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.056 -0.307 25289 2336 1 17 . 1 1 26 26 ASN CB C 26 40.826 40.826 38.604 2.222 25289 2337 1 17 . 1 1 27 27 LYS N N 27 119.929 119.929 122.344 -2.415 25289 2338 1 17 . 1 1 27 27 LYS C C 27 174.254 174.254 177.020 -2.766 25289 2339 1 17 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.413 -0.622 25289 2340 1 17 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.778 5.593 25289 2341 1 17 . 1 1 28 28 GLY N N 28 110.364 110.364 109.690 0.674 25289 2342 1 17 . 1 1 28 28 GLY C C 28 170.924 170.924 173.289 -2.365 25289 2343 1 17 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.328 -0.342 25289 2344 1 17 . 1 1 29 29 ALA N N 29 131.126 131.126 125.642 5.484 25289 2345 1 17 . 1 1 29 29 ALA C C 29 174.741 174.741 176.488 -1.747 25289 2346 1 17 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.904 -1.747 25289 2347 1 17 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.316 0.866 25289 2348 1 17 . 1 1 30 30 ILE N N 30 124.057 124.057 123.531 0.526 25289 2349 1 17 . 1 1 30 30 ILE C C 30 174.412 174.412 175.237 -0.825 25289 2350 1 17 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.309 -3.557 25289 2351 1 17 . 1 1 30 30 ILE CB C 30 38.797 38.797 40.075 -1.278 25289 2352 1 17 . 1 1 31 31 ILE N N 31 125.346 125.346 126.326 -0.980 25289 2353 1 17 . 1 1 31 31 ILE C C 31 175.726 175.726 176.200 -0.474 25289 2354 1 17 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.730 -2.292 25289 2355 1 17 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.886 0.863 25289 2356 1 17 . 1 1 32 32 GLY N N 32 114.247 114.247 115.385 -1.138 25289 2357 1 17 . 1 1 32 32 GLY C C 32 171.545 171.545 174.286 -2.741 25289 2358 1 17 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.079 2.632 25289 2359 1 17 . 1 1 33 33 LEU N N 33 125.458 125.458 116.425 9.033 25289 2360 1 17 . 1 1 33 33 LEU C C 33 173.806 173.806 175.011 -1.205 25289 2361 1 17 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.766 0.358 25289 2362 1 17 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.914 2.940 25289 2363 1 17 . 1 1 34 34 MET N N 34 126.372 126.372 121.026 5.346 25289 2364 1 17 . 1 1 34 34 MET C C 34 173.609 173.609 175.093 -1.484 25289 2365 1 17 . 1 1 34 34 MET CA C 34 53.644 53.644 55.032 -1.387 25289 2366 1 17 . 1 1 34 34 MET CB C 34 37.230 37.230 34.459 2.771 25289 2367 1 17 . 1 1 35 35 VAL N N 35 125.387 125.387 123.462 1.925 25289 2368 1 17 . 1 1 35 35 VAL C C 35 176.204 176.204 176.769 -0.565 25289 2369 1 17 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.189 -3.472 25289 2370 1 17 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.448 3.619 25289 2371 1 17 . 1 1 36 36 GLY N N 36 117.182 117.182 114.130 3.052 25289 2372 1 17 . 1 1 36 36 GLY C C 36 173.838 173.838 174.604 -0.766 25289 2373 1 17 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.244 3.109 25289 2374 1 17 . 1 1 37 37 GLY N N 37 105.656 105.656 106.334 -0.678 25289 2375 1 17 . 1 1 37 37 GLY C C 37 169.824 169.824 172.906 -3.082 25289 2376 1 17 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.349 0.625 25289 2377 1 17 . 1 1 38 38 VAL N N 38 118.585 118.585 119.392 -0.807 25289 2378 1 17 . 1 1 38 38 VAL C C 38 172.917 172.917 175.154 -2.237 25289 2379 1 17 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.123 -0.578 25289 2380 1 17 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.634 3.099 25289 2381 1 18 . 1 1 2 2 ALA N N 2 118.014 118.014 126.264 -8.250 25289 2382 1 18 . 1 1 2 2 ALA C C 2 177.737 177.737 177.825 -0.088 25289 2383 1 18 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.731 0.149 25289 2384 1 18 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.274 -3.582 25289 2385 1 18 . 1 1 3 3 GLU N N 3 121.987 121.987 120.649 1.338 25289 2386 1 18 . 1 1 3 3 GLU C C 3 176.622 176.622 176.323 0.299 25289 2387 1 18 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.594 3.910 25289 2388 1 18 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.101 -0.478 25289 2389 1 18 . 1 1 4 4 PHE N N 4 114.820 114.820 117.480 -2.660 25289 2390 1 18 . 1 1 4 4 PHE C C 4 175.867 175.867 174.934 0.933 25289 2391 1 18 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.081 -0.097 25289 2392 1 18 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.737 0.963 25289 2393 1 18 . 1 1 5 5 ARG N N 5 132.201 132.201 126.773 5.428 25289 2394 1 18 . 1 1 5 5 ARG C C 5 173.318 173.318 175.114 -1.796 25289 2395 1 18 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.735 -1.099 25289 2396 1 18 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.470 2.253 25289 2397 1 18 . 1 1 6 6 HIS N N 6 126.106 126.106 123.121 2.985 25289 2398 1 18 . 1 1 6 6 HIS C C 6 171.847 171.847 174.674 -2.827 25289 2399 1 18 . 1 1 6 6 HIS CA C 6 51.169 51.169 55.998 -4.829 25289 2400 1 18 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.896 1.441 25289 2401 1 18 . 1 1 7 7 ASP N N 7 129.834 129.834 125.700 4.134 25289 2402 1 18 . 1 1 7 7 ASP C C 7 173.950 173.950 174.852 -0.902 25289 2403 1 18 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.048 -1.625 25289 2404 1 18 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.103 0.921 25289 2405 1 18 . 1 1 8 8 SER N N 8 116.727 116.727 117.369 -0.642 25289 2406 1 18 . 1 1 8 8 SER C C 8 175.357 175.357 174.731 0.626 25289 2407 1 18 . 1 1 8 8 SER CA C 8 55.033 55.033 57.777 -2.744 25289 2408 1 18 . 1 1 8 8 SER CB C 8 66.184 66.184 64.247 1.937 25289 2409 1 18 . 1 1 9 9 GLY N N 9 112.188 112.188 109.801 2.387 25289 2410 1 18 . 1 1 9 9 GLY C C 9 173.834 173.834 172.880 0.954 25289 2411 1 18 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.504 1.692 25289 2412 1 18 . 1 1 10 10 TYR N N 10 126.552 126.552 119.947 6.605 25289 2413 1 18 . 1 1 10 10 TYR C C 10 172.647 172.647 174.041 -1.394 25289 2414 1 18 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.159 0.872 25289 2415 1 18 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.608 1.460 25289 2416 1 18 . 1 1 11 11 GLU N N 11 130.897 130.897 127.621 3.276 25289 2417 1 18 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.739 -0.911 25289 2418 1 18 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.910 1.423 25289 2419 1 18 . 1 1 12 12 VAL N N 12 126.150 126.150 124.449 1.701 25289 2420 1 18 . 1 1 12 12 VAL C C 12 175.777 175.777 174.886 0.891 25289 2421 1 18 . 1 1 12 12 VAL CA C 12 60.552 60.552 61.931 -1.379 25289 2422 1 18 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.223 1.643 25289 2423 1 18 . 1 1 13 13 HIS N N 13 125.956 125.956 126.162 -0.206 25289 2424 1 18 . 1 1 13 13 HIS C C 13 173.570 173.570 174.576 -1.006 25289 2425 1 18 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.570 -5.126 25289 2426 1 18 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.250 2.140 25289 2427 1 18 . 1 1 14 14 HIS N N 14 118.068 118.068 122.942 -4.874 25289 2428 1 18 . 1 1 14 14 HIS C C 14 173.557 173.557 174.582 -1.025 25289 2429 1 18 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.651 -0.753 25289 2430 1 18 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.010 0.959 25289 2431 1 18 . 1 1 15 15 GLN N N 15 108.832 108.832 122.325 -13.493 25289 2432 1 18 . 1 1 15 15 GLN C C 15 175.161 175.161 175.005 0.156 25289 2433 1 18 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.310 -0.575 25289 2434 1 18 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.392 2.641 25289 2435 1 18 . 1 1 16 16 LYS N N 16 120.134 120.134 123.962 -3.828 25289 2436 1 18 . 1 1 16 16 LYS C C 16 174.135 174.135 175.295 -1.160 25289 2437 1 18 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.073 -0.912 25289 2438 1 18 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.405 3.272 25289 2439 1 18 . 1 1 17 17 LEU N N 17 128.053 128.053 125.797 2.256 25289 2440 1 18 . 1 1 17 17 LEU C C 17 174.949 174.949 175.603 -0.654 25289 2441 1 18 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.148 0.476 25289 2442 1 18 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.061 2.635 25289 2443 1 18 . 1 1 18 18 VAL N N 18 123.642 123.642 123.587 0.055 25289 2444 1 18 . 1 1 18 18 VAL C C 18 172.776 172.776 175.497 -2.721 25289 2445 1 18 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.543 0.214 25289 2446 1 18 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.272 1.545 25289 2447 1 18 . 1 1 19 19 PHE N N 19 129.487 129.487 126.730 2.757 25289 2448 1 18 . 1 1 19 19 PHE C C 19 174.192 174.192 175.670 -1.478 25289 2449 1 18 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.960 -0.385 25289 2450 1 18 . 1 1 19 19 PHE CB C 19 42.431 42.431 39.708 2.724 25289 2451 1 18 . 1 1 20 20 PHE N N 20 117.543 117.543 117.967 -0.424 25289 2452 1 18 . 1 1 20 20 PHE C C 20 170.932 170.932 174.697 -3.765 25289 2453 1 18 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.213 0.466 25289 2454 1 18 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.363 -4.440 25289 2455 1 18 . 1 1 21 21 ALA N N 21 115.079 115.079 122.203 -7.124 25289 2456 1 18 . 1 1 21 21 ALA C C 21 177.230 177.230 177.238 -0.008 25289 2457 1 18 . 1 1 21 21 ALA CA C 21 48.992 48.992 52.313 -3.321 25289 2458 1 18 . 1 1 21 21 ALA CB C 21 23.188 23.188 19.855 3.333 25289 2459 1 18 . 1 1 22 22 ASP N N 22 118.083 118.083 121.324 -3.241 25289 2460 1 18 . 1 1 22 22 ASP CA C 22 55.469 55.469 55.130 0.339 25289 2461 1 18 . 1 1 22 22 ASP CB C 22 39.067 39.067 39.886 -0.819 25289 2462 1 18 . 1 1 23 23 VAL N N 23 118.167 118.167 118.917 -0.750 25289 2463 1 18 . 1 1 23 23 VAL C C 23 177.102 177.102 176.995 0.107 25289 2464 1 18 . 1 1 23 23 VAL CA C 23 58.358 58.358 60.751 -2.393 25289 2465 1 18 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.652 2.159 25289 2466 1 18 . 1 1 24 24 GLY N N 24 116.706 116.706 114.047 2.659 25289 2467 1 18 . 1 1 24 24 GLY C C 24 175.652 175.652 174.767 0.885 25289 2468 1 18 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.762 3.100 25289 2469 1 18 . 1 1 25 25 SER N N 25 114.116 114.116 113.570 0.546 25289 2470 1 18 . 1 1 25 25 SER C C 25 171.430 171.430 173.138 -1.708 25289 2471 1 18 . 1 1 25 25 SER CA C 25 57.801 57.801 58.232 -0.431 25289 2472 1 18 . 1 1 25 25 SER CB C 25 66.227 66.227 64.639 1.588 25289 2473 1 18 . 1 1 26 26 ASN N N 26 124.399 124.399 120.917 3.482 25289 2474 1 18 . 1 1 26 26 ASN C C 26 174.397 174.397 174.215 0.182 25289 2475 1 18 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.065 -0.316 25289 2476 1 18 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.038 1.788 25289 2477 1 18 . 1 1 27 27 LYS N N 27 119.929 119.929 124.036 -4.107 25289 2478 1 18 . 1 1 27 27 LYS C C 27 174.254 174.254 176.766 -2.512 25289 2479 1 18 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.685 -0.895 25289 2480 1 18 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.380 4.990 25289 2481 1 18 . 1 1 28 28 GLY N N 28 110.364 110.364 110.477 -0.113 25289 2482 1 18 . 1 1 28 28 GLY C C 28 170.924 170.924 173.767 -2.843 25289 2483 1 18 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.360 -0.374 25289 2484 1 18 . 1 1 29 29 ALA N N 29 131.126 131.126 126.044 5.082 25289 2485 1 18 . 1 1 29 29 ALA C C 29 174.741 174.741 176.460 -1.719 25289 2486 1 18 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.690 -1.532 25289 2487 1 18 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.576 0.606 25289 2488 1 18 . 1 1 30 30 ILE N N 30 124.057 124.057 122.788 1.269 25289 2489 1 18 . 1 1 30 30 ILE C C 30 174.412 174.412 175.175 -0.763 25289 2490 1 18 . 1 1 30 30 ILE CA C 30 57.752 57.752 61.293 -3.541 25289 2491 1 18 . 1 1 30 30 ILE CB C 30 38.797 38.797 40.176 -1.379 25289 2492 1 18 . 1 1 31 31 ILE N N 31 125.346 125.346 125.722 -0.376 25289 2493 1 18 . 1 1 31 31 ILE C C 31 175.726 175.726 176.156 -0.430 25289 2494 1 18 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.732 -2.294 25289 2495 1 18 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.850 0.899 25289 2496 1 18 . 1 1 32 32 GLY N N 32 114.247 114.247 115.527 -1.280 25289 2497 1 18 . 1 1 32 32 GLY C C 32 171.545 171.545 174.288 -2.743 25289 2498 1 18 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.047 2.664 25289 2499 1 18 . 1 1 33 33 LEU N N 33 125.458 125.458 116.622 8.836 25289 2500 1 18 . 1 1 33 33 LEU C C 33 173.806 173.806 175.195 -1.389 25289 2501 1 18 . 1 1 33 33 LEU CA C 33 54.124 54.124 53.758 0.366 25289 2502 1 18 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.891 2.963 25289 2503 1 18 . 1 1 34 34 MET N N 34 126.372 126.372 121.727 4.645 25289 2504 1 18 . 1 1 34 34 MET C C 34 173.609 173.609 175.216 -1.607 25289 2505 1 18 . 1 1 34 34 MET CA C 34 53.644 53.644 54.912 -1.268 25289 2506 1 18 . 1 1 34 34 MET CB C 34 37.230 37.230 34.214 3.016 25289 2507 1 18 . 1 1 35 35 VAL N N 35 125.387 125.387 123.702 1.685 25289 2508 1 18 . 1 1 35 35 VAL C C 35 176.204 176.204 177.301 -1.097 25289 2509 1 18 . 1 1 35 35 VAL CA C 35 58.717 58.717 61.279 -2.562 25289 2510 1 18 . 1 1 35 35 VAL CB C 35 36.067 36.067 31.353 4.714 25289 2511 1 18 . 1 1 36 36 GLY N N 36 117.182 117.182 118.662 -1.480 25289 2512 1 18 . 1 1 36 36 GLY C C 36 173.838 173.838 174.858 -1.020 25289 2513 1 18 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.150 3.203 25289 2514 1 18 . 1 1 37 37 GLY N N 37 105.656 105.656 110.247 -4.591 25289 2515 1 18 . 1 1 37 37 GLY C C 37 169.824 169.824 173.043 -3.219 25289 2516 1 18 . 1 1 37 37 GLY CA C 37 44.974 44.974 45.069 -0.095 25289 2517 1 18 . 1 1 38 38 VAL N N 38 118.585 118.585 121.344 -2.759 25289 2518 1 18 . 1 1 38 38 VAL C C 38 172.917 172.917 175.212 -2.295 25289 2519 1 18 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.060 -0.515 25289 2520 1 18 . 1 1 38 38 VAL CB C 38 36.733 36.733 35.261 1.472 25289 2521 1 19 . 1 1 2 2 ALA N N 2 118.014 118.014 126.682 -8.668 25289 2522 1 19 . 1 1 2 2 ALA C C 2 177.737 177.737 177.881 -0.144 25289 2523 1 19 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.557 0.323 25289 2524 1 19 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.285 -3.592 25289 2525 1 19 . 1 1 3 3 GLU N N 3 121.987 121.987 122.696 -0.709 25289 2526 1 19 . 1 1 3 3 GLU C C 3 176.622 176.622 176.510 0.112 25289 2527 1 19 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.305 4.199 25289 2528 1 19 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.191 -0.568 25289 2529 1 19 . 1 1 4 4 PHE N N 4 114.820 114.820 117.762 -2.942 25289 2530 1 19 . 1 1 4 4 PHE C C 4 175.867 175.867 175.176 0.691 25289 2531 1 19 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.034 -0.050 25289 2532 1 19 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.633 1.067 25289 2533 1 19 . 1 1 5 5 ARG N N 5 132.201 132.201 126.727 5.474 25289 2534 1 19 . 1 1 5 5 ARG C C 5 173.318 173.318 175.093 -1.775 25289 2535 1 19 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.873 -1.237 25289 2536 1 19 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.226 2.497 25289 2537 1 19 . 1 1 6 6 HIS N N 6 126.106 126.106 123.551 2.555 25289 2538 1 19 . 1 1 6 6 HIS C C 6 171.847 171.847 174.231 -2.384 25289 2539 1 19 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.161 -4.992 25289 2540 1 19 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.920 1.417 25289 2541 1 19 . 1 1 7 7 ASP N N 7 129.834 129.834 126.955 2.879 25289 2542 1 19 . 1 1 7 7 ASP C C 7 173.950 173.950 175.285 -1.335 25289 2543 1 19 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.160 -1.737 25289 2544 1 19 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.189 0.835 25289 2545 1 19 . 1 1 8 8 SER N N 8 116.727 116.727 116.653 0.074 25289 2546 1 19 . 1 1 8 8 SER C C 8 175.357 175.357 175.055 0.302 25289 2547 1 19 . 1 1 8 8 SER CA C 8 55.033 55.033 57.967 -2.933 25289 2548 1 19 . 1 1 8 8 SER CB C 8 66.184 66.184 64.955 1.229 25289 2549 1 19 . 1 1 9 9 GLY N N 9 112.188 112.188 109.001 3.187 25289 2550 1 19 . 1 1 9 9 GLY C C 9 173.834 173.834 173.676 0.158 25289 2551 1 19 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.864 1.332 25289 2552 1 19 . 1 1 10 10 TYR N N 10 126.552 126.552 119.318 7.234 25289 2553 1 19 . 1 1 10 10 TYR C C 10 172.647 172.647 174.303 -1.656 25289 2554 1 19 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.520 0.511 25289 2555 1 19 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.541 1.528 25289 2556 1 19 . 1 1 11 11 GLU N N 11 130.897 130.897 124.895 6.002 25289 2557 1 19 . 1 1 11 11 GLU CA C 11 54.828 54.828 56.132 -1.304 25289 2558 1 19 . 1 1 11 11 GLU CB C 11 32.332 32.332 29.888 2.444 25289 2559 1 19 . 1 1 12 12 VAL N N 12 126.150 126.150 125.211 0.939 25289 2560 1 19 . 1 1 12 12 VAL C C 12 175.777 175.777 175.172 0.605 25289 2561 1 19 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.096 -1.544 25289 2562 1 19 . 1 1 12 12 VAL CB C 12 34.866 34.866 32.885 1.981 25289 2563 1 19 . 1 1 13 13 HIS N N 13 125.956 125.956 125.515 0.441 25289 2564 1 19 . 1 1 13 13 HIS C C 13 173.570 173.570 174.605 -1.035 25289 2565 1 19 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.306 -4.862 25289 2566 1 19 . 1 1 13 13 HIS CB C 13 33.390 33.390 30.732 2.658 25289 2567 1 19 . 1 1 14 14 HIS N N 14 118.068 118.068 123.229 -5.161 25289 2568 1 19 . 1 1 14 14 HIS C C 14 173.557 173.557 174.504 -0.947 25289 2569 1 19 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.625 -0.727 25289 2570 1 19 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.970 0.999 25289 2571 1 19 . 1 1 15 15 GLN N N 15 108.832 108.832 123.282 -14.450 25289 2572 1 19 . 1 1 15 15 GLN C C 15 175.161 175.161 175.123 0.038 25289 2573 1 19 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.317 -0.582 25289 2574 1 19 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.372 2.661 25289 2575 1 19 . 1 1 16 16 LYS N N 16 120.134 120.134 124.740 -4.606 25289 2576 1 19 . 1 1 16 16 LYS C C 16 174.135 174.135 175.210 -1.075 25289 2577 1 19 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.347 -1.186 25289 2578 1 19 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.255 3.421 25289 2579 1 19 . 1 1 17 17 LEU N N 17 128.053 128.053 126.330 1.723 25289 2580 1 19 . 1 1 17 17 LEU C C 17 174.949 174.949 175.763 -0.814 25289 2581 1 19 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.226 0.398 25289 2582 1 19 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.603 2.093 25289 2583 1 19 . 1 1 18 18 VAL N N 18 123.642 123.642 124.319 -0.677 25289 2584 1 19 . 1 1 18 18 VAL C C 18 172.776 172.776 175.303 -2.527 25289 2585 1 19 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.951 -0.194 25289 2586 1 19 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.339 1.478 25289 2587 1 19 . 1 1 19 19 PHE N N 19 129.487 129.487 127.924 1.563 25289 2588 1 19 . 1 1 19 19 PHE C C 19 174.192 174.192 175.300 -1.108 25289 2589 1 19 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.881 -0.306 25289 2590 1 19 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.514 3.917 25289 2591 1 19 . 1 1 20 20 PHE N N 20 117.543 117.543 123.097 -5.554 25289 2592 1 19 . 1 1 20 20 PHE C C 20 170.932 170.932 174.543 -3.611 25289 2593 1 19 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.243 0.436 25289 2594 1 19 . 1 1 20 20 PHE CB C 20 32.923 32.923 38.401 -5.478 25289 2595 1 19 . 1 1 21 21 ALA N N 21 115.079 115.079 125.352 -10.273 25289 2596 1 19 . 1 1 21 21 ALA C C 21 177.230 177.230 176.630 0.600 25289 2597 1 19 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.716 -2.724 25289 2598 1 19 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.500 2.688 25289 2599 1 19 . 1 1 22 22 ASP N N 22 118.083 118.083 120.928 -2.845 25289 2600 1 19 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.916 0.553 25289 2601 1 19 . 1 1 22 22 ASP CB C 22 39.067 39.067 39.857 -0.790 25289 2602 1 19 . 1 1 23 23 VAL N N 23 118.167 118.167 119.490 -1.323 25289 2603 1 19 . 1 1 23 23 VAL C C 23 177.102 177.102 176.830 0.272 25289 2604 1 19 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.379 -3.021 25289 2605 1 19 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.049 2.762 25289 2606 1 19 . 1 1 24 24 GLY N N 24 116.706 116.706 114.986 1.720 25289 2607 1 19 . 1 1 24 24 GLY C C 24 175.652 175.652 174.522 1.130 25289 2608 1 19 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.795 3.067 25289 2609 1 19 . 1 1 25 25 SER N N 25 114.116 114.116 114.689 -0.573 25289 2610 1 19 . 1 1 25 25 SER C C 25 171.430 171.430 173.302 -1.872 25289 2611 1 19 . 1 1 25 25 SER CA C 25 57.801 57.801 58.310 -0.509 25289 2612 1 19 . 1 1 25 25 SER CB C 25 66.227 66.227 65.247 0.980 25289 2613 1 19 . 1 1 26 26 ASN N N 26 124.399 124.399 122.403 1.996 25289 2614 1 19 . 1 1 26 26 ASN C C 26 174.397 174.397 174.559 -0.162 25289 2615 1 19 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.382 -0.633 25289 2616 1 19 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.470 1.356 25289 2617 1 19 . 1 1 27 27 LYS N N 27 119.929 119.929 122.819 -2.890 25289 2618 1 19 . 1 1 27 27 LYS C C 27 174.254 174.254 177.009 -2.755 25289 2619 1 19 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.677 -0.887 25289 2620 1 19 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.498 5.873 25289 2621 1 19 . 1 1 28 28 GLY N N 28 110.364 110.364 108.871 1.493 25289 2622 1 19 . 1 1 28 28 GLY C C 28 170.924 170.924 173.196 -2.272 25289 2623 1 19 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.147 -0.161 25289 2624 1 19 . 1 1 29 29 ALA N N 29 131.126 131.126 126.174 4.952 25289 2625 1 19 . 1 1 29 29 ALA C C 29 174.741 174.741 176.469 -1.728 25289 2626 1 19 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.458 -1.300 25289 2627 1 19 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.511 0.671 25289 2628 1 19 . 1 1 30 30 ILE N N 30 124.057 124.057 121.335 2.722 25289 2629 1 19 . 1 1 30 30 ILE C C 30 174.412 174.412 174.259 0.153 25289 2630 1 19 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.428 -2.676 25289 2631 1 19 . 1 1 30 30 ILE CB C 30 38.797 38.797 37.861 0.936 25289 2632 1 19 . 1 1 31 31 ILE N N 31 125.346 125.346 125.385 -0.039 25289 2633 1 19 . 1 1 31 31 ILE C C 31 175.726 175.726 176.194 -0.468 25289 2634 1 19 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.295 -1.857 25289 2635 1 19 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.342 1.407 25289 2636 1 19 . 1 1 32 32 GLY N N 32 114.247 114.247 115.417 -1.170 25289 2637 1 19 . 1 1 32 32 GLY C C 32 171.545 171.545 174.497 -2.952 25289 2638 1 19 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.623 2.088 25289 2639 1 19 . 1 1 33 33 LEU N N 33 125.458 125.458 116.415 9.043 25289 2640 1 19 . 1 1 33 33 LEU C C 33 173.806 173.806 175.030 -1.224 25289 2641 1 19 . 1 1 33 33 LEU CA C 33 54.124 54.124 54.034 0.090 25289 2642 1 19 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.884 2.970 25289 2643 1 19 . 1 1 34 34 MET N N 34 126.372 126.372 121.680 4.692 25289 2644 1 19 . 1 1 34 34 MET C C 34 173.609 173.609 174.838 -1.229 25289 2645 1 19 . 1 1 34 34 MET CA C 34 53.644 53.644 55.156 -1.512 25289 2646 1 19 . 1 1 34 34 MET CB C 34 37.230 37.230 33.755 3.475 25289 2647 1 19 . 1 1 35 35 VAL N N 35 125.387 125.387 124.318 1.069 25289 2648 1 19 . 1 1 35 35 VAL C C 35 176.204 176.204 176.469 -0.265 25289 2649 1 19 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.682 -3.965 25289 2650 1 19 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.566 3.501 25289 2651 1 19 . 1 1 36 36 GLY N N 36 117.182 117.182 113.937 3.245 25289 2652 1 19 . 1 1 36 36 GLY C C 36 173.838 173.838 174.404 -0.566 25289 2653 1 19 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.864 3.490 25289 2654 1 19 . 1 1 37 37 GLY N N 37 105.656 105.656 107.565 -1.909 25289 2655 1 19 . 1 1 37 37 GLY C C 37 169.824 169.824 173.173 -3.349 25289 2656 1 19 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.281 0.693 25289 2657 1 19 . 1 1 38 38 VAL N N 38 118.585 118.585 119.352 -0.767 25289 2658 1 19 . 1 1 38 38 VAL C C 38 172.917 172.917 176.135 -3.218 25289 2659 1 19 . 1 1 38 38 VAL CA C 38 60.545 60.545 60.729 -0.184 25289 2660 1 19 . 1 1 38 38 VAL CB C 38 36.733 36.733 34.568 2.165 25289 2661 1 20 . 1 1 2 2 ALA N N 2 118.014 118.014 125.326 -7.312 25289 2662 1 20 . 1 1 2 2 ALA C C 2 177.737 177.737 177.743 -0.006 25289 2663 1 20 . 1 1 2 2 ALA CA C 2 51.880 51.880 52.050 -0.170 25289 2664 1 20 . 1 1 2 2 ALA CB C 2 15.692 15.692 20.320 -4.628 25289 2665 1 20 . 1 1 3 3 GLU N N 3 121.987 121.987 122.596 -0.609 25289 2666 1 20 . 1 1 3 3 GLU C C 3 176.622 176.622 176.296 0.326 25289 2667 1 20 . 1 1 3 3 GLU CA C 3 62.504 62.504 57.885 4.619 25289 2668 1 20 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.193 -0.570 25289 2669 1 20 . 1 1 4 4 PHE N N 4 114.820 114.820 117.806 -2.986 25289 2670 1 20 . 1 1 4 4 PHE C C 4 175.867 175.867 174.934 0.933 25289 2671 1 20 . 1 1 4 4 PHE CA C 4 57.984 57.984 58.047 -0.063 25289 2672 1 20 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.714 0.986 25289 2673 1 20 . 1 1 5 5 ARG N N 5 132.201 132.201 126.078 6.123 25289 2674 1 20 . 1 1 5 5 ARG C C 5 173.318 173.318 175.254 -1.936 25289 2675 1 20 . 1 1 5 5 ARG CA C 5 54.636 54.636 56.002 -1.366 25289 2676 1 20 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.510 2.213 25289 2677 1 20 . 1 1 6 6 HIS N N 6 126.106 126.106 123.952 2.154 25289 2678 1 20 . 1 1 6 6 HIS C C 6 171.847 171.847 174.218 -2.371 25289 2679 1 20 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.186 -5.017 25289 2680 1 20 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.901 1.437 25289 2681 1 20 . 1 1 7 7 ASP N N 7 129.834 129.834 126.355 3.479 25289 2682 1 20 . 1 1 7 7 ASP C C 7 173.950 173.950 175.048 -1.098 25289 2683 1 20 . 1 1 7 7 ASP CA C 7 52.423 52.423 53.647 -1.224 25289 2684 1 20 . 1 1 7 7 ASP CB C 7 42.024 42.024 40.651 1.373 25289 2685 1 20 . 1 1 8 8 SER N N 8 116.727 116.727 117.417 -0.690 25289 2686 1 20 . 1 1 8 8 SER C C 8 175.357 175.357 174.857 0.500 25289 2687 1 20 . 1 1 8 8 SER CA C 8 55.033 55.033 57.625 -2.592 25289 2688 1 20 . 1 1 8 8 SER CB C 8 66.184 66.184 65.332 0.852 25289 2689 1 20 . 1 1 9 9 GLY N N 9 112.188 112.188 108.700 3.488 25289 2690 1 20 . 1 1 9 9 GLY C C 9 173.834 173.834 173.110 0.724 25289 2691 1 20 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.690 1.506 25289 2692 1 20 . 1 1 10 10 TYR N N 10 126.552 126.552 119.055 7.497 25289 2693 1 20 . 1 1 10 10 TYR C C 10 172.647 172.647 174.039 -1.392 25289 2694 1 20 . 1 1 10 10 TYR CA C 10 58.031 58.031 56.943 1.088 25289 2695 1 20 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.946 1.123 25289 2696 1 20 . 1 1 11 11 GLU N N 11 130.897 130.897 126.867 4.030 25289 2697 1 20 . 1 1 11 11 GLU CA C 11 54.828 54.828 56.034 -1.206 25289 2698 1 20 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.087 2.245 25289 2699 1 20 . 1 1 12 12 VAL N N 12 126.150 126.150 125.334 0.816 25289 2700 1 20 . 1 1 12 12 VAL C C 12 175.777 175.777 174.836 0.941 25289 2701 1 20 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.148 -1.596 25289 2702 1 20 . 1 1 12 12 VAL CB C 12 34.866 34.866 32.922 1.944 25289 2703 1 20 . 1 1 13 13 HIS N N 13 125.956 125.956 124.462 1.494 25289 2704 1 20 . 1 1 13 13 HIS C C 13 173.570 173.570 174.503 -0.933 25289 2705 1 20 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.314 -4.870 25289 2706 1 20 . 1 1 13 13 HIS CB C 13 33.390 33.390 32.000 1.390 25289 2707 1 20 . 1 1 14 14 HIS N N 14 118.068 118.068 122.112 -4.044 25289 2708 1 20 . 1 1 14 14 HIS C C 14 173.557 173.557 174.373 -0.816 25289 2709 1 20 . 1 1 14 14 HIS CA C 14 54.898 54.898 56.007 -1.109 25289 2710 1 20 . 1 1 14 14 HIS CB C 14 31.969 31.969 30.984 0.985 25289 2711 1 20 . 1 1 15 15 GLN N N 15 108.832 108.832 122.618 -13.786 25289 2712 1 20 . 1 1 15 15 GLN C C 15 175.161 175.161 174.971 0.190 25289 2713 1 20 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.342 -0.607 25289 2714 1 20 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.463 2.570 25289 2715 1 20 . 1 1 16 16 LYS N N 16 120.134 120.134 124.382 -4.248 25289 2716 1 20 . 1 1 16 16 LYS C C 16 174.135 174.135 175.206 -1.071 25289 2717 1 20 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.102 -0.941 25289 2718 1 20 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.456 3.221 25289 2719 1 20 . 1 1 17 17 LEU N N 17 128.053 128.053 125.709 2.344 25289 2720 1 20 . 1 1 17 17 LEU C C 17 174.949 174.949 175.489 -0.540 25289 2721 1 20 . 1 1 17 17 LEU CA C 17 54.624 54.624 53.964 0.660 25289 2722 1 20 . 1 1 17 17 LEU CB C 17 44.696 44.696 41.798 2.898 25289 2723 1 20 . 1 1 18 18 VAL N N 18 123.642 123.642 124.350 -0.708 25289 2724 1 20 . 1 1 18 18 VAL C C 18 172.776 172.776 175.408 -2.632 25289 2725 1 20 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.658 0.099 25289 2726 1 20 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.422 1.395 25289 2727 1 20 . 1 1 19 19 PHE N N 19 129.487 129.487 127.785 1.702 25289 2728 1 20 . 1 1 19 19 PHE C C 19 174.192 174.192 174.998 -0.806 25289 2729 1 20 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.259 0.316 25289 2730 1 20 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.162 4.269 25289 2731 1 20 . 1 1 20 20 PHE N N 20 117.543 117.543 120.303 -2.760 25289 2732 1 20 . 1 1 20 20 PHE C C 20 170.932 170.932 173.941 -3.009 25289 2733 1 20 . 1 1 20 20 PHE CA C 20 58.679 58.679 57.675 1.004 25289 2734 1 20 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.522 -4.599 25289 2735 1 20 . 1 1 21 21 ALA N N 21 115.079 115.079 126.646 -11.567 25289 2736 1 20 . 1 1 21 21 ALA C C 21 177.230 177.230 177.316 -0.086 25289 2737 1 20 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.431 -2.439 25289 2738 1 20 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.692 2.496 25289 2739 1 20 . 1 1 22 22 ASP N N 22 118.083 118.083 119.903 -1.820 25289 2740 1 20 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.643 0.826 25289 2741 1 20 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.553 -1.486 25289 2742 1 20 . 1 1 23 23 VAL N N 23 118.167 118.167 120.046 -1.879 25289 2743 1 20 . 1 1 23 23 VAL C C 23 177.102 177.102 176.944 0.158 25289 2744 1 20 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.272 -2.913 25289 2745 1 20 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.074 2.737 25289 2746 1 20 . 1 1 24 24 GLY N N 24 116.706 116.706 114.491 2.215 25289 2747 1 20 . 1 1 24 24 GLY C C 24 175.652 175.652 174.518 1.134 25289 2748 1 20 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.943 2.919 25289 2749 1 20 . 1 1 25 25 SER N N 25 114.116 114.116 115.117 -1.001 25289 2750 1 20 . 1 1 25 25 SER C C 25 171.430 171.430 173.173 -1.743 25289 2751 1 20 . 1 1 25 25 SER CA C 25 57.801 57.801 57.864 -0.063 25289 2752 1 20 . 1 1 25 25 SER CB C 25 66.227 66.227 64.984 1.244 25289 2753 1 20 . 1 1 26 26 ASN N N 26 124.399 124.399 122.720 1.679 25289 2754 1 20 . 1 1 26 26 ASN C C 26 174.397 174.397 174.466 -0.069 25289 2755 1 20 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.067 -0.318 25289 2756 1 20 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.067 1.759 25289 2757 1 20 . 1 1 27 27 LYS N N 27 119.929 119.929 124.157 -4.228 25289 2758 1 20 . 1 1 27 27 LYS C C 27 174.254 174.254 176.883 -2.629 25289 2759 1 20 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.701 -0.911 25289 2760 1 20 . 1 1 27 27 LYS CB C 27 39.371 39.371 34.367 5.004 25289 2761 1 20 . 1 1 28 28 GLY N N 28 110.364 110.364 110.394 -0.030 25289 2762 1 20 . 1 1 28 28 GLY C C 28 170.924 170.924 173.616 -2.692 25289 2763 1 20 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.065 -0.079 25289 2764 1 20 . 1 1 29 29 ALA N N 29 131.126 131.126 126.013 5.113 25289 2765 1 20 . 1 1 29 29 ALA C C 29 174.741 174.741 176.748 -2.007 25289 2766 1 20 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.302 -1.145 25289 2767 1 20 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.448 0.734 25289 2768 1 20 . 1 1 30 30 ILE N N 30 124.057 124.057 121.995 2.062 25289 2769 1 20 . 1 1 30 30 ILE C C 30 174.412 174.412 174.022 0.390 25289 2770 1 20 . 1 1 30 30 ILE CA C 30 57.752 57.752 59.953 -2.200 25289 2771 1 20 . 1 1 30 30 ILE CB C 30 38.797 38.797 36.909 1.888 25289 2772 1 20 . 1 1 31 31 ILE N N 31 125.346 125.346 125.394 -0.048 25289 2773 1 20 . 1 1 31 31 ILE C C 31 175.726 175.726 175.777 -0.051 25289 2774 1 20 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.292 -1.854 25289 2775 1 20 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.130 1.619 25289 2776 1 20 . 1 1 32 32 GLY N N 32 114.247 114.247 115.309 -1.062 25289 2777 1 20 . 1 1 32 32 GLY C C 32 171.545 171.545 174.417 -2.872 25289 2778 1 20 . 1 1 32 32 GLY CA C 32 48.711 48.711 46.440 2.271 25289 2779 1 20 . 1 1 33 33 LEU N N 33 125.458 125.458 116.673 8.785 25289 2780 1 20 . 1 1 33 33 LEU C C 33 173.806 173.806 175.070 -1.264 25289 2781 1 20 . 1 1 33 33 LEU CA C 33 54.124 54.124 54.041 0.083 25289 2782 1 20 . 1 1 33 33 LEU CB C 33 45.854 45.854 43.076 2.778 25289 2783 1 20 . 1 1 34 34 MET N N 34 126.372 126.372 121.515 4.857 25289 2784 1 20 . 1 1 34 34 MET C C 34 173.609 173.609 175.083 -1.474 25289 2785 1 20 . 1 1 34 34 MET CA C 34 53.644 53.644 55.350 -1.706 25289 2786 1 20 . 1 1 34 34 MET CB C 34 37.230 37.230 34.179 3.051 25289 2787 1 20 . 1 1 35 35 VAL N N 35 125.387 125.387 123.533 1.854 25289 2788 1 20 . 1 1 35 35 VAL C C 35 176.204 176.204 176.607 -0.403 25289 2789 1 20 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.517 -3.800 25289 2790 1 20 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.426 3.641 25289 2791 1 20 . 1 1 36 36 GLY N N 36 117.182 117.182 114.011 3.171 25289 2792 1 20 . 1 1 36 36 GLY C C 36 173.838 173.838 175.002 -1.164 25289 2793 1 20 . 1 1 36 36 GLY CA C 36 48.353 48.353 44.699 3.654 25289 2794 1 20 . 1 1 37 37 GLY N N 37 105.656 105.656 107.444 -1.788 25289 2795 1 20 . 1 1 37 37 GLY C C 37 169.824 169.824 173.524 -3.700 25289 2796 1 20 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.400 0.574 25289 2797 1 20 . 1 1 38 38 VAL N N 38 118.585 118.585 117.738 0.847 25289 2798 1 20 . 1 1 38 38 VAL C C 38 172.917 172.917 174.382 -1.465 25289 2799 1 20 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.592 -1.047 25289 2800 1 20 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.550 3.183 25289 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 37 4.289 0.305 4.338 25289 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 25289 3 1 1 "Average Difference" C 35 1.535 0.992 1.188 25289 4 1 1 "Average Difference" CA 37 2.133 0.612 2.071 25289 5 1 1 "Average Difference" CB 31 2.720 -1.590 2.243 25289 6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 25289 7 1 2 "Average Difference" N 37 4.112 0.274 4.160 25289 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 25289 9 1 2 "Average Difference" C 35 1.555 0.991 1.216 25289 10 1 2 "Average Difference" CA 37 2.142 0.602 2.084 25289 11 1 2 "Average Difference" CB 31 2.667 -1.585 2.180 25289 12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 25289 13 1 3 "Average Difference" N 37 4.519 0.047 4.581 25289 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 25289 15 1 3 "Average Difference" C 35 1.609 0.988 1.288 25289 16 1 3 "Average Difference" CA 37 2.119 0.564 2.070 25289 17 1 3 "Average Difference" CB 31 2.598 -1.478 2.172 25289 18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 25289 19 1 4 "Average Difference" N 37 4.832 0.299 4.889 25289 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 25289 21 1 4 "Average Difference" C 35 1.652 0.981 1.349 25289 22 1 4 "Average Difference" CA 37 2.121 0.636 2.052 25289 23 1 4 "Average Difference" CB 31 2.656 -1.523 2.211 25289 24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 25289 25 1 5 "Average Difference" N 37 4.578 -0.027 4.641 25289 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 25289 27 1 5 "Average Difference" C 35 1.557 1.001 1.209 25289 28 1 5 "Average Difference" CA 37 2.125 0.583 2.071 25289 29 1 5 "Average Difference" CB 31 2.607 -1.619 2.078 25289 30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 25289 31 1 6 "Average Difference" N 37 4.841 0.172 4.904 25289 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 25289 33 1 6 "Average Difference" C 35 1.582 1.002 1.242 25289 34 1 6 "Average Difference" CA 37 2.117 0.630 2.049 25289 35 1 6 "Average Difference" CB 31 2.586 -1.483 2.154 25289 36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 25289 37 1 7 "Average Difference" N 37 4.613 -0.706 4.621 25289 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 25289 39 1 7 "Average Difference" C 35 1.556 0.939 1.258 25289 40 1 7 "Average Difference" CA 37 2.167 0.558 2.123 25289 41 1 7 "Average Difference" CB 31 2.449 -1.407 2.038 25289 42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 25289 43 1 8 "Average Difference" N 37 4.544 0.143 4.604 25289 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 25289 45 1 8 "Average Difference" C 35 1.611 0.998 1.283 25289 46 1 8 "Average Difference" CA 37 2.106 0.554 2.060 25289 47 1 8 "Average Difference" CB 31 2.631 -1.703 2.039 25289 48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 25289 49 1 9 "Average Difference" N 37 4.537 0.149 4.597 25289 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 25289 51 1 9 "Average Difference" C 35 1.605 1.017 1.259 25289 52 1 9 "Average Difference" CA 37 2.072 0.527 2.031 25289 53 1 9 "Average Difference" CB 31 2.566 -1.604 2.036 25289 54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 25289 55 1 10 "Average Difference" N 37 4.257 -0.399 4.297 25289 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 25289 57 1 10 "Average Difference" C 35 1.681 1.070 1.316 25289 58 1 10 "Average Difference" CA 37 2.106 0.642 2.033 25289 59 1 10 "Average Difference" CB 31 2.509 -1.536 2.017 25289 60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 25289 61 1 11 "Average Difference" N 37 4.629 0.450 4.670 25289 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 25289 63 1 11 "Average Difference" C 35 1.603 0.917 1.333 25289 64 1 11 "Average Difference" CA 37 2.025 0.555 1.974 25289 65 1 11 "Average Difference" CB 31 2.659 -1.672 2.103 25289 66 1 11 "Average Difference" HN 0 0.000 0.000 0.000 25289 67 1 12 "Average Difference" N 37 4.710 0.038 4.774 25289 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 25289 69 1 12 "Average Difference" C 35 1.598 0.951 1.302 25289 70 1 12 "Average Difference" CA 37 2.048 0.560 1.997 25289 71 1 12 "Average Difference" CB 31 2.579 -1.566 2.083 25289 72 1 12 "Average Difference" HN 0 0.000 0.000 0.000 25289 73 1 13 "Average Difference" N 37 4.455 -0.401 4.498 25289 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 25289 75 1 13 "Average Difference" C 35 1.619 1.008 1.286 25289 76 1 13 "Average Difference" CA 37 2.190 0.634 2.125 25289 77 1 13 "Average Difference" CB 31 2.469 -1.477 2.011 25289 78 1 13 "Average Difference" HN 0 0.000 0.000 0.000 25289 79 1 14 "Average Difference" N 37 4.654 -0.068 4.718 25289 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 25289 81 1 14 "Average Difference" C 35 1.575 0.932 1.288 25289 82 1 14 "Average Difference" CA 37 2.172 0.581 2.122 25289 83 1 14 "Average Difference" CB 31 2.571 -1.544 2.089 25289 84 1 14 "Average Difference" HN 0 0.000 0.000 0.000 25289 85 1 15 "Average Difference" N 37 4.758 -0.047 4.823 25289 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 25289 87 1 15 "Average Difference" C 35 1.599 0.999 1.267 25289 88 1 15 "Average Difference" CA 37 2.067 0.606 2.004 25289 89 1 15 "Average Difference" CB 31 2.533 -1.508 2.069 25289 90 1 15 "Average Difference" HN 0 0.000 0.000 0.000 25289 91 1 16 "Average Difference" N 37 4.491 -0.087 4.552 25289 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 25289 93 1 16 "Average Difference" C 35 1.601 1.042 1.233 25289 94 1 16 "Average Difference" CA 37 2.154 0.645 2.084 25289 95 1 16 "Average Difference" CB 31 2.606 -1.602 2.089 25289 96 1 16 "Average Difference" HN 0 0.000 0.000 0.000 25289 97 1 17 "Average Difference" N 37 4.344 -0.082 4.403 25289 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 25289 99 1 17 "Average Difference" C 35 1.622 1.109 1.201 25289 100 1 17 "Average Difference" CA 37 2.144 0.687 2.059 25289 101 1 17 "Average Difference" CB 31 2.530 -1.496 2.074 25289 102 1 17 "Average Difference" HN 0 0.000 0.000 0.000 25289 103 1 18 "Average Difference" N 37 4.318 -0.025 4.378 25289 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 25289 105 1 18 "Average Difference" C 35 1.660 1.061 1.295 25289 106 1 18 "Average Difference" CA 37 2.072 0.609 2.008 25289 107 1 18 "Average Difference" CB 31 2.441 -1.445 1.999 25289 108 1 18 "Average Difference" HN 0 0.000 0.000 0.000 25289 109 1 19 "Average Difference" N 37 4.674 0.042 4.738 25289 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 25289 111 1 19 "Average Difference" C 35 1.636 1.040 1.281 25289 112 1 19 "Average Difference" CA 37 2.102 0.646 2.027 25289 113 1 19 "Average Difference" CB 31 2.601 -1.567 2.110 25289 114 1 19 "Average Difference" HN 0 0.000 0.000 0.000 25289 115 1 20 "Average Difference" N 37 4.541 -0.085 4.603 25289 116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 25289 117 1 20 "Average Difference" C 35 1.575 0.941 1.282 25289 118 1 20 "Average Difference" CA 37 2.101 0.530 2.061 25289 119 1 20 "Average Difference" CB 31 2.570 -1.540 2.091 25289 120 1 20 "Average Difference" HN 0 0.000 0.000 0.000 25289 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 25289 _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 ALA N N 2 118.014 118.014 125.611 -7.597 25289 2 1 . 1 1 2 2 ALA C C 2 177.737 177.737 178.072 -0.335 25289 3 1 . 1 1 2 2 ALA CA C 2 51.880 51.880 51.853 0.027 25289 4 1 . 1 1 2 2 ALA CB C 2 15.692 15.692 19.151 -3.459 25289 5 1 . 1 1 3 3 GLU N N 3 121.987 121.987 121.897 0.090 25289 6 1 . 1 1 3 3 GLU C C 3 176.622 176.622 176.377 0.245 25289 7 1 . 1 1 3 3 GLU CA C 3 62.504 62.504 58.391 4.113 25289 8 1 . 1 1 3 3 GLU CB C 3 29.623 29.623 30.145 -0.522 25289 9 1 . 1 1 4 4 PHE N N 4 114.820 114.820 117.635 -2.815 25289 10 1 . 1 1 4 4 PHE C C 4 175.867 175.867 174.854 1.013 25289 11 1 . 1 1 4 4 PHE CA C 4 57.984 57.984 57.958 0.026 25289 12 1 . 1 1 4 4 PHE CB C 4 41.700 41.700 40.649 1.051 25289 13 1 . 1 1 5 5 ARG N N 5 132.201 132.201 126.467 5.734 25289 14 1 . 1 1 5 5 ARG C C 5 173.318 173.318 175.274 -1.956 25289 15 1 . 1 1 5 5 ARG CA C 5 54.636 54.636 55.732 -1.096 25289 16 1 . 1 1 5 5 ARG CB C 5 33.723 33.723 31.348 2.375 25289 17 1 . 1 1 6 6 HIS N N 6 126.106 126.106 123.312 2.794 25289 18 1 . 1 1 6 6 HIS C C 6 171.847 171.847 174.488 -2.641 25289 19 1 . 1 1 6 6 HIS CA C 6 51.169 51.169 56.115 -4.946 25289 20 1 . 1 1 6 6 HIS CB C 6 32.337 32.337 30.887 1.450 25289 21 1 . 1 1 7 7 ASP N N 7 129.834 129.834 126.056 3.778 25289 22 1 . 1 1 7 7 ASP C C 7 173.950 173.950 175.021 -1.071 25289 23 1 . 1 1 7 7 ASP CA C 7 52.423 52.423 54.097 -1.674 25289 24 1 . 1 1 7 7 ASP CB C 7 42.024 42.024 41.255 0.769 25289 25 1 . 1 1 8 8 SER N N 8 116.727 116.727 117.466 -0.739 25289 26 1 . 1 1 8 8 SER C C 8 175.357 175.357 175.066 0.291 25289 27 1 . 1 1 8 8 SER CA C 8 55.033 55.033 57.734 -2.701 25289 28 1 . 1 1 8 8 SER CB C 8 66.184 66.184 64.863 1.321 25289 29 1 . 1 1 9 9 GLY N N 9 112.188 112.188 109.276 2.912 25289 30 1 . 1 1 9 9 GLY C C 9 173.834 173.834 173.420 0.414 25289 31 1 . 1 1 9 9 GLY CA C 9 47.196 47.196 45.738 1.458 25289 32 1 . 1 1 10 10 TYR N N 10 126.552 126.552 119.411 7.141 25289 33 1 . 1 1 10 10 TYR C C 10 172.647 172.647 174.012 -1.365 25289 34 1 . 1 1 10 10 TYR CA C 10 58.031 58.031 57.088 0.942 25289 35 1 . 1 1 10 10 TYR CB C 10 42.069 42.069 40.377 1.692 25289 36 1 . 1 1 11 11 GLU N N 11 130.897 130.897 126.950 3.947 25289 37 1 . 1 1 11 11 GLU CA C 11 54.828 54.828 55.918 -1.090 25289 38 1 . 1 1 11 11 GLU CB C 11 32.332 32.332 30.490 1.842 25289 39 1 . 1 1 12 12 VAL N N 12 126.150 126.150 125.025 1.124 25289 40 1 . 1 1 12 12 VAL C C 12 175.777 175.777 174.946 0.831 25289 41 1 . 1 1 12 12 VAL CA C 12 60.552 60.552 62.057 -1.505 25289 42 1 . 1 1 12 12 VAL CB C 12 34.866 34.866 33.449 1.417 25289 43 1 . 1 1 13 13 HIS N N 13 125.956 125.956 125.480 0.476 25289 44 1 . 1 1 13 13 HIS C C 13 173.570 173.570 174.581 -1.011 25289 45 1 . 1 1 13 13 HIS CA C 13 50.444 50.444 55.347 -4.903 25289 46 1 . 1 1 13 13 HIS CB C 13 33.390 33.390 31.112 2.278 25289 47 1 . 1 1 14 14 HIS N N 14 118.068 118.068 122.845 -4.777 25289 48 1 . 1 1 14 14 HIS C C 14 173.557 173.557 174.457 -0.900 25289 49 1 . 1 1 14 14 HIS CA C 14 54.898 54.898 55.788 -0.890 25289 50 1 . 1 1 14 14 HIS CB C 14 31.969 31.969 31.039 0.930 25289 51 1 . 1 1 15 15 GLN N N 15 108.832 108.832 123.096 -14.264 25289 52 1 . 1 1 15 15 GLN C C 15 175.161 175.161 175.098 0.063 25289 53 1 . 1 1 15 15 GLN CA C 15 54.735 54.735 55.329 -0.594 25289 54 1 . 1 1 15 15 GLN CB C 15 33.033 33.033 30.294 2.739 25289 55 1 . 1 1 16 16 LYS N N 16 120.134 120.134 124.513 -4.379 25289 56 1 . 1 1 16 16 LYS C C 16 174.135 174.135 175.205 -1.070 25289 57 1 . 1 1 16 16 LYS CA C 16 55.161 55.161 56.119 -0.958 25289 58 1 . 1 1 16 16 LYS CB C 16 36.677 36.677 33.303 3.374 25289 59 1 . 1 1 17 17 LEU N N 17 128.053 128.053 126.310 1.743 25289 60 1 . 1 1 17 17 LEU C C 17 174.949 174.949 175.630 -0.681 25289 61 1 . 1 1 17 17 LEU CA C 17 54.624 54.624 54.123 0.501 25289 62 1 . 1 1 17 17 LEU CB C 17 44.696 44.696 42.302 2.394 25289 63 1 . 1 1 18 18 VAL N N 18 123.642 123.642 123.115 0.527 25289 64 1 . 1 1 18 18 VAL C C 18 172.776 172.776 175.375 -2.599 25289 65 1 . 1 1 18 18 VAL CA C 18 61.757 61.757 61.507 0.250 25289 66 1 . 1 1 18 18 VAL CB C 18 33.817 33.817 32.257 1.560 25289 67 1 . 1 1 19 19 PHE N N 19 129.487 129.487 127.284 2.203 25289 68 1 . 1 1 19 19 PHE C C 19 174.192 174.192 175.397 -1.205 25289 69 1 . 1 1 19 19 PHE CA C 19 55.575 55.575 55.833 -0.258 25289 70 1 . 1 1 19 19 PHE CB C 19 42.431 42.431 38.915 3.516 25289 71 1 . 1 1 20 20 PHE N N 20 117.543 117.543 120.874 -3.331 25289 72 1 . 1 1 20 20 PHE C C 20 170.932 170.932 174.525 -3.593 25289 73 1 . 1 1 20 20 PHE CA C 20 58.679 58.679 58.035 0.644 25289 74 1 . 1 1 20 20 PHE CB C 20 32.923 32.923 37.909 -4.986 25289 75 1 . 1 1 21 21 ALA N N 21 115.079 115.079 124.516 -9.437 25289 76 1 . 1 1 21 21 ALA C C 21 177.230 177.230 176.904 0.326 25289 77 1 . 1 1 21 21 ALA CA C 21 48.992 48.992 51.940 -2.948 25289 78 1 . 1 1 21 21 ALA CB C 21 23.188 23.188 20.109 3.078 25289 79 1 . 1 1 22 22 ASP N N 22 118.083 118.083 121.554 -3.471 25289 80 1 . 1 1 22 22 ASP CA C 22 55.469 55.469 54.882 0.587 25289 81 1 . 1 1 22 22 ASP CB C 22 39.067 39.067 40.441 -1.374 25289 82 1 . 1 1 23 23 VAL N N 23 118.167 118.167 120.326 -2.159 25289 83 1 . 1 1 23 23 VAL C C 23 177.102 177.102 176.672 0.430 25289 84 1 . 1 1 23 23 VAL CA C 23 58.358 58.358 61.189 -2.831 25289 85 1 . 1 1 23 23 VAL CB C 23 36.811 36.811 34.058 2.753 25289 86 1 . 1 1 24 24 GLY N N 24 116.706 116.706 115.153 1.553 25289 87 1 . 1 1 24 24 GLY C C 24 175.652 175.652 174.628 1.024 25289 88 1 . 1 1 24 24 GLY CA C 24 48.862 48.862 45.883 2.979 25289 89 1 . 1 1 25 25 SER N N 25 114.116 114.116 114.643 -0.527 25289 90 1 . 1 1 25 25 SER C C 25 171.430 171.430 173.129 -1.699 25289 91 1 . 1 1 25 25 SER CA C 25 57.801 57.801 58.208 -0.407 25289 92 1 . 1 1 25 25 SER CB C 25 66.227 66.227 64.864 1.363 25289 93 1 . 1 1 26 26 ASN N N 26 124.399 124.399 122.340 2.059 25289 94 1 . 1 1 26 26 ASN C C 26 174.397 174.397 174.483 -0.086 25289 95 1 . 1 1 26 26 ASN CA C 26 52.749 52.749 53.145 -0.396 25289 96 1 . 1 1 26 26 ASN CB C 26 40.826 40.826 39.067 1.759 25289 97 1 . 1 1 27 27 LYS N N 27 119.929 119.929 123.540 -3.611 25289 98 1 . 1 1 27 27 LYS C C 27 174.254 174.254 176.881 -2.627 25289 99 1 . 1 1 27 27 LYS CA C 27 54.790 54.790 55.513 -0.723 25289 100 1 . 1 1 27 27 LYS CB C 27 39.371 39.371 33.965 5.406 25289 101 1 . 1 1 28 28 GLY N N 28 110.364 110.364 109.672 0.692 25289 102 1 . 1 1 28 28 GLY C C 28 170.924 170.924 173.535 -2.611 25289 103 1 . 1 1 28 28 GLY CA C 28 44.986 44.986 45.042 -0.056 25289 104 1 . 1 1 29 29 ALA N N 29 131.126 131.126 125.647 5.479 25289 105 1 . 1 1 29 29 ALA C C 29 174.741 174.741 176.692 -1.951 25289 106 1 . 1 1 29 29 ALA CA C 29 50.157 50.157 51.751 -1.594 25289 107 1 . 1 1 29 29 ALA CB C 29 20.182 20.182 19.370 0.812 25289 108 1 . 1 1 30 30 ILE N N 30 124.057 124.057 123.193 0.864 25289 109 1 . 1 1 30 30 ILE C C 30 174.412 174.412 174.849 -0.437 25289 110 1 . 1 1 30 30 ILE CA C 30 57.752 57.752 60.764 -3.012 25289 111 1 . 1 1 30 30 ILE CB C 30 38.797 38.797 38.727 0.070 25289 112 1 . 1 1 31 31 ILE N N 31 125.346 125.346 126.298 -0.952 25289 113 1 . 1 1 31 31 ILE C C 31 175.726 175.726 176.040 -0.315 25289 114 1 . 1 1 31 31 ILE CA C 31 58.438 58.438 60.596 -2.159 25289 115 1 . 1 1 31 31 ILE CB C 31 41.749 41.749 40.388 1.361 25289 116 1 . 1 1 32 32 GLY N N 32 114.247 114.247 114.980 -0.733 25289 117 1 . 1 1 32 32 GLY C C 32 171.545 171.545 174.050 -2.505 25289 118 1 . 1 1 32 32 GLY CA C 32 48.711 48.711 45.975 2.736 25289 119 1 . 1 1 33 33 LEU N N 33 125.458 125.458 116.730 8.728 25289 120 1 . 1 1 33 33 LEU C C 33 173.806 173.806 175.023 -1.217 25289 121 1 . 1 1 33 33 LEU CA C 33 54.124 54.124 54.072 0.052 25289 122 1 . 1 1 33 33 LEU CB C 33 45.854 45.854 42.815 3.039 25289 123 1 . 1 1 34 34 MET N N 34 126.372 126.372 121.992 4.380 25289 124 1 . 1 1 34 34 MET C C 34 173.609 173.609 175.014 -1.405 25289 125 1 . 1 1 34 34 MET CA C 34 53.644 53.644 55.006 -1.362 25289 126 1 . 1 1 34 34 MET CB C 34 37.230 37.230 34.004 3.226 25289 127 1 . 1 1 35 35 VAL N N 35 125.387 125.387 123.821 1.566 25289 128 1 . 1 1 35 35 VAL C C 35 176.204 176.204 176.547 -0.343 25289 129 1 . 1 1 35 35 VAL CA C 35 58.717 58.717 62.201 -3.484 25289 130 1 . 1 1 35 35 VAL CB C 35 36.067 36.067 32.393 3.674 25289 131 1 . 1 1 36 36 GLY N N 36 117.182 117.182 114.447 2.735 25289 132 1 . 1 1 36 36 GLY C C 36 173.838 173.838 174.660 -0.822 25289 133 1 . 1 1 36 36 GLY CA C 36 48.353 48.353 45.047 3.307 25289 134 1 . 1 1 37 37 GLY N N 37 105.656 105.656 107.016 -1.360 25289 135 1 . 1 1 37 37 GLY C C 37 169.824 169.824 173.154 -3.330 25289 136 1 . 1 1 37 37 GLY CA C 37 44.974 44.974 44.460 0.514 25289 137 1 . 1 1 38 38 VAL N N 38 118.585 118.585 118.943 -0.358 25289 138 1 . 1 1 38 38 VAL C C 38 172.917 172.917 174.746 -1.829 25289 139 1 . 1 1 38 38 VAL CA C 38 60.545 60.545 61.229 -0.684 25289 140 1 . 1 1 38 38 VAL CB C 38 36.733 36.733 33.675 3.058 25289 stop_ save_