data_25294 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25294 _Entry.PDB_ID 2MW1 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 25294 _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 5 5 SER N N 5 116.267 116.267 116.687 -0.420 25294 2 1 1 . 1 1 5 5 SER HA H 5 4.349 4.349 4.684 -0.335 25294 3 1 1 . 1 1 5 5 SER CA C 5 55.478 55.478 57.386 -1.908 25294 4 1 1 . 1 1 5 5 SER CB C 5 61.191 61.191 64.962 -3.771 25294 5 1 1 . 1 1 6 6 ASP N N 6 123.039 123.039 124.124 -1.085 25294 6 1 1 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.875 -0.048 25294 7 1 1 . 1 1 6 6 ASP CA C 6 49.671 49.671 53.434 -3.764 25294 8 1 1 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.155 -2.499 25294 9 1 1 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.349 -0.032 25294 10 1 1 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.416 -3.269 25294 11 1 1 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.061 -2.583 25294 12 1 1 . 1 1 8 8 ASP N N 8 119.159 119.159 118.276 0.883 25294 13 1 1 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.738 -0.173 25294 14 1 1 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.123 -2.264 25294 15 1 1 . 1 1 8 8 ASP CB C 8 38.725 38.725 40.919 -2.195 25294 16 1 1 . 1 1 9 9 GLY N N 9 108.837 108.837 108.606 0.231 25294 17 1 1 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.683 -2.547 25294 18 1 1 . 1 1 10 10 LEU N N 10 121.571 121.571 119.131 2.440 25294 19 1 1 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.804 -0.537 25294 20 1 1 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.568 -1.177 25294 21 1 1 . 1 1 10 10 LEU CB C 10 39.863 39.863 43.293 -3.430 25294 22 1 1 . 1 1 11 11 ALA N N 11 125.169 125.169 122.771 2.398 25294 23 1 1 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.594 -0.258 25294 24 1 1 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.296 -2.312 25294 25 1 1 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.855 -2.673 25294 26 1 1 . 1 1 12 12 ASP N N 12 122.672 122.672 125.345 -2.673 25294 27 1 1 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.684 0.052 25294 28 1 1 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.792 -3.090 25294 29 1 1 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.676 -3.845 25294 30 1 1 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.441 -0.137 25294 31 1 1 . 1 1 13 13 PRO CA C 13 59.600 59.600 63.128 -3.528 25294 32 1 1 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.497 -2.981 25294 33 1 1 . 1 1 14 14 MET N N 14 120.151 120.151 120.514 -0.363 25294 34 1 1 . 1 1 14 14 MET HA H 14 3.780 3.780 4.405 -0.625 25294 35 1 1 . 1 1 14 14 MET CA C 14 55.822 55.822 56.617 -0.795 25294 36 1 1 . 1 1 14 14 MET CB C 14 30.909 30.909 33.114 -2.205 25294 37 1 1 . 1 1 15 15 LYS N N 15 123.897 123.897 121.908 1.989 25294 38 1 1 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.725 -0.268 25294 39 1 1 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.232 -3.825 25294 40 1 1 . 1 1 15 15 LYS CB C 15 32.453 32.453 36.717 -4.264 25294 41 1 1 . 1 1 16 16 TRP N N 16 125.776 125.776 122.828 2.948 25294 42 1 1 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.301 -0.226 25294 43 1 1 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.793 -3.141 25294 44 1 1 . 1 1 16 16 TRP CB C 16 28.000 28.000 32.131 -4.131 25294 45 1 1 . 1 1 17 17 SER N N 17 120.772 120.772 118.146 2.626 25294 46 1 1 . 1 1 17 17 SER HA H 17 4.403 4.403 4.422 -0.019 25294 47 1 1 . 1 1 17 17 SER CA C 17 56.167 56.167 59.861 -3.694 25294 48 1 1 . 1 1 17 17 SER CB C 17 60.833 60.833 63.593 -2.760 25294 49 1 1 . 1 1 18 18 LYS N N 18 121.096 121.096 121.251 -0.155 25294 50 1 1 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.609 0.108 25294 51 1 1 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.353 -1.618 25294 52 1 1 . 1 1 18 18 LYS CB C 18 32.917 32.917 34.812 -1.895 25294 53 1 1 . 1 1 19 19 VAL N N 19 116.358 116.358 120.025 -3.667 25294 54 1 1 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.751 -0.328 25294 55 1 1 . 1 1 19 19 VAL CA C 19 55.230 55.230 57.807 -2.577 25294 56 1 1 . 1 1 19 19 VAL CB C 19 31.026 31.026 33.524 -2.498 25294 57 1 1 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.581 -0.278 25294 58 1 1 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.645 -2.875 25294 59 1 1 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.600 -3.047 25294 60 1 1 . 1 1 21 21 SER N N 21 118.882 118.882 118.240 0.642 25294 61 1 1 . 1 1 21 21 SER HA H 21 4.084 4.084 4.224 -0.140 25294 62 1 1 . 1 1 21 21 SER CA C 21 57.657 57.657 60.280 -2.623 25294 63 1 1 . 1 1 21 21 SER CB C 21 60.173 60.173 62.853 -2.680 25294 64 1 1 . 1 1 22 22 GLY N N 22 109.523 109.523 109.753 -0.230 25294 65 1 1 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.493 -2.089 25294 66 1 1 . 1 1 23 23 LEU N N 23 123.003 123.003 121.196 1.807 25294 67 1 1 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.181 -0.147 25294 68 1 1 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.494 -1.891 25294 69 1 1 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.514 -2.443 25294 70 1 1 . 1 1 24 24 LYS N N 24 129.004 129.004 128.061 0.943 25294 71 1 1 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.469 0.041 25294 72 1 1 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.649 -2.412 25294 73 1 1 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.703 -1.542 25294 74 1 1 . 1 1 25 25 ASN N N 25 126.336 126.336 125.143 1.193 25294 75 1 1 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.443 -0.119 25294 76 1 1 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.783 -2.163 25294 77 1 1 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.765 -2.780 25294 78 1 1 . 1 1 26 26 GLY N N 26 103.076 103.076 102.600 0.476 25294 79 1 1 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.228 -1.679 25294 80 1 1 . 1 1 27 27 GLU N N 27 120.878 120.878 122.310 -1.432 25294 81 1 1 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.870 0.332 25294 82 1 1 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.347 -4.114 25294 83 1 1 . 1 1 27 27 GLU CB C 27 30.761 30.761 30.832 -0.071 25294 84 1 1 . 1 1 28 28 LEU N N 28 128.583 128.583 128.275 0.308 25294 85 1 1 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.796 -0.241 25294 86 1 1 . 1 1 28 28 LEU CA C 28 50.324 50.324 52.748 -2.424 25294 87 1 1 . 1 1 28 28 LEU CB C 28 43.517 43.517 41.708 1.809 25294 88 1 1 . 1 1 29 29 LYS N N 29 127.554 127.554 126.074 1.480 25294 89 1 1 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.671 0.230 25294 90 1 1 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.966 -3.127 25294 91 1 1 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.294 -3.771 25294 92 1 1 . 1 1 30 30 VAL N N 30 127.915 127.915 123.128 4.787 25294 93 1 1 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.485 -0.301 25294 94 1 1 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.255 -1.947 25294 95 1 1 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.247 -3.977 25294 96 1 1 . 1 1 31 31 GLU N N 31 125.151 125.151 123.222 1.929 25294 97 1 1 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.535 -0.174 25294 98 1 1 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.513 -0.413 25294 99 1 1 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.463 -3.760 25294 100 1 1 . 1 1 32 32 ALA N N 32 126.271 126.271 120.159 6.112 25294 101 1 1 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.210 -0.194 25294 102 1 1 . 1 1 32 32 ALA CA C 32 53.127 53.127 53.175 -0.048 25294 103 1 1 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.255 -2.989 25294 104 1 1 . 1 1 33 33 GLU N N 33 113.076 113.076 116.160 -3.084 25294 105 1 1 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.416 -0.451 25294 106 1 1 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.311 -0.326 25294 107 1 1 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.938 -4.009 25294 108 1 1 . 1 1 34 34 GLY N N 34 104.905 104.905 107.996 -3.091 25294 109 1 1 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.169 -4.462 25294 110 1 1 . 1 1 35 35 GLY N N 35 105.946 105.946 107.704 -1.758 25294 111 1 1 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.064 -1.076 25294 112 1 1 . 1 1 36 36 SER N N 36 116.044 116.044 115.173 0.871 25294 113 1 1 . 1 1 36 36 SER HA H 36 5.539 5.539 5.411 0.128 25294 114 1 1 . 1 1 36 36 SER CA C 36 54.323 54.323 57.142 -2.819 25294 115 1 1 . 1 1 36 36 SER CB C 36 62.808 62.808 65.355 -2.547 25294 116 1 1 . 1 1 37 37 SER N N 37 119.501 119.501 115.746 3.755 25294 117 1 1 . 1 1 37 37 SER HA H 37 4.712 4.712 4.602 0.110 25294 118 1 1 . 1 1 37 37 SER CA C 37 55.548 55.548 58.023 -2.475 25294 119 1 1 . 1 1 37 37 SER CB C 37 63.943 63.943 65.146 -1.203 25294 120 1 1 . 1 1 38 38 LEU N N 38 125.962 125.962 123.696 2.266 25294 121 1 1 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.961 0.292 25294 122 1 1 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.145 -2.363 25294 123 1 1 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.378 -2.544 25294 124 1 1 . 1 1 39 39 PHE N N 39 124.707 124.707 124.751 -0.044 25294 125 1 1 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.260 -0.121 25294 126 1 1 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.837 -3.706 25294 127 1 1 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.287 -1.335 25294 128 1 1 . 1 1 40 40 ALA N N 40 124.994 124.994 126.888 -1.894 25294 129 1 1 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.851 -0.216 25294 130 1 1 . 1 1 40 40 ALA CA C 40 48.301 48.301 49.840 -1.539 25294 131 1 1 . 1 1 40 40 ALA CB C 40 19.446 19.446 21.364 -1.918 25294 132 1 1 . 1 1 41 41 CYS N N 41 125.757 125.757 123.202 2.555 25294 133 1 1 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.922 -0.776 25294 134 1 1 . 1 1 41 41 CYS CA C 41 56.465 56.465 56.599 -0.134 25294 135 1 1 . 1 1 41 41 CYS CB C 41 25.973 25.973 29.446 -3.473 25294 136 1 1 . 1 1 42 42 LYS N N 42 129.019 129.019 122.408 6.611 25294 137 1 1 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.346 -0.086 25294 138 1 1 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.234 -2.383 25294 139 1 1 . 1 1 42 42 LYS CB C 42 32.107 32.107 33.575 -1.468 25294 140 1 1 . 1 1 43 43 ASN N N 43 113.240 113.240 117.580 -4.340 25294 141 1 1 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.546 -0.021 25294 142 1 1 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.640 -3.405 25294 143 1 1 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.676 -4.815 25294 144 1 1 . 1 1 44 44 TYR N N 44 119.335 119.335 119.711 -0.376 25294 145 1 1 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.570 -0.013 25294 146 1 1 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.494 -1.776 25294 147 1 1 . 1 1 44 44 TYR CB C 44 37.372 37.372 39.086 -1.714 25294 148 1 1 . 1 1 45 45 LYS N N 45 120.676 120.676 122.157 -1.481 25294 149 1 1 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.653 -0.617 25294 150 1 1 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.536 -1.998 25294 151 1 1 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.980 -2.747 25294 152 1 1 . 1 1 46 46 SER N N 46 108.797 108.797 115.255 -6.458 25294 153 1 1 . 1 1 46 46 SER HA H 46 4.388 4.388 4.742 -0.354 25294 154 1 1 . 1 1 46 46 SER CA C 46 53.664 53.664 57.724 -4.060 25294 155 1 1 . 1 1 46 46 SER CB C 46 61.810 61.810 63.440 -1.630 25294 156 1 1 . 1 1 47 47 PHE N N 47 117.325 117.325 120.251 -2.926 25294 157 1 1 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.071 -0.429 25294 158 1 1 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.328 -2.711 25294 159 1 1 . 1 1 47 47 PHE CB C 47 37.101 37.101 41.612 -4.511 25294 160 1 1 . 1 1 48 48 TRP N N 48 117.090 117.090 115.883 1.207 25294 161 1 1 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.168 0.067 25294 162 1 1 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.494 -2.002 25294 163 1 1 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.300 -1.405 25294 164 1 1 . 1 1 49 49 ILE N N 49 119.682 119.682 121.122 -1.440 25294 165 1 1 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.148 -0.117 25294 166 1 1 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.963 -1.490 25294 167 1 1 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.543 -0.107 25294 168 1 1 . 1 1 50 50 SER N N 50 124.071 124.071 121.333 2.738 25294 169 1 1 . 1 1 50 50 SER HA H 50 4.708 4.708 4.756 -0.048 25294 170 1 1 . 1 1 50 50 SER CA C 50 56.110 56.110 57.928 -1.819 25294 171 1 1 . 1 1 50 50 SER CB C 50 63.816 63.816 65.018 -1.202 25294 172 1 1 . 1 1 51 51 SER N N 51 111.253 111.253 116.013 -4.760 25294 173 1 1 . 1 1 51 51 SER HA H 51 4.557 4.557 4.695 -0.138 25294 174 1 1 . 1 1 51 51 SER CA C 51 55.564 55.564 57.276 -1.712 25294 175 1 1 . 1 1 51 51 SER CB C 51 62.821 62.821 65.843 -3.022 25294 176 1 1 . 1 1 52 52 VAL N N 52 121.147 121.147 119.138 2.009 25294 177 1 1 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.607 0.124 25294 178 1 1 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.520 -1.394 25294 179 1 1 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.651 -3.151 25294 180 1 1 . 1 1 53 53 LYS N N 53 126.128 126.128 124.516 1.612 25294 181 1 1 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.690 0.317 25294 182 1 1 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.669 -2.946 25294 183 1 1 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.535 -1.763 25294 184 1 1 . 1 1 54 54 GLU N N 54 124.160 124.160 123.649 0.511 25294 185 1 1 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.588 1.170 25294 186 1 1 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.410 -2.151 25294 187 1 1 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.780 -0.721 25294 188 1 1 . 1 1 55 55 GLU N N 55 127.218 127.218 118.941 8.277 25294 189 1 1 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.416 -0.508 25294 190 1 1 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.472 -1.926 25294 191 1 1 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.272 -4.978 25294 192 1 1 . 1 1 56 56 GLY N N 56 104.894 104.894 108.950 -4.056 25294 193 1 1 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.401 -3.520 25294 194 1 1 . 1 1 57 57 LYS N N 57 120.444 120.444 116.624 3.820 25294 195 1 1 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.729 -0.165 25294 196 1 1 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.104 -2.145 25294 197 1 1 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.246 -3.058 25294 198 1 1 . 1 1 58 58 PHE N N 58 121.824 121.824 119.656 2.168 25294 199 1 1 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.055 -0.284 25294 200 1 1 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.629 -0.464 25294 201 1 1 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.241 -3.339 25294 202 1 1 . 1 1 59 59 LYS N N 59 123.205 123.205 119.803 3.402 25294 203 1 1 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.696 -0.245 25294 204 1 1 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.979 -3.994 25294 205 1 1 . 1 1 59 59 LYS CB C 59 29.791 29.791 35.346 -5.556 25294 206 1 1 . 1 1 60 60 GLU N N 60 122.647 122.647 118.729 3.918 25294 207 1 1 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.303 -0.043 25294 208 1 1 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.573 -1.667 25294 209 1 1 . 1 1 60 60 GLU CB C 60 27.663 27.663 31.136 -3.473 25294 210 1 1 . 1 1 61 61 ASN N N 61 119.907 119.907 118.774 1.133 25294 211 1 1 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.012 -0.167 25294 212 1 1 . 1 1 61 61 ASN CA C 61 50.752 50.752 52.982 -2.230 25294 213 1 1 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.713 -3.690 25294 214 1 1 . 1 1 62 62 THR N N 62 113.271 113.271 114.916 -1.645 25294 215 1 1 . 1 1 62 62 THR HA H 62 4.308 4.308 4.362 -0.054 25294 216 1 1 . 1 1 62 62 THR CA C 62 59.310 59.310 62.743 -3.433 25294 217 1 1 . 1 1 62 62 THR CB C 62 66.813 66.813 69.235 -2.422 25294 218 1 1 . 1 1 63 63 SER N N 63 116.521 116.521 114.754 1.767 25294 219 1 1 . 1 1 63 63 SER HA H 63 4.650 4.650 4.489 0.161 25294 220 1 1 . 1 1 63 63 SER CA C 63 54.094 54.094 57.619 -3.525 25294 221 1 1 . 1 1 63 63 SER CB C 63 61.617 61.617 64.338 -2.721 25294 222 1 1 . 1 1 64 64 TYR N N 64 120.183 120.183 118.560 1.623 25294 223 1 1 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.883 -0.045 25294 224 1 1 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.775 -2.372 25294 225 1 1 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.451 -2.882 25294 226 1 1 . 1 1 65 65 LYS N N 65 115.195 115.195 116.751 -1.556 25294 227 1 1 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.637 0.084 25294 228 1 1 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.298 -3.592 25294 229 1 1 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.669 -2.849 25294 230 1 1 . 1 1 66 66 GLU N N 66 117.231 117.231 119.000 -1.769 25294 231 1 1 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.225 -0.012 25294 232 1 1 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.057 -2.444 25294 233 1 1 . 1 1 66 66 GLU CB C 66 30.793 30.793 34.056 -3.263 25294 234 1 1 . 1 1 67 67 PHE N N 67 121.532 121.532 119.281 2.251 25294 235 1 1 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.860 -0.430 25294 236 1 1 . 1 1 67 67 PHE CA C 67 56.269 56.269 56.675 -0.406 25294 237 1 1 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.955 -2.680 25294 238 1 1 . 1 1 68 68 ASP N N 68 128.157 128.157 123.560 4.597 25294 239 1 1 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.701 -0.273 25294 240 1 1 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.656 -3.100 25294 241 1 1 . 1 1 68 68 ASP CB C 68 38.424 38.424 42.147 -3.723 25294 242 1 1 . 1 1 69 69 GLY N N 69 114.151 114.151 107.914 6.237 25294 243 1 1 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.494 -3.595 25294 244 1 1 . 1 1 70 70 GLY N N 70 113.714 113.714 109.729 3.985 25294 245 1 1 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.391 -1.397 25294 246 1 1 . 1 1 71 71 TRP N N 71 117.823 117.823 120.525 -2.702 25294 247 1 1 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.784 0.024 25294 248 1 1 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.252 -3.475 25294 249 1 1 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.296 -4.651 25294 250 1 1 . 1 1 72 72 TYR N N 72 114.204 114.204 119.671 -5.467 25294 251 1 1 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.402 0.723 25294 252 1 1 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.679 -5.245 25294 253 1 1 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.938 -2.318 25294 254 1 1 . 1 1 73 73 LEU N N 73 121.469 121.469 124.452 -2.983 25294 255 1 1 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.754 0.013 25294 256 1 1 . 1 1 73 73 LEU CA C 73 51.332 51.332 54.106 -2.774 25294 257 1 1 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.212 -2.809 25294 258 1 1 . 1 1 74 74 VAL N N 74 124.558 124.558 122.534 2.024 25294 259 1 1 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.948 -0.165 25294 260 1 1 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.269 -2.457 25294 261 1 1 . 1 1 74 74 VAL CB C 74 31.820 31.820 35.166 -3.346 25294 262 1 1 . 1 1 75 75 LYS N N 75 125.824 125.824 125.423 0.401 25294 263 1 1 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.102 0.008 25294 264 1 1 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.799 -2.995 25294 265 1 1 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.862 -2.287 25294 266 1 1 . 1 1 76 76 ILE N N 76 124.647 124.647 125.464 -0.817 25294 267 1 1 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.675 0.403 25294 268 1 1 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.597 -3.230 25294 269 1 1 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.342 -1.748 25294 270 1 1 . 1 1 77 77 GLU N N 77 128.081 128.081 128.666 -0.585 25294 271 1 1 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.548 -0.104 25294 272 1 1 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.342 -2.871 25294 273 1 1 . 1 1 77 77 GLU CB C 77 29.914 29.914 30.014 -0.100 25294 274 1 1 . 1 1 78 78 ASP N N 78 126.158 126.158 123.391 2.767 25294 275 1 1 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.175 -0.075 25294 276 1 1 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.865 -3.802 25294 277 1 1 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.114 -3.376 25294 278 1 1 . 1 1 79 79 ASN N N 79 118.653 118.653 117.758 0.895 25294 279 1 1 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.035 -0.389 25294 280 1 1 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.330 -2.121 25294 281 1 1 . 1 1 79 79 ASN CB C 79 35.350 35.350 41.219 -5.869 25294 282 1 1 . 1 1 80 80 GLU N N 80 120.378 120.378 122.484 -2.106 25294 283 1 1 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.106 0.403 25294 284 1 1 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.536 -2.676 25294 285 1 1 . 1 1 80 80 GLU CB C 80 29.673 29.673 31.130 -1.456 25294 286 1 1 . 1 1 81 81 LEU N N 81 125.771 125.771 128.295 -2.524 25294 287 1 1 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.463 -0.497 25294 288 1 1 . 1 1 81 81 LEU CA C 81 51.014 51.014 53.893 -2.879 25294 289 1 1 . 1 1 81 81 LEU CB C 81 42.550 42.550 44.443 -1.893 25294 290 1 1 . 1 1 82 82 LYS N N 82 128.076 128.076 125.768 2.308 25294 291 1 1 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.571 -0.326 25294 292 1 1 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.467 -2.135 25294 293 1 1 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.092 -3.913 25294 294 1 1 . 1 1 83 83 VAL N N 83 124.216 124.216 117.532 6.684 25294 295 1 1 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.074 -0.166 25294 296 1 1 . 1 1 83 83 VAL CA C 83 58.380 58.380 59.274 -0.894 25294 297 1 1 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.100 -2.932 25294 298 1 1 . 1 1 84 84 ILE N N 84 129.084 129.084 124.195 4.889 25294 299 1 1 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.659 -0.129 25294 300 1 1 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.427 -2.021 25294 301 1 1 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.308 -2.142 25294 302 1 1 . 1 1 85 85 ILE N N 85 127.360 127.360 126.917 0.443 25294 303 1 1 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.576 0.009 25294 304 1 1 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.701 -1.241 25294 305 1 1 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.015 -1.517 25294 306 1 1 . 1 1 86 86 ASN N N 86 128.337 128.337 125.813 2.524 25294 307 1 1 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.750 0.016 25294 308 1 1 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.889 -3.707 25294 309 1 1 . 1 1 86 86 ASN CB C 86 36.891 36.891 39.838 -2.947 25294 310 1 1 . 1 1 87 87 ARG N N 87 119.368 119.368 120.623 -1.255 25294 311 1 1 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.150 -0.159 25294 312 1 1 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.352 -2.154 25294 313 1 1 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.756 -2.353 25294 314 1 1 . 1 1 88 88 ASN N N 88 125.082 125.082 123.101 1.981 25294 315 1 1 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.455 0.270 25294 316 1 1 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.319 -4.216 25294 317 1 1 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.291 -3.534 25294 318 1 1 . 1 1 89 89 GLU N N 89 125.309 125.309 123.007 2.302 25294 319 1 1 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.381 -0.023 25294 320 1 1 . 1 1 89 89 GLU CA C 89 53.013 53.013 55.791 -2.778 25294 321 1 1 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.503 -2.419 25294 322 1 1 . 1 1 90 90 THR N N 90 112.516 112.516 114.460 -1.944 25294 323 1 1 . 1 1 90 90 THR HA H 90 4.534 4.534 4.441 0.093 25294 324 1 1 . 1 1 90 90 THR CA C 90 58.161 58.161 60.355 -2.194 25294 325 1 1 . 1 1 90 90 THR CB C 90 68.409 68.409 70.936 -2.527 25294 326 1 1 . 1 1 91 91 ASN N N 91 116.717 116.717 120.878 -4.161 25294 327 1 1 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.677 0.030 25294 328 1 1 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.603 -3.807 25294 329 1 1 . 1 1 91 91 ASN CB C 91 35.474 35.474 37.410 -1.936 25294 330 1 1 . 1 1 92 92 ALA N N 92 122.025 122.025 121.741 0.284 25294 331 1 1 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.556 0.080 25294 332 1 1 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.988 -2.939 25294 333 1 1 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.985 -1.268 25294 334 1 1 . 1 1 93 93 SER N N 93 115.895 115.895 118.160 -2.265 25294 335 1 1 . 1 1 93 93 SER HA H 93 4.536 4.536 4.347 0.189 25294 336 1 1 . 1 1 93 93 SER CA C 93 54.865 54.865 59.169 -4.304 25294 337 1 1 . 1 1 93 93 SER CB C 93 61.292 61.292 63.570 -2.278 25294 338 1 1 . 1 1 94 94 ARG N N 94 119.529 119.529 120.529 -1.000 25294 339 1 1 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.750 0.164 25294 340 1 1 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.726 -2.630 25294 341 1 1 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.531 -4.019 25294 342 1 1 . 1 1 95 95 SER N N 95 114.542 114.542 114.118 0.424 25294 343 1 1 . 1 1 95 95 SER HA H 95 5.926 5.926 5.044 0.882 25294 344 1 1 . 1 1 95 95 SER CA C 95 54.219 54.219 57.857 -3.638 25294 345 1 1 . 1 1 95 95 SER CB C 95 65.271 65.271 66.330 -1.059 25294 346 1 1 . 1 1 96 96 PHE N N 96 117.183 117.183 119.088 -1.905 25294 347 1 1 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.248 0.090 25294 348 1 1 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.513 -2.033 25294 349 1 1 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.786 -4.918 25294 350 1 1 . 1 1 97 97 THR N N 97 115.263 115.263 116.191 -0.928 25294 351 1 1 . 1 1 97 97 THR HA H 97 5.250 5.250 5.264 -0.014 25294 352 1 1 . 1 1 97 97 THR CA C 97 58.178 58.178 61.574 -3.396 25294 353 1 1 . 1 1 97 97 THR CB C 97 69.068 69.068 71.950 -2.882 25294 354 1 1 . 1 1 98 98 VAL N N 98 125.442 125.442 124.060 1.382 25294 355 1 1 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.636 0.221 25294 356 1 1 . 1 1 98 98 VAL CA C 98 57.409 57.409 61.471 -4.062 25294 357 1 1 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.299 -1.370 25294 358 1 1 . 1 1 99 99 CYS N N 99 127.111 127.111 127.444 -0.333 25294 359 1 1 . 1 1 99 99 CYS HA H 99 5.346 5.346 4.679 0.667 25294 360 1 1 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.881 -2.930 25294 361 1 1 . 1 1 99 99 CYS CB C 99 25.942 25.942 29.820 -3.878 25294 362 1 1 . 1 1 100 100 VAL N N 100 120.146 120.146 122.084 -1.938 25294 363 1 1 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.023 0.360 25294 364 1 1 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.636 -3.923 25294 365 1 1 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.947 -2.304 25294 366 1 1 . 1 1 101 101 GLU N N 101 118.807 118.807 124.710 -5.903 25294 367 1 1 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.851 -0.099 25294 368 1 1 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.917 -2.482 25294 369 1 1 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.202 -1.481 25294 370 1 1 . 1 1 102 102 ALA N N 102 124.088 124.088 127.562 -3.474 25294 371 1 1 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.758 -0.901 25294 372 1 1 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.011 -2.133 25294 373 1 1 . 1 1 102 102 ALA CB C 102 18.025 18.025 18.242 -0.217 25294 374 1 1 . 1 1 103 103 GLY N N 103 111.186 111.186 109.763 1.423 25294 375 1 1 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.776 -2.133 25294 376 1 1 . 1 1 104 104 ASN N N 104 123.092 123.092 121.505 1.587 25294 377 1 1 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.728 -0.056 25294 378 1 1 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.595 -2.899 25294 379 1 1 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.786 -3.379 25294 380 1 1 . 1 1 105 105 ALA N N 105 122.653 122.653 118.643 4.010 25294 381 1 1 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.252 0.179 25294 382 1 1 . 1 1 105 105 ALA CA C 105 48.668 48.668 50.914 -2.246 25294 383 1 1 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.980 -2.044 25294 384 1 1 . 1 1 106 106 PHE N N 106 116.011 116.011 115.426 0.585 25294 385 1 1 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.300 0.117 25294 386 1 1 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.419 -2.861 25294 387 1 1 . 1 1 106 106 PHE CB C 106 40.484 40.484 41.601 -1.117 25294 388 1 1 . 1 1 107 107 ASP N N 107 121.992 121.992 124.904 -2.912 25294 389 1 1 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.717 -0.123 25294 390 1 1 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.102 -2.578 25294 391 1 1 . 1 1 107 107 ASP CB C 107 43.091 43.091 41.786 1.305 25294 392 1 1 . 1 1 108 108 GLU N N 108 119.354 119.354 125.051 -5.697 25294 393 1 1 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.288 0.721 25294 394 1 1 . 1 1 108 108 GLU CA C 108 51.988 51.988 56.410 -4.422 25294 395 1 1 . 1 1 108 108 GLU CB C 108 31.317 31.317 30.571 0.746 25294 396 1 1 . 1 1 109 109 PHE N N 109 122.098 122.098 124.449 -2.351 25294 397 1 1 . 1 1 109 109 PHE HA H 109 4.958 4.958 5.091 -0.133 25294 398 1 1 . 1 1 109 109 PHE CA C 109 52.787 52.787 54.508 -1.721 25294 399 1 1 . 1 1 109 109 PHE CB C 109 40.443 40.443 41.082 -0.639 25294 400 1 1 . 1 1 110 110 LYS N N 110 124.500 124.500 124.452 0.048 25294 401 1 1 . 1 1 110 110 LYS HA H 110 4.692 4.692 5.051 -0.359 25294 402 1 1 . 1 1 110 110 LYS CA C 110 51.891 51.891 54.950 -3.059 25294 403 1 1 . 1 1 110 110 LYS CB C 110 33.012 33.012 34.315 -1.302 25294 404 1 1 . 1 1 111 111 PHE N N 111 125.010 125.010 125.443 -0.433 25294 405 1 1 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.295 -0.541 25294 406 1 1 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.559 0.625 25294 407 1 1 . 1 1 111 111 PHE CB C 111 38.380 38.380 41.243 -2.863 25294 408 1 1 . 1 1 112 112 VAL N N 112 122.957 122.957 122.276 0.681 25294 409 1 1 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.490 -0.050 25294 410 1 1 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.468 -3.212 25294 411 1 1 . 1 1 112 112 VAL CB C 112 31.093 31.093 33.091 -1.998 25294 412 1 1 . 1 1 113 113 GLN N N 113 130.864 130.864 126.760 4.104 25294 413 1 1 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.854 0.465 25294 414 1 1 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.837 -3.718 25294 415 1 1 . 1 1 113 113 GLN CB C 113 28.164 28.164 31.389 -3.225 25294 416 1 1 . 1 1 114 114 ASP N N 114 126.272 126.272 123.636 2.636 25294 417 1 1 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.923 -0.596 25294 418 1 1 . 1 1 114 114 ASP CA C 114 51.773 51.773 53.216 -1.443 25294 419 1 1 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.828 -3.973 25294 420 1 1 . 1 1 115 115 ALA N N 115 120.134 120.134 122.087 -1.953 25294 421 1 1 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.500 -0.801 25294 422 1 1 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.987 -3.086 25294 423 1 1 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.700 -1.949 25294 424 1 1 . 1 1 116 116 ALA N N 116 121.377 121.377 124.167 -2.790 25294 425 1 1 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.244 -0.291 25294 426 1 1 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.157 -2.169 25294 427 1 1 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.703 -3.503 25294 428 1 1 . 1 1 117 117 LYS N N 117 121.536 121.536 121.645 -0.109 25294 429 1 1 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.468 -0.329 25294 430 1 1 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.550 -1.903 25294 431 1 1 . 1 1 117 117 LYS CB C 117 30.579 30.579 32.201 -1.622 25294 432 1 2 . 1 1 5 5 SER N N 5 116.267 116.267 119.638 -3.371 25294 433 1 2 . 1 1 5 5 SER HA H 5 4.349 4.349 4.695 -0.346 25294 434 1 2 . 1 1 5 5 SER CA C 5 55.478 55.478 57.349 -1.871 25294 435 1 2 . 1 1 5 5 SER CB C 5 61.191 61.191 64.750 -3.559 25294 436 1 2 . 1 1 6 6 ASP N N 6 123.039 123.039 121.655 1.384 25294 437 1 2 . 1 1 6 6 ASP HA H 6 4.827 4.827 5.014 -0.187 25294 438 1 2 . 1 1 6 6 ASP CA C 6 49.671 49.671 51.686 -2.015 25294 439 1 2 . 1 1 6 6 ASP CB C 6 38.656 38.656 39.943 -1.287 25294 440 1 2 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.310 0.007 25294 441 1 2 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.417 -3.270 25294 442 1 2 . 1 1 7 7 PRO CB C 7 29.478 29.478 31.893 -2.415 25294 443 1 2 . 1 1 8 8 ASP N N 8 119.159 119.159 117.725 1.434 25294 444 1 2 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.678 -0.113 25294 445 1 2 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.296 -2.436 25294 446 1 2 . 1 1 8 8 ASP CB C 8 38.725 38.725 39.879 -1.154 25294 447 1 2 . 1 1 9 9 GLY N N 9 108.837 108.837 107.944 0.893 25294 448 1 2 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.142 -2.006 25294 449 1 2 . 1 1 10 10 LEU N N 10 121.571 121.571 118.096 3.475 25294 450 1 2 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.686 -0.419 25294 451 1 2 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.786 -1.395 25294 452 1 2 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.645 -2.782 25294 453 1 2 . 1 1 11 11 ALA N N 11 125.169 125.169 123.227 1.942 25294 454 1 2 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.532 -0.196 25294 455 1 2 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.177 -2.193 25294 456 1 2 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.306 -2.124 25294 457 1 2 . 1 1 12 12 ASP N N 12 122.672 122.672 125.570 -2.898 25294 458 1 2 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.863 -0.127 25294 459 1 2 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.309 -2.607 25294 460 1 2 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.636 -3.805 25294 461 1 2 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.513 -0.209 25294 462 1 2 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.599 -2.999 25294 463 1 2 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.679 -3.163 25294 464 1 2 . 1 1 14 14 MET N N 14 120.151 120.151 117.342 2.809 25294 465 1 2 . 1 1 14 14 MET HA H 14 3.780 3.780 4.592 -0.812 25294 466 1 2 . 1 1 14 14 MET CA C 14 55.822 55.822 56.065 -0.243 25294 467 1 2 . 1 1 14 14 MET CB C 14 30.909 30.909 33.620 -2.711 25294 468 1 2 . 1 1 15 15 LYS N N 15 123.897 123.897 121.317 2.580 25294 469 1 2 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.683 -0.226 25294 470 1 2 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.355 -3.948 25294 471 1 2 . 1 1 15 15 LYS CB C 15 32.453 32.453 36.226 -3.773 25294 472 1 2 . 1 1 16 16 TRP N N 16 125.776 125.776 124.908 0.868 25294 473 1 2 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.432 -0.357 25294 474 1 2 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.597 -2.945 25294 475 1 2 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.775 -2.775 25294 476 1 2 . 1 1 17 17 SER N N 17 120.772 120.772 119.569 1.203 25294 477 1 2 . 1 1 17 17 SER HA H 17 4.403 4.403 4.407 -0.004 25294 478 1 2 . 1 1 17 17 SER CA C 17 56.167 56.167 60.326 -4.159 25294 479 1 2 . 1 1 17 17 SER CB C 17 60.833 60.833 63.438 -2.605 25294 480 1 2 . 1 1 18 18 LYS N N 18 121.096 121.096 120.511 0.585 25294 481 1 2 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.530 0.188 25294 482 1 2 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.485 -1.750 25294 483 1 2 . 1 1 18 18 LYS CB C 18 32.917 32.917 34.907 -1.990 25294 484 1 2 . 1 1 19 19 VAL N N 19 116.358 116.358 118.933 -2.575 25294 485 1 2 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.510 -0.087 25294 486 1 2 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.029 -2.799 25294 487 1 2 . 1 1 19 19 VAL CB C 19 31.026 31.026 33.257 -2.231 25294 488 1 2 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.393 -0.090 25294 489 1 2 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.429 -2.659 25294 490 1 2 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.496 -2.943 25294 491 1 2 . 1 1 21 21 SER N N 21 118.882 118.882 114.856 4.026 25294 492 1 2 . 1 1 21 21 SER HA H 21 4.084 4.084 4.418 -0.334 25294 493 1 2 . 1 1 21 21 SER CA C 21 57.657 57.657 58.779 -1.122 25294 494 1 2 . 1 1 21 21 SER CB C 21 60.173 60.173 63.387 -3.214 25294 495 1 2 . 1 1 22 22 GLY N N 22 109.523 109.523 111.279 -1.756 25294 496 1 2 . 1 1 22 22 GLY CA C 22 42.404 42.404 45.673 -3.269 25294 497 1 2 . 1 1 23 23 LEU N N 23 123.003 123.003 122.543 0.460 25294 498 1 2 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.291 -0.257 25294 499 1 2 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.266 -1.663 25294 500 1 2 . 1 1 23 23 LEU CB C 23 40.071 40.071 41.739 -1.668 25294 501 1 2 . 1 1 24 24 LYS N N 24 129.004 129.004 128.126 0.878 25294 502 1 2 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.475 0.035 25294 503 1 2 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.713 -2.476 25294 504 1 2 . 1 1 24 24 LYS CB C 24 32.161 32.161 34.260 -2.099 25294 505 1 2 . 1 1 25 25 ASN N N 25 126.336 126.336 126.143 0.193 25294 506 1 2 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.446 -0.122 25294 507 1 2 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.801 -2.181 25294 508 1 2 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.967 -2.982 25294 509 1 2 . 1 1 26 26 GLY N N 26 103.076 103.076 104.539 -1.463 25294 510 1 2 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.197 -1.649 25294 511 1 2 . 1 1 27 27 GLU N N 27 120.878 120.878 121.018 -0.140 25294 512 1 2 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.189 0.013 25294 513 1 2 . 1 1 27 27 GLU CA C 27 51.233 51.233 54.920 -3.687 25294 514 1 2 . 1 1 27 27 GLU CB C 27 30.761 30.761 32.343 -1.582 25294 515 1 2 . 1 1 28 28 LEU N N 28 128.583 128.583 125.276 3.307 25294 516 1 2 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.677 -0.122 25294 517 1 2 . 1 1 28 28 LEU CA C 28 50.324 50.324 54.032 -3.708 25294 518 1 2 . 1 1 28 28 LEU CB C 28 43.517 43.517 43.955 -0.438 25294 519 1 2 . 1 1 29 29 LYS N N 29 127.554 127.554 124.372 3.182 25294 520 1 2 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.547 0.354 25294 521 1 2 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.086 -3.247 25294 522 1 2 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.965 -3.442 25294 523 1 2 . 1 1 30 30 VAL N N 30 127.915 127.915 122.168 5.747 25294 524 1 2 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.509 -0.325 25294 525 1 2 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.931 -2.623 25294 526 1 2 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.073 -3.803 25294 527 1 2 . 1 1 31 31 GLU N N 31 125.151 125.151 124.369 0.782 25294 528 1 2 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.637 -0.276 25294 529 1 2 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.002 -0.902 25294 530 1 2 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.242 -3.539 25294 531 1 2 . 1 1 32 32 ALA N N 32 126.271 126.271 120.751 5.520 25294 532 1 2 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.290 -0.274 25294 533 1 2 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.137 -1.010 25294 534 1 2 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.438 -3.171 25294 535 1 2 . 1 1 33 33 GLU N N 33 113.076 113.076 115.984 -2.908 25294 536 1 2 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.389 -0.424 25294 537 1 2 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.603 -0.619 25294 538 1 2 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.146 -3.217 25294 539 1 2 . 1 1 34 34 GLY N N 34 104.905 104.905 108.444 -3.539 25294 540 1 2 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.200 -4.493 25294 541 1 2 . 1 1 35 35 GLY N N 35 105.946 105.946 107.193 -1.247 25294 542 1 2 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.553 -1.565 25294 543 1 2 . 1 1 36 36 SER N N 36 116.044 116.044 115.733 0.311 25294 544 1 2 . 1 1 36 36 SER HA H 36 5.539 5.539 5.310 0.229 25294 545 1 2 . 1 1 36 36 SER CA C 36 54.323 54.323 57.244 -2.921 25294 546 1 2 . 1 1 36 36 SER CB C 36 62.808 62.808 64.936 -2.128 25294 547 1 2 . 1 1 37 37 SER N N 37 119.501 119.501 121.115 -1.614 25294 548 1 2 . 1 1 37 37 SER HA H 37 4.712 4.712 4.762 -0.050 25294 549 1 2 . 1 1 37 37 SER CA C 37 55.548 55.548 57.766 -2.218 25294 550 1 2 . 1 1 37 37 SER CB C 37 63.943 63.943 66.041 -2.098 25294 551 1 2 . 1 1 38 38 LEU N N 38 125.962 125.962 123.549 2.413 25294 552 1 2 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.137 0.116 25294 553 1 2 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.442 -2.660 25294 554 1 2 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.733 -2.899 25294 555 1 2 . 1 1 39 39 PHE N N 39 124.707 124.707 123.719 0.988 25294 556 1 2 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.114 0.025 25294 557 1 2 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.025 -3.894 25294 558 1 2 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.557 -1.605 25294 559 1 2 . 1 1 40 40 ALA N N 40 124.994 124.994 127.717 -2.723 25294 560 1 2 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.045 0.590 25294 561 1 2 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.469 -2.168 25294 562 1 2 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.018 0.428 25294 563 1 2 . 1 1 41 41 CYS N N 41 125.757 125.757 123.736 2.021 25294 564 1 2 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.179 -0.033 25294 565 1 2 . 1 1 41 41 CYS CA C 41 56.465 56.465 60.238 -3.773 25294 566 1 2 . 1 1 41 41 CYS CB C 41 25.973 25.973 28.259 -2.286 25294 567 1 2 . 1 1 42 42 LYS N N 42 129.019 129.019 126.693 2.326 25294 568 1 2 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.456 -0.196 25294 569 1 2 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.219 -2.368 25294 570 1 2 . 1 1 42 42 LYS CB C 42 32.107 32.107 33.329 -1.222 25294 571 1 2 . 1 1 43 43 ASN N N 43 113.240 113.240 114.675 -1.435 25294 572 1 2 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.692 -0.167 25294 573 1 2 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.132 -2.897 25294 574 1 2 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.602 -4.740 25294 575 1 2 . 1 1 44 44 TYR N N 44 119.335 119.335 118.939 0.396 25294 576 1 2 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.649 -0.092 25294 577 1 2 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.792 -2.074 25294 578 1 2 . 1 1 44 44 TYR CB C 44 37.372 37.372 42.074 -4.702 25294 579 1 2 . 1 1 45 45 LYS N N 45 120.676 120.676 120.754 -0.078 25294 580 1 2 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.747 -0.711 25294 581 1 2 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.420 -1.882 25294 582 1 2 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.874 -3.641 25294 583 1 2 . 1 1 46 46 SER N N 46 108.797 108.797 115.470 -6.673 25294 584 1 2 . 1 1 46 46 SER HA H 46 4.388 4.388 4.807 -0.419 25294 585 1 2 . 1 1 46 46 SER CA C 46 53.664 53.664 57.376 -3.712 25294 586 1 2 . 1 1 46 46 SER CB C 46 61.810 61.810 63.585 -1.775 25294 587 1 2 . 1 1 47 47 PHE N N 47 117.325 117.325 119.767 -2.442 25294 588 1 2 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.216 -0.574 25294 589 1 2 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.815 -3.198 25294 590 1 2 . 1 1 47 47 PHE CB C 47 37.101 37.101 41.833 -4.732 25294 591 1 2 . 1 1 48 48 TRP N N 48 117.090 117.090 115.860 1.230 25294 592 1 2 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.280 -0.045 25294 593 1 2 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.810 -2.318 25294 594 1 2 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.580 -1.685 25294 595 1 2 . 1 1 49 49 ILE N N 49 119.682 119.682 119.841 -0.159 25294 596 1 2 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.449 -0.418 25294 597 1 2 . 1 1 49 49 ILE CA C 49 60.473 60.473 60.840 -0.367 25294 598 1 2 . 1 1 49 49 ILE CB C 49 36.436 36.436 37.348 -0.912 25294 599 1 2 . 1 1 50 50 SER N N 50 124.071 124.071 121.590 2.481 25294 600 1 2 . 1 1 50 50 SER HA H 50 4.708 4.708 4.800 -0.092 25294 601 1 2 . 1 1 50 50 SER CA C 50 56.110 56.110 57.980 -1.869 25294 602 1 2 . 1 1 50 50 SER CB C 50 63.816 63.816 64.860 -1.044 25294 603 1 2 . 1 1 51 51 SER N N 51 111.253 111.253 115.821 -4.568 25294 604 1 2 . 1 1 51 51 SER HA H 51 4.557 4.557 4.735 -0.178 25294 605 1 2 . 1 1 51 51 SER CA C 51 55.564 55.564 58.072 -2.508 25294 606 1 2 . 1 1 51 51 SER CB C 51 62.821 62.821 66.591 -3.770 25294 607 1 2 . 1 1 52 52 VAL N N 52 121.147 121.147 123.289 -2.142 25294 608 1 2 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.482 0.249 25294 609 1 2 . 1 1 52 52 VAL CA C 52 59.126 59.126 61.161 -2.035 25294 610 1 2 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.034 -2.534 25294 611 1 2 . 1 1 53 53 LYS N N 53 126.128 126.128 127.370 -1.242 25294 612 1 2 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.739 0.268 25294 613 1 2 . 1 1 53 53 LYS CA C 53 51.723 51.723 56.039 -4.316 25294 614 1 2 . 1 1 53 53 LYS CB C 53 33.772 33.772 34.178 -0.406 25294 615 1 2 . 1 1 54 54 GLU N N 54 124.160 124.160 125.043 -0.883 25294 616 1 2 . 1 1 54 54 GLU HA H 54 4.758 4.758 4.988 -0.230 25294 617 1 2 . 1 1 54 54 GLU CA C 54 53.259 53.259 57.031 -3.772 25294 618 1 2 . 1 1 54 54 GLU CB C 54 31.059 31.059 32.637 -1.578 25294 619 1 2 . 1 1 55 55 GLU N N 55 127.218 127.218 118.302 8.916 25294 620 1 2 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.549 -0.641 25294 621 1 2 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.735 -2.189 25294 622 1 2 . 1 1 55 55 GLU CB C 55 25.294 25.294 31.122 -5.828 25294 623 1 2 . 1 1 56 56 GLY N N 56 104.894 104.894 107.887 -2.993 25294 624 1 2 . 1 1 56 56 GLY CA C 56 42.881 42.881 45.779 -2.898 25294 625 1 2 . 1 1 57 57 LYS N N 57 120.444 120.444 117.561 2.883 25294 626 1 2 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.747 -0.183 25294 627 1 2 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.286 -2.327 25294 628 1 2 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.191 -3.003 25294 629 1 2 . 1 1 58 58 PHE N N 58 121.824 121.824 119.984 1.840 25294 630 1 2 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.226 -0.455 25294 631 1 2 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.158 0.007 25294 632 1 2 . 1 1 58 58 PHE CB C 58 36.902 36.902 39.974 -3.072 25294 633 1 2 . 1 1 59 59 LYS N N 59 123.205 123.205 122.636 0.569 25294 634 1 2 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.863 -0.412 25294 635 1 2 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.117 -4.132 25294 636 1 2 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.202 -4.411 25294 637 1 2 . 1 1 60 60 GLU N N 60 122.647 122.647 118.283 4.364 25294 638 1 2 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.596 -0.336 25294 639 1 2 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.341 -1.435 25294 640 1 2 . 1 1 60 60 GLU CB C 60 27.663 27.663 31.754 -4.091 25294 641 1 2 . 1 1 61 61 ASN N N 61 119.907 119.907 117.945 1.962 25294 642 1 2 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.855 -0.010 25294 643 1 2 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.129 -2.377 25294 644 1 2 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.372 -4.349 25294 645 1 2 . 1 1 62 62 THR N N 62 113.271 113.271 113.777 -0.506 25294 646 1 2 . 1 1 62 62 THR HA H 62 4.308 4.308 4.393 -0.085 25294 647 1 2 . 1 1 62 62 THR CA C 62 59.310 59.310 62.029 -2.720 25294 648 1 2 . 1 1 62 62 THR CB C 62 66.813 66.813 68.674 -1.861 25294 649 1 2 . 1 1 63 63 SER N N 63 116.521 116.521 114.320 2.201 25294 650 1 2 . 1 1 63 63 SER HA H 63 4.650 4.650 4.450 0.200 25294 651 1 2 . 1 1 63 63 SER CA C 63 54.094 54.094 57.531 -3.437 25294 652 1 2 . 1 1 63 63 SER CB C 63 61.617 61.617 64.552 -2.935 25294 653 1 2 . 1 1 64 64 TYR N N 64 120.183 120.183 117.946 2.237 25294 654 1 2 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.885 -0.047 25294 655 1 2 . 1 1 64 64 TYR CA C 64 56.403 56.403 57.646 -1.243 25294 656 1 2 . 1 1 64 64 TYR CB C 64 36.569 36.569 38.682 -2.113 25294 657 1 2 . 1 1 65 65 LYS N N 65 115.195 115.195 114.598 0.597 25294 658 1 2 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.643 0.078 25294 659 1 2 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.605 -3.899 25294 660 1 2 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.593 -2.773 25294 661 1 2 . 1 1 66 66 GLU N N 66 117.231 117.231 119.419 -2.188 25294 662 1 2 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.157 0.056 25294 663 1 2 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.104 -2.491 25294 664 1 2 . 1 1 66 66 GLU CB C 66 30.793 30.793 34.272 -3.479 25294 665 1 2 . 1 1 67 67 PHE N N 67 121.532 121.532 119.981 1.551 25294 666 1 2 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.664 -0.234 25294 667 1 2 . 1 1 67 67 PHE CA C 67 56.269 56.269 56.484 -0.215 25294 668 1 2 . 1 1 67 67 PHE CB C 67 40.275 40.275 43.036 -2.761 25294 669 1 2 . 1 1 68 68 ASP N N 68 128.157 128.157 125.054 3.103 25294 670 1 2 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.638 -0.210 25294 671 1 2 . 1 1 68 68 ASP CA C 68 49.556 49.556 51.771 -2.215 25294 672 1 2 . 1 1 68 68 ASP CB C 68 38.424 38.424 39.950 -1.526 25294 673 1 2 . 1 1 69 69 GLY N N 69 114.151 114.151 108.021 6.130 25294 674 1 2 . 1 1 69 69 GLY CA C 69 40.899 40.899 43.883 -2.984 25294 675 1 2 . 1 1 70 70 GLY N N 70 113.714 113.714 110.177 3.537 25294 676 1 2 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.388 -1.393 25294 677 1 2 . 1 1 71 71 TRP N N 71 117.823 117.823 121.078 -3.255 25294 678 1 2 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.552 0.256 25294 679 1 2 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.151 -3.374 25294 680 1 2 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.775 -4.130 25294 681 1 2 . 1 1 72 72 TYR N N 72 114.204 114.204 120.077 -5.873 25294 682 1 2 . 1 1 72 72 TYR HA H 72 5.125 5.125 5.044 0.081 25294 683 1 2 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.317 -4.882 25294 684 1 2 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.702 -2.082 25294 685 1 2 . 1 1 73 73 LEU N N 73 121.469 121.469 126.228 -4.759 25294 686 1 2 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.641 0.126 25294 687 1 2 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.562 -2.230 25294 688 1 2 . 1 1 73 73 LEU CB C 73 43.403 43.403 45.777 -2.374 25294 689 1 2 . 1 1 74 74 VAL N N 74 124.558 124.558 125.642 -1.084 25294 690 1 2 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.070 0.713 25294 691 1 2 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.794 -3.982 25294 692 1 2 . 1 1 74 74 VAL CB C 74 31.820 31.820 32.999 -1.179 25294 693 1 2 . 1 1 75 75 LYS N N 75 125.824 125.824 127.136 -1.312 25294 694 1 2 . 1 1 75 75 LYS HA H 75 5.110 5.110 4.891 0.219 25294 695 1 2 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.129 -2.325 25294 696 1 2 . 1 1 75 75 LYS CB C 75 34.575 34.575 35.429 -0.854 25294 697 1 2 . 1 1 76 76 ILE N N 76 124.647 124.647 126.714 -2.067 25294 698 1 2 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.148 0.930 25294 699 1 2 . 1 1 76 76 ILE CA C 76 57.367 57.367 61.898 -4.531 25294 700 1 2 . 1 1 76 76 ILE CB C 76 37.593 37.593 37.654 -0.061 25294 701 1 2 . 1 1 77 77 GLU N N 77 128.081 128.081 127.716 0.365 25294 702 1 2 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.561 -0.117 25294 703 1 2 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.361 -2.890 25294 704 1 2 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.597 -1.683 25294 705 1 2 . 1 1 78 78 ASP N N 78 126.158 126.158 123.433 2.725 25294 706 1 2 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.232 -0.132 25294 707 1 2 . 1 1 78 78 ASP CA C 78 54.063 54.063 56.340 -2.276 25294 708 1 2 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.505 -3.767 25294 709 1 2 . 1 1 79 79 ASN N N 79 118.653 118.653 117.235 1.418 25294 710 1 2 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.754 -0.108 25294 711 1 2 . 1 1 79 79 ASN CA C 79 51.209 51.209 54.805 -3.596 25294 712 1 2 . 1 1 79 79 ASN CB C 79 35.350 35.350 38.450 -3.100 25294 713 1 2 . 1 1 80 80 GLU N N 80 120.378 120.378 121.056 -0.678 25294 714 1 2 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.051 0.458 25294 715 1 2 . 1 1 80 80 GLU CA C 80 52.860 52.860 54.847 -1.987 25294 716 1 2 . 1 1 80 80 GLU CB C 80 29.673 29.673 29.586 0.087 25294 717 1 2 . 1 1 81 81 LEU N N 81 125.771 125.771 126.884 -1.113 25294 718 1 2 . 1 1 81 81 LEU HA H 81 4.966 4.966 4.698 0.268 25294 719 1 2 . 1 1 81 81 LEU CA C 81 51.014 51.014 55.691 -4.677 25294 720 1 2 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.175 -0.625 25294 721 1 2 . 1 1 82 82 LYS N N 82 128.076 128.076 126.117 1.959 25294 722 1 2 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.693 -0.448 25294 723 1 2 . 1 1 82 82 LYS CA C 82 52.332 52.332 53.903 -1.571 25294 724 1 2 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.286 -4.107 25294 725 1 2 . 1 1 83 83 VAL N N 83 124.216 124.216 115.217 8.999 25294 726 1 2 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.220 -0.312 25294 727 1 2 . 1 1 83 83 VAL CA C 83 58.380 58.380 59.121 -0.741 25294 728 1 2 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.357 -3.189 25294 729 1 2 . 1 1 84 84 ILE N N 84 129.084 129.084 122.222 6.862 25294 730 1 2 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.749 -0.219 25294 731 1 2 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.770 -1.364 25294 732 1 2 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.931 -3.765 25294 733 1 2 . 1 1 85 85 ILE N N 85 127.360 127.360 124.222 3.138 25294 734 1 2 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.857 -0.272 25294 735 1 2 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.947 -1.487 25294 736 1 2 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.171 -1.673 25294 737 1 2 . 1 1 86 86 ASN N N 86 128.337 128.337 125.485 2.852 25294 738 1 2 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.874 -0.108 25294 739 1 2 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.496 -3.314 25294 740 1 2 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.153 -3.262 25294 741 1 2 . 1 1 87 87 ARG N N 87 119.368 119.368 120.571 -1.203 25294 742 1 2 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.295 -0.304 25294 743 1 2 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.777 -2.579 25294 744 1 2 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.684 -2.281 25294 745 1 2 . 1 1 88 88 ASN N N 88 125.082 125.082 124.177 0.905 25294 746 1 2 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.673 0.052 25294 747 1 2 . 1 1 88 88 ASN CA C 88 49.103 49.103 52.727 -3.624 25294 748 1 2 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.966 -4.209 25294 749 1 2 . 1 1 89 89 GLU N N 89 125.309 125.309 124.082 1.227 25294 750 1 2 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.316 0.042 25294 751 1 2 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.818 -3.804 25294 752 1 2 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.663 -2.579 25294 753 1 2 . 1 1 90 90 THR N N 90 112.516 112.516 109.675 2.841 25294 754 1 2 . 1 1 90 90 THR HA H 90 4.534 4.534 4.406 0.128 25294 755 1 2 . 1 1 90 90 THR CA C 90 58.161 58.161 60.104 -1.943 25294 756 1 2 . 1 1 90 90 THR CB C 90 68.409 68.409 72.544 -4.135 25294 757 1 2 . 1 1 91 91 ASN N N 91 116.717 116.717 120.255 -3.538 25294 758 1 2 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.589 0.118 25294 759 1 2 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.796 -4.000 25294 760 1 2 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.202 -2.728 25294 761 1 2 . 1 1 92 92 ALA N N 92 122.025 122.025 122.916 -0.891 25294 762 1 2 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.585 0.051 25294 763 1 2 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.487 -2.438 25294 764 1 2 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.714 -0.998 25294 765 1 2 . 1 1 93 93 SER N N 93 115.895 115.895 119.060 -3.165 25294 766 1 2 . 1 1 93 93 SER HA H 93 4.536 4.536 4.503 0.033 25294 767 1 2 . 1 1 93 93 SER CA C 93 54.865 54.865 58.722 -3.857 25294 768 1 2 . 1 1 93 93 SER CB C 93 61.292 61.292 63.814 -2.522 25294 769 1 2 . 1 1 94 94 ARG N N 94 119.529 119.529 122.283 -2.754 25294 770 1 2 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.850 0.064 25294 771 1 2 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.082 -1.986 25294 772 1 2 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.201 -3.689 25294 773 1 2 . 1 1 95 95 SER N N 95 114.542 114.542 114.376 0.166 25294 774 1 2 . 1 1 95 95 SER HA H 95 5.926 5.926 4.789 1.137 25294 775 1 2 . 1 1 95 95 SER CA C 95 54.219 54.219 57.484 -3.265 25294 776 1 2 . 1 1 95 95 SER CB C 95 65.271 65.271 65.185 0.086 25294 777 1 2 . 1 1 96 96 PHE N N 96 117.183 117.183 116.989 0.194 25294 778 1 2 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.191 0.147 25294 779 1 2 . 1 1 96 96 PHE CA C 96 54.480 54.480 55.991 -1.511 25294 780 1 2 . 1 1 96 96 PHE CB C 96 38.868 38.868 41.430 -2.562 25294 781 1 2 . 1 1 97 97 THR N N 97 115.263 115.263 116.010 -0.747 25294 782 1 2 . 1 1 97 97 THR HA H 97 5.250 5.250 5.119 0.131 25294 783 1 2 . 1 1 97 97 THR CA C 97 58.178 58.178 61.196 -3.018 25294 784 1 2 . 1 1 97 97 THR CB C 97 69.068 69.068 71.561 -2.493 25294 785 1 2 . 1 1 98 98 VAL N N 98 125.442 125.442 120.350 5.092 25294 786 1 2 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.765 0.092 25294 787 1 2 . 1 1 98 98 VAL CA C 98 57.409 57.409 59.406 -1.997 25294 788 1 2 . 1 1 98 98 VAL CB C 98 32.929 32.929 33.924 -0.995 25294 789 1 2 . 1 1 99 99 CYS N N 99 127.111 127.111 124.558 2.553 25294 790 1 2 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.103 0.243 25294 791 1 2 . 1 1 99 99 CYS CA C 99 53.951 53.951 57.726 -3.775 25294 792 1 2 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.239 -4.297 25294 793 1 2 . 1 1 100 100 VAL N N 100 120.146 120.146 121.735 -1.589 25294 794 1 2 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.134 0.249 25294 795 1 2 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.693 -3.980 25294 796 1 2 . 1 1 100 100 VAL CB C 100 32.643 32.643 33.503 -0.860 25294 797 1 2 . 1 1 101 101 GLU N N 101 118.807 118.807 126.607 -7.800 25294 798 1 2 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.647 0.105 25294 799 1 2 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.654 -3.219 25294 800 1 2 . 1 1 101 101 GLU CB C 101 31.721 31.721 31.274 0.447 25294 801 1 2 . 1 1 102 102 ALA N N 102 124.088 124.088 123.723 0.365 25294 802 1 2 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.908 -1.051 25294 803 1 2 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.964 -3.086 25294 804 1 2 . 1 1 102 102 ALA CB C 102 18.025 18.025 20.667 -2.642 25294 805 1 2 . 1 1 103 103 GLY N N 103 111.186 111.186 108.008 3.178 25294 806 1 2 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.820 -1.177 25294 807 1 2 . 1 1 104 104 ASN N N 104 123.092 123.092 120.172 2.920 25294 808 1 2 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.821 -0.149 25294 809 1 2 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.329 -2.633 25294 810 1 2 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.269 -2.862 25294 811 1 2 . 1 1 105 105 ALA N N 105 122.653 122.653 120.207 2.446 25294 812 1 2 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.587 -0.156 25294 813 1 2 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.233 -2.565 25294 814 1 2 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.012 -2.076 25294 815 1 2 . 1 1 106 106 PHE N N 106 116.011 116.011 114.658 1.353 25294 816 1 2 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.295 0.122 25294 817 1 2 . 1 1 106 106 PHE CA C 106 53.558 53.558 55.248 -1.690 25294 818 1 2 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.157 -1.673 25294 819 1 2 . 1 1 107 107 ASP N N 107 121.992 121.992 119.283 2.709 25294 820 1 2 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.710 -0.116 25294 821 1 2 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.682 -2.158 25294 822 1 2 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.886 -1.795 25294 823 1 2 . 1 1 108 108 GLU N N 108 119.354 119.354 120.894 -1.540 25294 824 1 2 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.689 0.320 25294 825 1 2 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.798 -2.810 25294 826 1 2 . 1 1 108 108 GLU CB C 108 31.317 31.317 33.117 -1.800 25294 827 1 2 . 1 1 109 109 PHE N N 109 122.098 122.098 122.708 -0.610 25294 828 1 2 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.832 0.126 25294 829 1 2 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.111 -3.324 25294 830 1 2 . 1 1 109 109 PHE CB C 109 40.443 40.443 41.688 -1.245 25294 831 1 2 . 1 1 110 110 LYS N N 110 124.500 124.500 124.706 -0.206 25294 832 1 2 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.609 0.083 25294 833 1 2 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.117 -3.227 25294 834 1 2 . 1 1 110 110 LYS CB C 110 33.012 33.012 33.275 -0.263 25294 835 1 2 . 1 1 111 111 PHE N N 111 125.010 125.010 125.558 -0.548 25294 836 1 2 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.182 -0.428 25294 837 1 2 . 1 1 111 111 PHE CA C 111 58.184 58.184 56.717 1.467 25294 838 1 2 . 1 1 111 111 PHE CB C 111 38.380 38.380 41.427 -3.047 25294 839 1 2 . 1 1 112 112 VAL N N 112 122.957 122.957 120.111 2.846 25294 840 1 2 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.632 -0.192 25294 841 1 2 . 1 1 112 112 VAL CA C 112 58.256 58.256 60.964 -2.708 25294 842 1 2 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.648 -4.555 25294 843 1 2 . 1 1 113 113 GLN N N 113 130.864 130.864 128.281 2.583 25294 844 1 2 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.091 0.228 25294 845 1 2 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.548 -2.429 25294 846 1 2 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.546 -4.382 25294 847 1 2 . 1 1 114 114 ASP N N 114 126.272 126.272 125.606 0.666 25294 848 1 2 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.584 -0.257 25294 849 1 2 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.552 -2.779 25294 850 1 2 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.011 -3.156 25294 851 1 2 . 1 1 115 115 ALA N N 115 120.134 120.134 120.797 -0.663 25294 852 1 2 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.499 -0.800 25294 853 1 2 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.157 -3.256 25294 854 1 2 . 1 1 115 115 ALA CB C 115 17.751 17.751 20.016 -2.265 25294 855 1 2 . 1 1 116 116 ALA N N 116 121.377 121.377 123.566 -2.189 25294 856 1 2 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.394 -0.441 25294 857 1 2 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.147 -1.159 25294 858 1 2 . 1 1 116 116 ALA CB C 116 16.200 16.200 18.985 -2.785 25294 859 1 2 . 1 1 117 117 LYS N N 117 121.536 121.536 126.847 -5.311 25294 860 1 2 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.218 -0.079 25294 861 1 2 . 1 1 117 117 LYS CA C 117 53.646 53.646 56.351 -2.705 25294 862 1 2 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.404 -0.825 25294 863 1 3 . 1 1 5 5 SER N N 5 116.267 116.267 113.927 2.340 25294 864 1 3 . 1 1 5 5 SER HA H 5 4.349 4.349 4.600 -0.251 25294 865 1 3 . 1 1 5 5 SER CA C 5 55.478 55.478 57.804 -2.326 25294 866 1 3 . 1 1 5 5 SER CB C 5 61.191 61.191 65.438 -4.247 25294 867 1 3 . 1 1 6 6 ASP N N 6 123.039 123.039 121.699 1.340 25294 868 1 3 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.747 0.080 25294 869 1 3 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.339 -2.668 25294 870 1 3 . 1 1 6 6 ASP CB C 6 38.656 38.656 42.481 -3.825 25294 871 1 3 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.358 -0.041 25294 872 1 3 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.225 -3.078 25294 873 1 3 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.428 -2.950 25294 874 1 3 . 1 1 8 8 ASP N N 8 119.159 119.159 115.622 3.537 25294 875 1 3 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.659 -0.094 25294 876 1 3 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.491 -2.631 25294 877 1 3 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.942 -3.217 25294 878 1 3 . 1 1 9 9 GLY N N 9 108.837 108.837 110.951 -2.114 25294 879 1 3 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.153 -2.017 25294 880 1 3 . 1 1 10 10 LEU N N 10 121.571 121.571 119.689 1.882 25294 881 1 3 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.330 -0.063 25294 882 1 3 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.981 -2.590 25294 883 1 3 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.527 -2.664 25294 884 1 3 . 1 1 11 11 ALA N N 11 125.169 125.169 122.134 3.035 25294 885 1 3 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.556 -0.220 25294 886 1 3 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.310 -2.326 25294 887 1 3 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.994 -2.812 25294 888 1 3 . 1 1 12 12 ASP N N 12 122.672 122.672 125.787 -3.115 25294 889 1 3 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.829 -0.092 25294 890 1 3 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.607 -2.905 25294 891 1 3 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.466 -3.635 25294 892 1 3 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.454 -0.150 25294 893 1 3 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.594 -2.994 25294 894 1 3 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.785 -3.269 25294 895 1 3 . 1 1 14 14 MET N N 14 120.151 120.151 118.860 1.291 25294 896 1 3 . 1 1 14 14 MET HA H 14 3.780 3.780 4.519 -0.739 25294 897 1 3 . 1 1 14 14 MET CA C 14 55.822 55.822 56.021 -0.199 25294 898 1 3 . 1 1 14 14 MET CB C 14 30.909 30.909 32.471 -1.562 25294 899 1 3 . 1 1 15 15 LYS N N 15 123.897 123.897 122.688 1.209 25294 900 1 3 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.567 -0.110 25294 901 1 3 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.413 -4.006 25294 902 1 3 . 1 1 15 15 LYS CB C 15 32.453 32.453 34.673 -2.220 25294 903 1 3 . 1 1 16 16 TRP N N 16 125.776 125.776 121.682 4.094 25294 904 1 3 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.305 -0.230 25294 905 1 3 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.602 -2.950 25294 906 1 3 . 1 1 16 16 TRP CB C 16 28.000 28.000 31.141 -3.141 25294 907 1 3 . 1 1 17 17 SER N N 17 120.772 120.772 119.395 1.377 25294 908 1 3 . 1 1 17 17 SER HA H 17 4.403 4.403 4.550 -0.147 25294 909 1 3 . 1 1 17 17 SER CA C 17 56.167 56.167 58.834 -2.667 25294 910 1 3 . 1 1 17 17 SER CB C 17 60.833 60.833 63.300 -2.467 25294 911 1 3 . 1 1 18 18 LYS N N 18 121.096 121.096 121.422 -0.326 25294 912 1 3 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.505 0.213 25294 913 1 3 . 1 1 18 18 LYS CA C 18 53.735 53.735 56.517 -2.782 25294 914 1 3 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.436 -2.519 25294 915 1 3 . 1 1 19 19 VAL N N 19 116.358 116.358 120.689 -4.331 25294 916 1 3 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.666 -0.243 25294 917 1 3 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.410 -3.180 25294 918 1 3 . 1 1 19 19 VAL CB C 19 31.026 31.026 33.237 -2.211 25294 919 1 3 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.557 -0.254 25294 920 1 3 . 1 1 20 20 PRO CA C 20 59.770 59.770 61.938 -2.168 25294 921 1 3 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.748 -3.195 25294 922 1 3 . 1 1 21 21 SER N N 21 118.882 118.882 116.796 2.086 25294 923 1 3 . 1 1 21 21 SER HA H 21 4.084 4.084 4.230 -0.146 25294 924 1 3 . 1 1 21 21 SER CA C 21 57.657 57.657 59.531 -1.874 25294 925 1 3 . 1 1 21 21 SER CB C 21 60.173 60.173 63.029 -2.856 25294 926 1 3 . 1 1 22 22 GLY N N 22 109.523 109.523 108.524 0.999 25294 927 1 3 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.917 -2.513 25294 928 1 3 . 1 1 23 23 LEU N N 23 123.003 123.003 122.922 0.081 25294 929 1 3 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.401 -0.367 25294 930 1 3 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.463 -1.860 25294 931 1 3 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.206 -2.135 25294 932 1 3 . 1 1 24 24 LYS N N 24 129.004 129.004 126.486 2.518 25294 933 1 3 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.414 0.096 25294 934 1 3 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.593 -2.356 25294 935 1 3 . 1 1 24 24 LYS CB C 24 32.161 32.161 34.392 -2.231 25294 936 1 3 . 1 1 25 25 ASN N N 25 126.336 126.336 122.414 3.922 25294 937 1 3 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.470 -0.146 25294 938 1 3 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.972 -2.352 25294 939 1 3 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.534 -2.549 25294 940 1 3 . 1 1 26 26 GLY N N 26 103.076 103.076 103.324 -0.248 25294 941 1 3 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.153 -1.604 25294 942 1 3 . 1 1 27 27 GLU N N 27 120.878 120.878 121.661 -0.783 25294 943 1 3 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.049 0.153 25294 944 1 3 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.283 -4.050 25294 945 1 3 . 1 1 27 27 GLU CB C 27 30.761 30.761 32.133 -1.372 25294 946 1 3 . 1 1 28 28 LEU N N 28 128.583 128.583 124.810 3.773 25294 947 1 3 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.867 -0.312 25294 948 1 3 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.951 -3.627 25294 949 1 3 . 1 1 28 28 LEU CB C 28 43.517 43.517 44.050 -0.533 25294 950 1 3 . 1 1 29 29 LYS N N 29 127.554 127.554 124.086 3.468 25294 951 1 3 . 1 1 29 29 LYS HA H 29 4.901 4.901 5.170 -0.269 25294 952 1 3 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.673 -2.834 25294 953 1 3 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.920 -4.397 25294 954 1 3 . 1 1 30 30 VAL N N 30 127.915 127.915 118.781 9.134 25294 955 1 3 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.419 -0.235 25294 956 1 3 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.276 -1.968 25294 957 1 3 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.521 -4.251 25294 958 1 3 . 1 1 31 31 GLU N N 31 125.151 125.151 123.390 1.761 25294 959 1 3 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.410 -0.049 25294 960 1 3 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.803 -1.703 25294 961 1 3 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.514 -2.811 25294 962 1 3 . 1 1 32 32 ALA N N 32 126.271 126.271 122.096 4.175 25294 963 1 3 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.207 -0.191 25294 964 1 3 . 1 1 32 32 ALA CA C 32 53.127 53.127 53.993 -0.866 25294 965 1 3 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.594 -3.328 25294 966 1 3 . 1 1 33 33 GLU N N 33 113.076 113.076 116.065 -2.989 25294 967 1 3 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.243 -0.278 25294 968 1 3 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.982 -0.997 25294 969 1 3 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.218 -3.289 25294 970 1 3 . 1 1 34 34 GLY N N 34 104.905 104.905 108.411 -3.506 25294 971 1 3 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.254 -4.547 25294 972 1 3 . 1 1 35 35 GLY N N 35 105.946 105.946 106.983 -1.037 25294 973 1 3 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.517 -1.528 25294 974 1 3 . 1 1 36 36 SER N N 36 116.044 116.044 115.415 0.629 25294 975 1 3 . 1 1 36 36 SER HA H 36 5.539 5.539 5.404 0.135 25294 976 1 3 . 1 1 36 36 SER CA C 36 54.323 54.323 57.226 -2.903 25294 977 1 3 . 1 1 36 36 SER CB C 36 62.808 62.808 64.542 -1.734 25294 978 1 3 . 1 1 37 37 SER N N 37 119.501 119.501 120.082 -0.581 25294 979 1 3 . 1 1 37 37 SER HA H 37 4.712 4.712 4.742 -0.030 25294 980 1 3 . 1 1 37 37 SER CA C 37 55.548 55.548 57.826 -2.278 25294 981 1 3 . 1 1 37 37 SER CB C 37 63.943 63.943 64.579 -0.636 25294 982 1 3 . 1 1 38 38 LEU N N 38 125.962 125.962 121.611 4.351 25294 983 1 3 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.707 0.546 25294 984 1 3 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.981 -3.199 25294 985 1 3 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.757 -2.923 25294 986 1 3 . 1 1 39 39 PHE N N 39 124.707 124.707 124.017 0.690 25294 987 1 3 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.278 -0.139 25294 988 1 3 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.013 -3.882 25294 989 1 3 . 1 1 39 39 PHE CB C 39 38.952 38.952 41.150 -2.198 25294 990 1 3 . 1 1 40 40 ALA N N 40 124.994 124.994 126.980 -1.986 25294 991 1 3 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.593 0.042 25294 992 1 3 . 1 1 40 40 ALA CA C 40 48.301 48.301 49.806 -1.505 25294 993 1 3 . 1 1 40 40 ALA CB C 40 19.446 19.446 21.587 -2.140 25294 994 1 3 . 1 1 41 41 CYS N N 41 125.757 125.757 123.018 2.739 25294 995 1 3 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.843 -0.697 25294 996 1 3 . 1 1 41 41 CYS CA C 41 56.465 56.465 56.902 -0.437 25294 997 1 3 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.067 -1.094 25294 998 1 3 . 1 1 42 42 LYS N N 42 129.019 129.019 123.577 5.442 25294 999 1 3 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.209 0.051 25294 1000 1 3 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.830 -2.979 25294 1001 1 3 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.785 -0.678 25294 1002 1 3 . 1 1 43 43 ASN N N 43 113.240 113.240 116.001 -2.761 25294 1003 1 3 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.686 -0.161 25294 1004 1 3 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.641 -3.406 25294 1005 1 3 . 1 1 43 43 ASN CB C 43 34.861 34.861 40.577 -5.716 25294 1006 1 3 . 1 1 44 44 TYR N N 44 119.335 119.335 118.107 1.228 25294 1007 1 3 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.593 -0.036 25294 1008 1 3 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.199 -2.481 25294 1009 1 3 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.841 -4.469 25294 1010 1 3 . 1 1 45 45 LYS N N 45 120.676 120.676 120.212 0.464 25294 1011 1 3 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.712 -0.676 25294 1012 1 3 . 1 1 45 45 LYS CA C 45 54.538 54.538 55.690 -1.151 25294 1013 1 3 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.707 -3.474 25294 1014 1 3 . 1 1 46 46 SER N N 46 108.797 108.797 114.401 -5.604 25294 1015 1 3 . 1 1 46 46 SER HA H 46 4.388 4.388 4.693 -0.305 25294 1016 1 3 . 1 1 46 46 SER CA C 46 53.664 53.664 57.986 -4.322 25294 1017 1 3 . 1 1 46 46 SER CB C 46 61.810 61.810 64.284 -2.474 25294 1018 1 3 . 1 1 47 47 PHE N N 47 117.325 117.325 119.311 -1.986 25294 1019 1 3 . 1 1 47 47 PHE HA H 47 4.642 4.642 4.982 -0.340 25294 1020 1 3 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.962 -3.345 25294 1021 1 3 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.157 -5.056 25294 1022 1 3 . 1 1 48 48 TRP N N 48 117.090 117.090 116.043 1.047 25294 1023 1 3 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.328 -0.093 25294 1024 1 3 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.073 -1.581 25294 1025 1 3 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.739 -1.844 25294 1026 1 3 . 1 1 49 49 ILE N N 49 119.682 119.682 121.184 -1.502 25294 1027 1 3 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.399 -0.368 25294 1028 1 3 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.820 -1.347 25294 1029 1 3 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.710 -0.274 25294 1030 1 3 . 1 1 50 50 SER N N 50 124.071 124.071 122.167 1.904 25294 1031 1 3 . 1 1 50 50 SER HA H 50 4.708 4.708 4.838 -0.130 25294 1032 1 3 . 1 1 50 50 SER CA C 50 56.110 56.110 57.831 -1.721 25294 1033 1 3 . 1 1 50 50 SER CB C 50 63.816 63.816 64.802 -0.986 25294 1034 1 3 . 1 1 51 51 SER N N 51 111.253 111.253 114.827 -3.574 25294 1035 1 3 . 1 1 51 51 SER HA H 51 4.557 4.557 4.518 0.039 25294 1036 1 3 . 1 1 51 51 SER CA C 51 55.564 55.564 57.781 -2.217 25294 1037 1 3 . 1 1 51 51 SER CB C 51 62.821 62.821 66.294 -3.473 25294 1038 1 3 . 1 1 52 52 VAL N N 52 121.147 121.147 121.010 0.137 25294 1039 1 3 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.628 0.103 25294 1040 1 3 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.820 -1.694 25294 1041 1 3 . 1 1 52 52 VAL CB C 52 32.500 32.500 34.351 -1.851 25294 1042 1 3 . 1 1 53 53 LYS N N 53 126.128 126.128 126.569 -0.441 25294 1043 1 3 . 1 1 53 53 LYS HA H 53 5.007 5.007 5.039 -0.032 25294 1044 1 3 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.231 -2.508 25294 1045 1 3 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.355 -1.583 25294 1046 1 3 . 1 1 54 54 GLU N N 54 124.160 124.160 122.966 1.194 25294 1047 1 3 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.980 0.778 25294 1048 1 3 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.638 -2.379 25294 1049 1 3 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.541 -0.482 25294 1050 1 3 . 1 1 55 55 GLU N N 55 127.218 127.218 118.777 8.441 25294 1051 1 3 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.467 -0.559 25294 1052 1 3 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.559 -2.013 25294 1053 1 3 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.475 -5.181 25294 1054 1 3 . 1 1 56 56 GLY N N 56 104.894 104.894 107.615 -2.721 25294 1055 1 3 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.348 -3.467 25294 1056 1 3 . 1 1 57 57 LYS N N 57 120.444 120.444 117.562 2.882 25294 1057 1 3 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.621 -0.057 25294 1058 1 3 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.005 -2.046 25294 1059 1 3 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.637 -2.449 25294 1060 1 3 . 1 1 58 58 PHE N N 58 121.824 121.824 120.491 1.333 25294 1061 1 3 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.330 -0.559 25294 1062 1 3 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.144 0.021 25294 1063 1 3 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.631 -3.729 25294 1064 1 3 . 1 1 59 59 LYS N N 59 123.205 123.205 119.870 3.335 25294 1065 1 3 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.754 -0.303 25294 1066 1 3 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.938 -3.953 25294 1067 1 3 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.584 -4.793 25294 1068 1 3 . 1 1 60 60 GLU N N 60 122.647 122.647 119.019 3.628 25294 1069 1 3 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.251 0.009 25294 1070 1 3 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.151 -1.245 25294 1071 1 3 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.332 -2.669 25294 1072 1 3 . 1 1 61 61 ASN N N 61 119.907 119.907 117.528 2.379 25294 1073 1 3 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.482 0.363 25294 1074 1 3 . 1 1 61 61 ASN CA C 61 50.752 50.752 51.943 -1.191 25294 1075 1 3 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.673 -3.650 25294 1076 1 3 . 1 1 62 62 THR N N 62 113.271 113.271 112.728 0.543 25294 1077 1 3 . 1 1 62 62 THR HA H 62 4.308 4.308 4.483 -0.175 25294 1078 1 3 . 1 1 62 62 THR CA C 62 59.310 59.310 61.953 -2.643 25294 1079 1 3 . 1 1 62 62 THR CB C 62 66.813 66.813 68.931 -2.118 25294 1080 1 3 . 1 1 63 63 SER N N 63 116.521 116.521 116.168 0.353 25294 1081 1 3 . 1 1 63 63 SER HA H 63 4.650 4.650 4.461 0.189 25294 1082 1 3 . 1 1 63 63 SER CA C 63 54.094 54.094 57.739 -3.645 25294 1083 1 3 . 1 1 63 63 SER CB C 63 61.617 61.617 65.374 -3.757 25294 1084 1 3 . 1 1 64 64 TYR N N 64 120.183 120.183 118.996 1.187 25294 1085 1 3 . 1 1 64 64 TYR HA H 64 4.838 4.838 5.007 -0.169 25294 1086 1 3 . 1 1 64 64 TYR CA C 64 56.403 56.403 57.877 -1.474 25294 1087 1 3 . 1 1 64 64 TYR CB C 64 36.569 36.569 38.907 -2.338 25294 1088 1 3 . 1 1 65 65 LYS N N 65 115.195 115.195 115.125 0.070 25294 1089 1 3 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.598 0.123 25294 1090 1 3 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.256 -3.550 25294 1091 1 3 . 1 1 65 65 LYS CB C 65 31.820 31.820 33.861 -2.041 25294 1092 1 3 . 1 1 66 66 GLU N N 66 117.231 117.231 118.953 -1.722 25294 1093 1 3 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.111 0.102 25294 1094 1 3 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.059 -2.446 25294 1095 1 3 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.867 -3.074 25294 1096 1 3 . 1 1 67 67 PHE N N 67 121.532 121.532 119.130 2.402 25294 1097 1 3 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.834 -0.404 25294 1098 1 3 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.032 -0.763 25294 1099 1 3 . 1 1 67 67 PHE CB C 67 40.275 40.275 43.202 -2.927 25294 1100 1 3 . 1 1 68 68 ASP N N 68 128.157 128.157 126.173 1.984 25294 1101 1 3 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.610 -0.182 25294 1102 1 3 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.541 -2.985 25294 1103 1 3 . 1 1 68 68 ASP CB C 68 38.424 38.424 39.819 -1.395 25294 1104 1 3 . 1 1 69 69 GLY N N 69 114.151 114.151 109.419 4.732 25294 1105 1 3 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.155 -3.256 25294 1106 1 3 . 1 1 70 70 GLY N N 70 113.714 113.714 110.522 3.192 25294 1107 1 3 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.881 -1.887 25294 1108 1 3 . 1 1 71 71 TRP N N 71 117.823 117.823 120.313 -2.490 25294 1109 1 3 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.678 0.130 25294 1110 1 3 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.316 -2.539 25294 1111 1 3 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.069 -4.424 25294 1112 1 3 . 1 1 72 72 TYR N N 72 114.204 114.204 121.035 -6.831 25294 1113 1 3 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.887 0.238 25294 1114 1 3 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.655 -5.220 25294 1115 1 3 . 1 1 72 72 TYR CB C 72 38.620 38.620 39.026 -0.406 25294 1116 1 3 . 1 1 73 73 LEU N N 73 121.469 121.469 129.585 -8.116 25294 1117 1 3 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.766 0.001 25294 1118 1 3 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.170 -1.838 25294 1119 1 3 . 1 1 73 73 LEU CB C 73 43.403 43.403 43.892 -0.489 25294 1120 1 3 . 1 1 74 74 VAL N N 74 124.558 124.558 128.448 -3.890 25294 1121 1 3 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.381 0.402 25294 1122 1 3 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.668 -3.856 25294 1123 1 3 . 1 1 74 74 VAL CB C 74 31.820 31.820 32.880 -1.060 25294 1124 1 3 . 1 1 75 75 LYS N N 75 125.824 125.824 127.045 -1.221 25294 1125 1 3 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.065 0.045 25294 1126 1 3 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.245 -2.442 25294 1127 1 3 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.679 -2.104 25294 1128 1 3 . 1 1 76 76 ILE N N 76 124.647 124.647 126.883 -2.236 25294 1129 1 3 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.193 0.885 25294 1130 1 3 . 1 1 76 76 ILE CA C 76 57.367 57.367 61.507 -4.140 25294 1131 1 3 . 1 1 76 76 ILE CB C 76 37.593 37.593 38.413 -0.821 25294 1132 1 3 . 1 1 77 77 GLU N N 77 128.081 128.081 126.725 1.356 25294 1133 1 3 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.486 -0.042 25294 1134 1 3 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.250 -2.779 25294 1135 1 3 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.256 -1.342 25294 1136 1 3 . 1 1 78 78 ASP N N 78 126.158 126.158 119.166 6.992 25294 1137 1 3 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.345 -0.245 25294 1138 1 3 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.011 -2.949 25294 1139 1 3 . 1 1 78 78 ASP CB C 78 36.738 36.738 41.257 -4.519 25294 1140 1 3 . 1 1 79 79 ASN N N 79 118.653 118.653 113.364 5.289 25294 1141 1 3 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.837 -0.191 25294 1142 1 3 . 1 1 79 79 ASN CA C 79 51.209 51.209 52.817 -1.608 25294 1143 1 3 . 1 1 79 79 ASN CB C 79 35.350 35.350 39.347 -3.997 25294 1144 1 3 . 1 1 80 80 GLU N N 80 120.378 120.378 120.452 -0.074 25294 1145 1 3 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.266 0.243 25294 1146 1 3 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.386 -2.526 25294 1147 1 3 . 1 1 80 80 GLU CB C 80 29.673 29.673 32.922 -3.249 25294 1148 1 3 . 1 1 81 81 LEU N N 81 125.771 125.771 126.054 -0.283 25294 1149 1 3 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.640 -0.674 25294 1150 1 3 . 1 1 81 81 LEU CA C 81 51.014 51.014 53.428 -2.414 25294 1151 1 3 . 1 1 81 81 LEU CB C 81 42.550 42.550 45.864 -3.314 25294 1152 1 3 . 1 1 82 82 LYS N N 82 128.076 128.076 123.258 4.818 25294 1153 1 3 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.010 0.235 25294 1154 1 3 . 1 1 82 82 LYS CA C 82 52.332 52.332 55.114 -2.782 25294 1155 1 3 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.488 -4.309 25294 1156 1 3 . 1 1 83 83 VAL N N 83 124.216 124.216 120.680 3.536 25294 1157 1 3 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.049 -0.141 25294 1158 1 3 . 1 1 83 83 VAL CA C 83 58.380 58.380 58.974 -0.594 25294 1159 1 3 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.782 -2.615 25294 1160 1 3 . 1 1 84 84 ILE N N 84 129.084 129.084 127.076 2.008 25294 1161 1 3 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.637 -0.107 25294 1162 1 3 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.690 -1.284 25294 1163 1 3 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.776 -2.610 25294 1164 1 3 . 1 1 85 85 ILE N N 85 127.360 127.360 125.253 2.107 25294 1165 1 3 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.817 -0.232 25294 1166 1 3 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.771 -1.311 25294 1167 1 3 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.414 -1.916 25294 1168 1 3 . 1 1 86 86 ASN N N 86 128.337 128.337 125.461 2.876 25294 1169 1 3 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.925 -0.159 25294 1170 1 3 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.746 -2.564 25294 1171 1 3 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.373 -3.482 25294 1172 1 3 . 1 1 87 87 ARG N N 87 119.368 119.368 120.492 -1.124 25294 1173 1 3 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.263 -0.272 25294 1174 1 3 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.628 -2.430 25294 1175 1 3 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.651 -2.248 25294 1176 1 3 . 1 1 88 88 ASN N N 88 125.082 125.082 123.984 1.098 25294 1177 1 3 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.561 0.164 25294 1178 1 3 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.073 -3.970 25294 1179 1 3 . 1 1 88 88 ASN CB C 88 34.757 34.757 39.386 -4.628 25294 1180 1 3 . 1 1 89 89 GLU N N 89 125.309 125.309 122.635 2.674 25294 1181 1 3 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.366 -0.008 25294 1182 1 3 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.528 -3.515 25294 1183 1 3 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.706 -2.622 25294 1184 1 3 . 1 1 90 90 THR N N 90 112.516 112.516 112.051 0.465 25294 1185 1 3 . 1 1 90 90 THR HA H 90 4.534 4.534 4.524 0.010 25294 1186 1 3 . 1 1 90 90 THR CA C 90 58.161 58.161 60.054 -1.893 25294 1187 1 3 . 1 1 90 90 THR CB C 90 68.409 68.409 72.284 -3.875 25294 1188 1 3 . 1 1 91 91 ASN N N 91 116.717 116.717 120.855 -4.138 25294 1189 1 3 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.673 0.034 25294 1190 1 3 . 1 1 91 91 ASN CA C 91 49.796 49.796 54.025 -4.229 25294 1191 1 3 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.370 -2.896 25294 1192 1 3 . 1 1 92 92 ALA N N 92 122.025 122.025 122.094 -0.069 25294 1193 1 3 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.578 0.058 25294 1194 1 3 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.458 -2.409 25294 1195 1 3 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.549 -0.833 25294 1196 1 3 . 1 1 93 93 SER N N 93 115.895 115.895 118.945 -3.050 25294 1197 1 3 . 1 1 93 93 SER HA H 93 4.536 4.536 4.613 -0.077 25294 1198 1 3 . 1 1 93 93 SER CA C 93 54.865 54.865 58.471 -3.606 25294 1199 1 3 . 1 1 93 93 SER CB C 93 61.292 61.292 64.397 -3.106 25294 1200 1 3 . 1 1 94 94 ARG N N 94 119.529 119.529 122.303 -2.774 25294 1201 1 3 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.829 0.085 25294 1202 1 3 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.598 -2.502 25294 1203 1 3 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.611 -4.099 25294 1204 1 3 . 1 1 95 95 SER N N 95 114.542 114.542 115.641 -1.099 25294 1205 1 3 . 1 1 95 95 SER HA H 95 5.926 5.926 4.990 0.936 25294 1206 1 3 . 1 1 95 95 SER CA C 95 54.219 54.219 57.386 -3.167 25294 1207 1 3 . 1 1 95 95 SER CB C 95 65.271 65.271 66.145 -0.874 25294 1208 1 3 . 1 1 96 96 PHE N N 96 117.183 117.183 119.261 -2.078 25294 1209 1 3 . 1 1 96 96 PHE HA H 96 5.338 5.338 4.982 0.356 25294 1210 1 3 . 1 1 96 96 PHE CA C 96 54.480 54.480 57.058 -2.578 25294 1211 1 3 . 1 1 96 96 PHE CB C 96 38.868 38.868 44.042 -5.174 25294 1212 1 3 . 1 1 97 97 THR N N 97 115.263 115.263 118.116 -2.853 25294 1213 1 3 . 1 1 97 97 THR HA H 97 5.250 5.250 5.170 0.080 25294 1214 1 3 . 1 1 97 97 THR CA C 97 58.178 58.178 61.654 -3.476 25294 1215 1 3 . 1 1 97 97 THR CB C 97 69.068 69.068 71.442 -2.374 25294 1216 1 3 . 1 1 98 98 VAL N N 98 125.442 125.442 123.528 1.914 25294 1217 1 3 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.444 0.413 25294 1218 1 3 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.363 -2.954 25294 1219 1 3 . 1 1 98 98 VAL CB C 98 32.929 32.929 30.840 2.089 25294 1220 1 3 . 1 1 99 99 CYS N N 99 127.111 127.111 127.532 -0.421 25294 1221 1 3 . 1 1 99 99 CYS HA H 99 5.346 5.346 4.708 0.638 25294 1222 1 3 . 1 1 99 99 CYS CA C 99 53.951 53.951 57.819 -3.868 25294 1223 1 3 . 1 1 99 99 CYS CB C 99 25.942 25.942 27.760 -1.818 25294 1224 1 3 . 1 1 100 100 VAL N N 100 120.146 120.146 119.936 0.210 25294 1225 1 3 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.307 0.076 25294 1226 1 3 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.123 -3.410 25294 1227 1 3 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.547 -1.903 25294 1228 1 3 . 1 1 101 101 GLU N N 101 118.807 118.807 124.455 -5.648 25294 1229 1 3 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.739 0.013 25294 1230 1 3 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.359 -2.924 25294 1231 1 3 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.725 -2.004 25294 1232 1 3 . 1 1 102 102 ALA N N 102 124.088 124.088 127.458 -3.370 25294 1233 1 3 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.672 -0.815 25294 1234 1 3 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.639 -2.761 25294 1235 1 3 . 1 1 102 102 ALA CB C 102 18.025 18.025 18.867 -0.842 25294 1236 1 3 . 1 1 103 103 GLY N N 103 111.186 111.186 109.059 2.127 25294 1237 1 3 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.824 -1.181 25294 1238 1 3 . 1 1 104 104 ASN N N 104 123.092 123.092 122.141 0.951 25294 1239 1 3 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.605 0.067 25294 1240 1 3 . 1 1 104 104 ASN CA C 104 50.696 50.696 54.042 -3.346 25294 1241 1 3 . 1 1 104 104 ASN CB C 104 36.407 36.407 38.775 -2.368 25294 1242 1 3 . 1 1 105 105 ALA N N 105 122.653 122.653 119.604 3.049 25294 1243 1 3 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.440 -0.009 25294 1244 1 3 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.102 -2.434 25294 1245 1 3 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.855 -1.919 25294 1246 1 3 . 1 1 106 106 PHE N N 106 116.011 116.011 114.471 1.540 25294 1247 1 3 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.027 0.390 25294 1248 1 3 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.217 -2.659 25294 1249 1 3 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.017 -1.533 25294 1250 1 3 . 1 1 107 107 ASP N N 107 121.992 121.992 120.001 1.991 25294 1251 1 3 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.775 -0.181 25294 1252 1 3 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.382 -2.858 25294 1253 1 3 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.962 -1.871 25294 1254 1 3 . 1 1 108 108 GLU N N 108 119.354 119.354 121.894 -2.540 25294 1255 1 3 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.859 0.150 25294 1256 1 3 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.278 -3.290 25294 1257 1 3 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.329 -1.012 25294 1258 1 3 . 1 1 109 109 PHE N N 109 122.098 122.098 125.429 -3.331 25294 1259 1 3 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.897 0.061 25294 1260 1 3 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.276 -3.489 25294 1261 1 3 . 1 1 109 109 PHE CB C 109 40.443 40.443 41.206 -0.763 25294 1262 1 3 . 1 1 110 110 LYS N N 110 124.500 124.500 125.934 -1.434 25294 1263 1 3 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.943 -0.251 25294 1264 1 3 . 1 1 110 110 LYS CA C 110 51.891 51.891 54.425 -2.534 25294 1265 1 3 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.349 0.663 25294 1266 1 3 . 1 1 111 111 PHE N N 111 125.010 125.010 125.114 -0.104 25294 1267 1 3 . 1 1 111 111 PHE HA H 111 4.754 4.754 4.998 -0.244 25294 1268 1 3 . 1 1 111 111 PHE CA C 111 58.184 58.184 58.868 -0.684 25294 1269 1 3 . 1 1 111 111 PHE CB C 111 38.380 38.380 40.554 -2.174 25294 1270 1 3 . 1 1 112 112 VAL N N 112 122.957 122.957 121.642 1.315 25294 1271 1 3 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.618 -0.178 25294 1272 1 3 . 1 1 112 112 VAL CA C 112 58.256 58.256 60.966 -2.710 25294 1273 1 3 . 1 1 112 112 VAL CB C 112 31.093 31.093 34.322 -3.229 25294 1274 1 3 . 1 1 113 113 GLN N N 113 130.864 130.864 128.812 2.052 25294 1275 1 3 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.495 0.824 25294 1276 1 3 . 1 1 113 113 GLN CA C 113 51.119 51.119 55.511 -4.392 25294 1277 1 3 . 1 1 113 113 GLN CB C 113 28.164 28.164 30.476 -2.312 25294 1278 1 3 . 1 1 114 114 ASP N N 114 126.272 126.272 127.310 -1.038 25294 1279 1 3 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.546 -0.219 25294 1280 1 3 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.156 -3.383 25294 1281 1 3 . 1 1 114 114 ASP CB C 114 39.855 39.855 41.806 -1.951 25294 1282 1 3 . 1 1 115 115 ALA N N 115 120.134 120.134 122.084 -1.950 25294 1283 1 3 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.318 -0.619 25294 1284 1 3 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.332 -3.431 25294 1285 1 3 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.889 -2.138 25294 1286 1 3 . 1 1 116 116 ALA N N 116 121.377 121.377 124.260 -2.883 25294 1287 1 3 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.469 -0.516 25294 1288 1 3 . 1 1 116 116 ALA CA C 116 49.988 49.988 50.901 -0.913 25294 1289 1 3 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.754 -3.554 25294 1290 1 3 . 1 1 117 117 LYS N N 117 121.536 121.536 125.525 -3.989 25294 1291 1 3 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.209 -0.070 25294 1292 1 3 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.610 -1.964 25294 1293 1 3 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.598 -1.018 25294 1294 1 4 . 1 1 5 5 SER N N 5 116.267 116.267 118.993 -2.726 25294 1295 1 4 . 1 1 5 5 SER HA H 5 4.349 4.349 4.689 -0.340 25294 1296 1 4 . 1 1 5 5 SER CA C 5 55.478 55.478 58.022 -2.544 25294 1297 1 4 . 1 1 5 5 SER CB C 5 61.191 61.191 63.966 -2.775 25294 1298 1 4 . 1 1 6 6 ASP N N 6 123.039 123.039 122.737 0.302 25294 1299 1 4 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.963 -0.136 25294 1300 1 4 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.296 -2.625 25294 1301 1 4 . 1 1 6 6 ASP CB C 6 38.656 38.656 40.754 -2.098 25294 1302 1 4 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.429 -0.112 25294 1303 1 4 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.537 -3.390 25294 1304 1 4 . 1 1 7 7 PRO CB C 7 29.478 29.478 31.855 -2.377 25294 1305 1 4 . 1 1 8 8 ASP N N 8 119.159 119.159 115.757 3.402 25294 1306 1 4 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.688 -0.123 25294 1307 1 4 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.056 -2.196 25294 1308 1 4 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.382 -2.657 25294 1309 1 4 . 1 1 9 9 GLY N N 9 108.837 108.837 109.107 -0.270 25294 1310 1 4 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.358 -2.222 25294 1311 1 4 . 1 1 10 10 LEU N N 10 121.571 121.571 120.281 1.290 25294 1312 1 4 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.845 -0.578 25294 1313 1 4 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.429 -1.038 25294 1314 1 4 . 1 1 10 10 LEU CB C 10 39.863 39.863 43.216 -3.353 25294 1315 1 4 . 1 1 11 11 ALA N N 11 125.169 125.169 122.960 2.209 25294 1316 1 4 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.518 -0.182 25294 1317 1 4 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.291 -2.307 25294 1318 1 4 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.486 -2.304 25294 1319 1 4 . 1 1 12 12 ASP N N 12 122.672 122.672 124.980 -2.308 25294 1320 1 4 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.664 0.072 25294 1321 1 4 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.462 -2.760 25294 1322 1 4 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.644 -3.813 25294 1323 1 4 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.204 0.100 25294 1324 1 4 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.693 -3.093 25294 1325 1 4 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.465 -2.949 25294 1326 1 4 . 1 1 14 14 MET N N 14 120.151 120.151 119.070 1.081 25294 1327 1 4 . 1 1 14 14 MET HA H 14 3.780 3.780 4.357 -0.577 25294 1328 1 4 . 1 1 14 14 MET CA C 14 55.822 55.822 56.979 -1.157 25294 1329 1 4 . 1 1 14 14 MET CB C 14 30.909 30.909 33.006 -2.097 25294 1330 1 4 . 1 1 15 15 LYS N N 15 123.897 123.897 122.558 1.339 25294 1331 1 4 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.821 -0.364 25294 1332 1 4 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.180 -3.773 25294 1333 1 4 . 1 1 15 15 LYS CB C 15 32.453 32.453 35.486 -3.033 25294 1334 1 4 . 1 1 16 16 TRP N N 16 125.776 125.776 122.631 3.145 25294 1335 1 4 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.390 -0.315 25294 1336 1 4 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.443 -2.791 25294 1337 1 4 . 1 1 16 16 TRP CB C 16 28.000 28.000 32.292 -4.292 25294 1338 1 4 . 1 1 17 17 SER N N 17 120.772 120.772 116.333 4.439 25294 1339 1 4 . 1 1 17 17 SER HA H 17 4.403 4.403 4.657 -0.254 25294 1340 1 4 . 1 1 17 17 SER CA C 17 56.167 56.167 58.698 -2.531 25294 1341 1 4 . 1 1 17 17 SER CB C 17 60.833 60.833 63.761 -2.928 25294 1342 1 4 . 1 1 18 18 LYS N N 18 121.096 121.096 121.506 -0.410 25294 1343 1 4 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.528 0.190 25294 1344 1 4 . 1 1 18 18 LYS CA C 18 53.735 53.735 54.857 -1.122 25294 1345 1 4 . 1 1 18 18 LYS CB C 18 32.917 32.917 33.594 -0.677 25294 1346 1 4 . 1 1 19 19 VAL N N 19 116.358 116.358 118.955 -2.597 25294 1347 1 4 . 1 1 19 19 VAL HA H 19 4.423 4.423 3.688 0.735 25294 1348 1 4 . 1 1 19 19 VAL CA C 19 55.230 55.230 59.659 -4.429 25294 1349 1 4 . 1 1 19 19 VAL CB C 19 31.026 31.026 30.726 0.300 25294 1350 1 4 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.434 -0.131 25294 1351 1 4 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.072 -2.303 25294 1352 1 4 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.315 -2.762 25294 1353 1 4 . 1 1 21 21 SER N N 21 118.882 118.882 115.921 2.961 25294 1354 1 4 . 1 1 21 21 SER HA H 21 4.084 4.084 4.264 -0.180 25294 1355 1 4 . 1 1 21 21 SER CA C 21 57.657 57.657 60.586 -2.929 25294 1356 1 4 . 1 1 21 21 SER CB C 21 60.173 60.173 62.903 -2.729 25294 1357 1 4 . 1 1 22 22 GLY N N 22 109.523 109.523 109.054 0.469 25294 1358 1 4 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.488 -2.084 25294 1359 1 4 . 1 1 23 23 LEU N N 23 123.003 123.003 122.634 0.369 25294 1360 1 4 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.270 -0.236 25294 1361 1 4 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.589 -1.986 25294 1362 1 4 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.054 -1.983 25294 1363 1 4 . 1 1 24 24 LYS N N 24 129.004 129.004 128.761 0.243 25294 1364 1 4 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.476 0.034 25294 1365 1 4 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.237 -2.001 25294 1366 1 4 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.520 -1.359 25294 1367 1 4 . 1 1 25 25 ASN N N 25 126.336 126.336 123.055 3.281 25294 1368 1 4 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.503 -0.179 25294 1369 1 4 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.693 -2.073 25294 1370 1 4 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.916 -2.931 25294 1371 1 4 . 1 1 26 26 GLY N N 26 103.076 103.076 104.271 -1.195 25294 1372 1 4 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.336 -1.787 25294 1373 1 4 . 1 1 27 27 GLU N N 27 120.878 120.878 119.154 1.724 25294 1374 1 4 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.214 -0.012 25294 1375 1 4 . 1 1 27 27 GLU CA C 27 51.233 51.233 54.421 -3.188 25294 1376 1 4 . 1 1 27 27 GLU CB C 27 30.761 30.761 33.888 -3.127 25294 1377 1 4 . 1 1 28 28 LEU N N 28 128.583 128.583 124.195 4.388 25294 1378 1 4 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.706 -0.151 25294 1379 1 4 . 1 1 28 28 LEU CA C 28 50.324 50.324 54.378 -4.054 25294 1380 1 4 . 1 1 28 28 LEU CB C 28 43.517 43.517 45.285 -1.768 25294 1381 1 4 . 1 1 29 29 LYS N N 29 127.554 127.554 124.704 2.850 25294 1382 1 4 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.447 0.454 25294 1383 1 4 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.404 -3.565 25294 1384 1 4 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.134 -3.611 25294 1385 1 4 . 1 1 30 30 VAL N N 30 127.915 127.915 125.254 2.661 25294 1386 1 4 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.441 -0.257 25294 1387 1 4 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.367 -2.059 25294 1388 1 4 . 1 1 30 30 VAL CB C 30 32.270 32.270 34.685 -2.415 25294 1389 1 4 . 1 1 31 31 GLU N N 31 125.151 125.151 126.075 -0.924 25294 1390 1 4 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.460 -0.099 25294 1391 1 4 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.992 -1.892 25294 1392 1 4 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.541 -2.838 25294 1393 1 4 . 1 1 32 32 ALA N N 32 126.271 126.271 121.652 4.619 25294 1394 1 4 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.215 -0.199 25294 1395 1 4 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.528 -1.401 25294 1396 1 4 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.398 -3.132 25294 1397 1 4 . 1 1 33 33 GLU N N 33 113.076 113.076 116.543 -3.467 25294 1398 1 4 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.182 -0.217 25294 1399 1 4 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.891 -0.905 25294 1400 1 4 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.164 -3.235 25294 1401 1 4 . 1 1 34 34 GLY N N 34 104.905 104.905 108.279 -3.374 25294 1402 1 4 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.088 -4.381 25294 1403 1 4 . 1 1 35 35 GLY N N 35 105.946 105.946 108.184 -2.238 25294 1404 1 4 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.744 -1.756 25294 1405 1 4 . 1 1 36 36 SER N N 36 116.044 116.044 115.693 0.351 25294 1406 1 4 . 1 1 36 36 SER HA H 36 5.539 5.539 5.192 0.347 25294 1407 1 4 . 1 1 36 36 SER CA C 36 54.323 54.323 58.195 -3.872 25294 1408 1 4 . 1 1 36 36 SER CB C 36 62.808 62.808 64.990 -2.182 25294 1409 1 4 . 1 1 37 37 SER N N 37 119.501 119.501 116.931 2.570 25294 1410 1 4 . 1 1 37 37 SER HA H 37 4.712 4.712 4.682 0.030 25294 1411 1 4 . 1 1 37 37 SER CA C 37 55.548 55.548 58.495 -2.947 25294 1412 1 4 . 1 1 37 37 SER CB C 37 63.943 63.943 65.751 -1.808 25294 1413 1 4 . 1 1 38 38 LEU N N 38 125.962 125.962 123.462 2.500 25294 1414 1 4 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.887 0.366 25294 1415 1 4 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.388 -2.606 25294 1416 1 4 . 1 1 38 38 LEU CB C 38 42.834 42.834 44.676 -1.842 25294 1417 1 4 . 1 1 39 39 PHE N N 39 124.707 124.707 122.303 2.404 25294 1418 1 4 . 1 1 39 39 PHE HA H 39 5.139 5.139 4.949 0.190 25294 1419 1 4 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.265 -4.134 25294 1420 1 4 . 1 1 39 39 PHE CB C 39 38.952 38.952 43.180 -4.228 25294 1421 1 4 . 1 1 40 40 ALA N N 40 124.994 124.994 125.180 -0.186 25294 1422 1 4 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.353 0.282 25294 1423 1 4 . 1 1 40 40 ALA CA C 40 48.301 48.301 51.283 -2.982 25294 1424 1 4 . 1 1 40 40 ALA CB C 40 19.446 19.446 21.201 -1.755 25294 1425 1 4 . 1 1 41 41 CYS N N 41 125.757 125.757 124.979 0.778 25294 1426 1 4 . 1 1 41 41 CYS HA H 41 4.146 4.146 3.919 0.227 25294 1427 1 4 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.662 -3.197 25294 1428 1 4 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.350 -1.377 25294 1429 1 4 . 1 1 42 42 LYS N N 42 129.019 129.019 127.338 1.681 25294 1430 1 4 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.257 0.003 25294 1431 1 4 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.369 -2.518 25294 1432 1 4 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.858 -0.751 25294 1433 1 4 . 1 1 43 43 ASN N N 43 113.240 113.240 113.860 -0.620 25294 1434 1 4 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.606 -0.081 25294 1435 1 4 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.113 -2.878 25294 1436 1 4 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.214 -4.353 25294 1437 1 4 . 1 1 44 44 TYR N N 44 119.335 119.335 118.467 0.868 25294 1438 1 4 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.572 -0.015 25294 1439 1 4 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.259 -2.541 25294 1440 1 4 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.918 -4.546 25294 1441 1 4 . 1 1 45 45 LYS N N 45 120.676 120.676 119.858 0.818 25294 1442 1 4 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.671 -0.635 25294 1443 1 4 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.558 -2.020 25294 1444 1 4 . 1 1 45 45 LYS CB C 45 30.233 30.233 34.227 -3.994 25294 1445 1 4 . 1 1 46 46 SER N N 46 108.797 108.797 114.521 -5.724 25294 1446 1 4 . 1 1 46 46 SER HA H 46 4.388 4.388 4.837 -0.449 25294 1447 1 4 . 1 1 46 46 SER CA C 46 53.664 53.664 58.060 -4.396 25294 1448 1 4 . 1 1 46 46 SER CB C 46 61.810 61.810 63.931 -2.120 25294 1449 1 4 . 1 1 47 47 PHE N N 47 117.325 117.325 121.794 -4.469 25294 1450 1 4 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.769 -1.127 25294 1451 1 4 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.101 -2.484 25294 1452 1 4 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.526 -5.425 25294 1453 1 4 . 1 1 48 48 TRP N N 48 117.090 117.090 120.002 -2.912 25294 1454 1 4 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.251 -0.016 25294 1455 1 4 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.404 -1.912 25294 1456 1 4 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.658 -1.763 25294 1457 1 4 . 1 1 49 49 ILE N N 49 119.682 119.682 121.563 -1.881 25294 1458 1 4 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.555 -0.524 25294 1459 1 4 . 1 1 49 49 ILE CA C 49 60.473 60.473 62.110 -1.637 25294 1460 1 4 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.962 -0.526 25294 1461 1 4 . 1 1 50 50 SER N N 50 124.071 124.071 120.306 3.765 25294 1462 1 4 . 1 1 50 50 SER HA H 50 4.708 4.708 4.843 -0.135 25294 1463 1 4 . 1 1 50 50 SER CA C 50 56.110 56.110 57.688 -1.578 25294 1464 1 4 . 1 1 50 50 SER CB C 50 63.816 63.816 64.407 -0.591 25294 1465 1 4 . 1 1 51 51 SER N N 51 111.253 111.253 114.602 -3.349 25294 1466 1 4 . 1 1 51 51 SER HA H 51 4.557 4.557 4.898 -0.341 25294 1467 1 4 . 1 1 51 51 SER CA C 51 55.564 55.564 57.565 -2.001 25294 1468 1 4 . 1 1 51 51 SER CB C 51 62.821 62.821 66.118 -3.297 25294 1469 1 4 . 1 1 52 52 VAL N N 52 121.147 121.147 118.844 2.303 25294 1470 1 4 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.750 -0.019 25294 1471 1 4 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.446 -0.320 25294 1472 1 4 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.561 -3.061 25294 1473 1 4 . 1 1 53 53 LYS N N 53 126.128 126.128 120.894 5.234 25294 1474 1 4 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.678 0.329 25294 1475 1 4 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.937 -3.214 25294 1476 1 4 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.535 -1.763 25294 1477 1 4 . 1 1 54 54 GLU N N 54 124.160 124.160 122.777 1.383 25294 1478 1 4 . 1 1 54 54 GLU HA H 54 4.758 4.758 4.219 0.539 25294 1479 1 4 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.986 -2.727 25294 1480 1 4 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.971 -0.912 25294 1481 1 4 . 1 1 55 55 GLU N N 55 127.218 127.218 119.209 8.009 25294 1482 1 4 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.448 -0.540 25294 1483 1 4 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.240 -1.694 25294 1484 1 4 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.931 -5.637 25294 1485 1 4 . 1 1 56 56 GLY N N 56 104.894 104.894 108.144 -3.250 25294 1486 1 4 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.054 -3.173 25294 1487 1 4 . 1 1 57 57 LYS N N 57 120.444 120.444 116.175 4.269 25294 1488 1 4 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.675 -0.111 25294 1489 1 4 . 1 1 57 57 LYS CA C 57 51.959 51.959 53.892 -1.933 25294 1490 1 4 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.011 -2.823 25294 1491 1 4 . 1 1 58 58 PHE N N 58 121.824 121.824 120.113 1.711 25294 1492 1 4 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.149 -0.378 25294 1493 1 4 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.365 -0.200 25294 1494 1 4 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.209 -3.307 25294 1495 1 4 . 1 1 59 59 LYS N N 59 123.205 123.205 119.727 3.478 25294 1496 1 4 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.790 -0.339 25294 1497 1 4 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.892 -3.907 25294 1498 1 4 . 1 1 59 59 LYS CB C 59 29.791 29.791 35.105 -5.314 25294 1499 1 4 . 1 1 60 60 GLU N N 60 122.647 122.647 118.171 4.476 25294 1500 1 4 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.310 -0.050 25294 1501 1 4 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.061 -2.155 25294 1502 1 4 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.341 -2.678 25294 1503 1 4 . 1 1 61 61 ASN N N 61 119.907 119.907 117.495 2.412 25294 1504 1 4 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.855 -0.010 25294 1505 1 4 . 1 1 61 61 ASN CA C 61 50.752 50.752 52.544 -1.792 25294 1506 1 4 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.881 -3.858 25294 1507 1 4 . 1 1 62 62 THR N N 62 113.271 113.271 113.442 -0.171 25294 1508 1 4 . 1 1 62 62 THR HA H 62 4.308 4.308 4.248 0.060 25294 1509 1 4 . 1 1 62 62 THR CA C 62 59.310 59.310 62.786 -3.476 25294 1510 1 4 . 1 1 62 62 THR CB C 62 66.813 66.813 68.846 -2.033 25294 1511 1 4 . 1 1 63 63 SER N N 63 116.521 116.521 114.700 1.821 25294 1512 1 4 . 1 1 63 63 SER HA H 63 4.650 4.650 4.532 0.118 25294 1513 1 4 . 1 1 63 63 SER CA C 63 54.094 54.094 56.822 -2.728 25294 1514 1 4 . 1 1 63 63 SER CB C 63 61.617 61.617 64.241 -2.624 25294 1515 1 4 . 1 1 64 64 TYR N N 64 120.183 120.183 117.867 2.316 25294 1516 1 4 . 1 1 64 64 TYR HA H 64 4.838 4.838 5.246 -0.408 25294 1517 1 4 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.440 -2.037 25294 1518 1 4 . 1 1 64 64 TYR CB C 64 36.569 36.569 40.837 -4.268 25294 1519 1 4 . 1 1 65 65 LYS N N 65 115.195 115.195 116.454 -1.259 25294 1520 1 4 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.717 0.004 25294 1521 1 4 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.028 -3.322 25294 1522 1 4 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.198 -2.378 25294 1523 1 4 . 1 1 66 66 GLU N N 66 117.231 117.231 118.916 -1.685 25294 1524 1 4 . 1 1 66 66 GLU HA H 66 5.213 5.213 4.906 0.307 25294 1525 1 4 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.131 -2.518 25294 1526 1 4 . 1 1 66 66 GLU CB C 66 30.793 30.793 34.362 -3.570 25294 1527 1 4 . 1 1 67 67 PHE N N 67 121.532 121.532 119.859 1.673 25294 1528 1 4 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.801 -0.371 25294 1529 1 4 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.528 -1.259 25294 1530 1 4 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.634 -2.359 25294 1531 1 4 . 1 1 68 68 ASP N N 68 128.157 128.157 128.478 -0.321 25294 1532 1 4 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.439 -0.011 25294 1533 1 4 . 1 1 68 68 ASP CA C 68 49.556 49.556 53.512 -3.956 25294 1534 1 4 . 1 1 68 68 ASP CB C 68 38.424 38.424 41.250 -2.826 25294 1535 1 4 . 1 1 69 69 GLY N N 69 114.151 114.151 112.981 1.170 25294 1536 1 4 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.097 -3.198 25294 1537 1 4 . 1 1 70 70 GLY N N 70 113.714 113.714 110.967 2.747 25294 1538 1 4 . 1 1 70 70 GLY CA C 70 43.994 43.994 46.050 -2.056 25294 1539 1 4 . 1 1 71 71 TRP N N 71 117.823 117.823 121.810 -3.987 25294 1540 1 4 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.462 0.346 25294 1541 1 4 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.426 -3.649 25294 1542 1 4 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.456 -3.811 25294 1543 1 4 . 1 1 72 72 TYR N N 72 114.204 114.204 118.632 -4.428 25294 1544 1 4 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.920 0.205 25294 1545 1 4 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.040 -5.605 25294 1546 1 4 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.831 -2.212 25294 1547 1 4 . 1 1 73 73 LEU N N 73 121.469 121.469 125.330 -3.861 25294 1548 1 4 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.032 -0.265 25294 1549 1 4 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.528 -2.196 25294 1550 1 4 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.329 -2.926 25294 1551 1 4 . 1 1 74 74 VAL N N 74 124.558 124.558 124.030 0.528 25294 1552 1 4 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.450 0.333 25294 1553 1 4 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.085 -3.273 25294 1554 1 4 . 1 1 74 74 VAL CB C 74 31.820 31.820 34.249 -2.429 25294 1555 1 4 . 1 1 75 75 LYS N N 75 125.824 125.824 125.179 0.645 25294 1556 1 4 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.246 -0.136 25294 1557 1 4 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.424 -2.620 25294 1558 1 4 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.333 -2.758 25294 1559 1 4 . 1 1 76 76 ILE N N 76 124.647 124.647 122.082 2.565 25294 1560 1 4 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.981 0.097 25294 1561 1 4 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.120 -2.753 25294 1562 1 4 . 1 1 76 76 ILE CB C 76 37.593 37.593 41.294 -3.701 25294 1563 1 4 . 1 1 77 77 GLU N N 77 128.081 128.081 126.582 1.499 25294 1564 1 4 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.688 -0.244 25294 1565 1 4 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.302 -2.831 25294 1566 1 4 . 1 1 77 77 GLU CB C 77 29.914 29.914 32.253 -2.339 25294 1567 1 4 . 1 1 78 78 ASP N N 78 126.158 126.158 125.539 0.619 25294 1568 1 4 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.109 -0.009 25294 1569 1 4 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.422 -3.360 25294 1570 1 4 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.630 -3.892 25294 1571 1 4 . 1 1 79 79 ASN N N 79 118.653 118.653 116.504 2.149 25294 1572 1 4 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.834 -0.188 25294 1573 1 4 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.059 -1.850 25294 1574 1 4 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.583 -5.233 25294 1575 1 4 . 1 1 80 80 GLU N N 80 120.378 120.378 121.298 -0.920 25294 1576 1 4 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.313 0.196 25294 1577 1 4 . 1 1 80 80 GLU CA C 80 52.860 52.860 56.353 -3.493 25294 1578 1 4 . 1 1 80 80 GLU CB C 80 29.673 29.673 32.555 -2.882 25294 1579 1 4 . 1 1 81 81 LEU N N 81 125.771 125.771 125.577 0.194 25294 1580 1 4 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.506 -0.540 25294 1581 1 4 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.102 -3.088 25294 1582 1 4 . 1 1 81 81 LEU CB C 81 42.550 42.550 46.021 -3.471 25294 1583 1 4 . 1 1 82 82 LYS N N 82 128.076 128.076 127.023 1.053 25294 1584 1 4 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.185 0.060 25294 1585 1 4 . 1 1 82 82 LYS CA C 82 52.332 52.332 55.187 -2.855 25294 1586 1 4 . 1 1 82 82 LYS CB C 82 32.179 32.179 34.569 -2.390 25294 1587 1 4 . 1 1 83 83 VAL N N 83 124.216 124.216 125.913 -1.697 25294 1588 1 4 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.743 0.165 25294 1589 1 4 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.144 -1.764 25294 1590 1 4 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.400 -2.232 25294 1591 1 4 . 1 1 84 84 ILE N N 84 129.084 129.084 128.793 0.291 25294 1592 1 4 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.275 0.255 25294 1593 1 4 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.998 -1.592 25294 1594 1 4 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.207 -3.041 25294 1595 1 4 . 1 1 85 85 ILE N N 85 127.360 127.360 125.421 1.939 25294 1596 1 4 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.415 0.170 25294 1597 1 4 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.802 -1.342 25294 1598 1 4 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.800 -2.302 25294 1599 1 4 . 1 1 86 86 ASN N N 86 128.337 128.337 123.046 5.291 25294 1600 1 4 . 1 1 86 86 ASN HA H 86 4.766 4.766 5.071 -0.305 25294 1601 1 4 . 1 1 86 86 ASN CA C 86 50.182 50.182 51.802 -1.620 25294 1602 1 4 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.915 -4.024 25294 1603 1 4 . 1 1 87 87 ARG N N 87 119.368 119.368 119.902 -0.534 25294 1604 1 4 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.342 -0.351 25294 1605 1 4 . 1 1 87 87 ARG CA C 87 54.198 54.198 55.830 -1.631 25294 1606 1 4 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.677 -2.274 25294 1607 1 4 . 1 1 88 88 ASN N N 88 125.082 125.082 125.318 -0.236 25294 1608 1 4 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.416 0.309 25294 1609 1 4 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.422 -4.319 25294 1610 1 4 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.716 -3.959 25294 1611 1 4 . 1 1 89 89 GLU N N 89 125.309 125.309 123.203 2.106 25294 1612 1 4 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.342 0.016 25294 1613 1 4 . 1 1 89 89 GLU CA C 89 53.013 53.013 55.816 -2.803 25294 1614 1 4 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.162 -2.078 25294 1615 1 4 . 1 1 90 90 THR N N 90 112.516 112.516 111.289 1.227 25294 1616 1 4 . 1 1 90 90 THR HA H 90 4.534 4.534 4.580 -0.046 25294 1617 1 4 . 1 1 90 90 THR CA C 90 58.161 58.161 60.049 -1.888 25294 1618 1 4 . 1 1 90 90 THR CB C 90 68.409 68.409 72.248 -3.839 25294 1619 1 4 . 1 1 91 91 ASN N N 91 116.717 116.717 119.786 -3.069 25294 1620 1 4 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.823 -0.116 25294 1621 1 4 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.664 -3.868 25294 1622 1 4 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.201 -2.727 25294 1623 1 4 . 1 1 92 92 ALA N N 92 122.025 122.025 123.123 -1.098 25294 1624 1 4 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.528 0.108 25294 1625 1 4 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.921 -2.872 25294 1626 1 4 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.033 -0.317 25294 1627 1 4 . 1 1 93 93 SER N N 93 115.895 115.895 119.494 -3.599 25294 1628 1 4 . 1 1 93 93 SER HA H 93 4.536 4.536 4.597 -0.061 25294 1629 1 4 . 1 1 93 93 SER CA C 93 54.865 54.865 58.733 -3.868 25294 1630 1 4 . 1 1 93 93 SER CB C 93 61.292 61.292 64.317 -3.025 25294 1631 1 4 . 1 1 94 94 ARG N N 94 119.529 119.529 118.655 0.874 25294 1632 1 4 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.957 -0.043 25294 1633 1 4 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.660 -2.563 25294 1634 1 4 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.153 -3.641 25294 1635 1 4 . 1 1 95 95 SER N N 95 114.542 114.542 113.505 1.037 25294 1636 1 4 . 1 1 95 95 SER HA H 95 5.926 5.926 5.364 0.562 25294 1637 1 4 . 1 1 95 95 SER CA C 95 54.219 54.219 58.164 -3.945 25294 1638 1 4 . 1 1 95 95 SER CB C 95 65.271 65.271 66.483 -1.212 25294 1639 1 4 . 1 1 96 96 PHE N N 96 117.183 117.183 120.084 -2.901 25294 1640 1 4 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.228 0.110 25294 1641 1 4 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.526 -2.046 25294 1642 1 4 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.827 -4.959 25294 1643 1 4 . 1 1 97 97 THR N N 97 115.263 115.263 117.600 -2.337 25294 1644 1 4 . 1 1 97 97 THR HA H 97 5.250 5.250 4.942 0.308 25294 1645 1 4 . 1 1 97 97 THR CA C 97 58.178 58.178 62.043 -3.865 25294 1646 1 4 . 1 1 97 97 THR CB C 97 69.068 69.068 70.715 -1.647 25294 1647 1 4 . 1 1 98 98 VAL N N 98 125.442 125.442 127.301 -1.859 25294 1648 1 4 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.460 0.397 25294 1649 1 4 . 1 1 98 98 VAL CA C 98 57.409 57.409 61.757 -4.348 25294 1650 1 4 . 1 1 98 98 VAL CB C 98 32.929 32.929 32.411 0.518 25294 1651 1 4 . 1 1 99 99 CYS N N 99 127.111 127.111 124.261 2.850 25294 1652 1 4 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.358 -0.012 25294 1653 1 4 . 1 1 99 99 CYS CA C 99 53.951 53.951 55.521 -1.570 25294 1654 1 4 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.907 -4.965 25294 1655 1 4 . 1 1 100 100 VAL N N 100 120.146 120.146 113.355 6.791 25294 1656 1 4 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.053 0.330 25294 1657 1 4 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.639 -3.926 25294 1658 1 4 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.829 -3.186 25294 1659 1 4 . 1 1 101 101 GLU N N 101 118.807 118.807 119.982 -1.175 25294 1660 1 4 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.870 -0.118 25294 1661 1 4 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.870 -2.435 25294 1662 1 4 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.656 -1.935 25294 1663 1 4 . 1 1 102 102 ALA N N 102 124.088 124.088 123.976 0.112 25294 1664 1 4 . 1 1 102 102 ALA HA H 102 3.857 3.857 5.212 -1.355 25294 1665 1 4 . 1 1 102 102 ALA CA C 102 47.878 47.878 51.030 -3.152 25294 1666 1 4 . 1 1 102 102 ALA CB C 102 18.025 18.025 20.834 -2.809 25294 1667 1 4 . 1 1 103 103 GLY N N 103 111.186 111.186 109.488 1.698 25294 1668 1 4 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.831 -1.188 25294 1669 1 4 . 1 1 104 104 ASN N N 104 123.092 123.092 122.087 1.005 25294 1670 1 4 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.942 -0.270 25294 1671 1 4 . 1 1 104 104 ASN CA C 104 50.696 50.696 52.789 -2.093 25294 1672 1 4 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.702 -3.295 25294 1673 1 4 . 1 1 105 105 ALA N N 105 122.653 122.653 119.449 3.204 25294 1674 1 4 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.131 0.300 25294 1675 1 4 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.464 -2.796 25294 1676 1 4 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.015 -2.079 25294 1677 1 4 . 1 1 106 106 PHE N N 106 116.011 116.011 114.514 1.497 25294 1678 1 4 . 1 1 106 106 PHE HA H 106 5.417 5.417 4.811 0.606 25294 1679 1 4 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.003 -2.445 25294 1680 1 4 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.182 -1.698 25294 1681 1 4 . 1 1 107 107 ASP N N 107 121.992 121.992 120.125 1.867 25294 1682 1 4 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.925 -0.331 25294 1683 1 4 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.550 -2.026 25294 1684 1 4 . 1 1 107 107 ASP CB C 107 43.091 43.091 45.520 -2.429 25294 1685 1 4 . 1 1 108 108 GLU N N 108 119.354 119.354 121.565 -2.211 25294 1686 1 4 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.446 0.563 25294 1687 1 4 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.586 -3.598 25294 1688 1 4 . 1 1 108 108 GLU CB C 108 31.317 31.317 31.730 -0.413 25294 1689 1 4 . 1 1 109 109 PHE N N 109 122.098 122.098 125.205 -3.107 25294 1690 1 4 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.915 0.043 25294 1691 1 4 . 1 1 109 109 PHE CA C 109 52.787 52.787 55.541 -2.754 25294 1692 1 4 . 1 1 109 109 PHE CB C 109 40.443 40.443 39.637 0.806 25294 1693 1 4 . 1 1 110 110 LYS N N 110 124.500 124.500 123.923 0.577 25294 1694 1 4 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.775 -0.083 25294 1695 1 4 . 1 1 110 110 LYS CA C 110 51.891 51.891 56.873 -4.982 25294 1696 1 4 . 1 1 110 110 LYS CB C 110 33.012 33.012 33.812 -0.800 25294 1697 1 4 . 1 1 111 111 PHE N N 111 125.010 125.010 120.809 4.201 25294 1698 1 4 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.294 -0.540 25294 1699 1 4 . 1 1 111 111 PHE CA C 111 58.184 58.184 56.886 1.298 25294 1700 1 4 . 1 1 111 111 PHE CB C 111 38.380 38.380 44.043 -5.663 25294 1701 1 4 . 1 1 112 112 VAL N N 112 122.957 122.957 122.208 0.749 25294 1702 1 4 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.960 -0.520 25294 1703 1 4 . 1 1 112 112 VAL CA C 112 58.256 58.256 59.767 -1.511 25294 1704 1 4 . 1 1 112 112 VAL CB C 112 31.093 31.093 34.807 -3.714 25294 1705 1 4 . 1 1 113 113 GLN N N 113 130.864 130.864 129.434 1.430 25294 1706 1 4 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.143 0.176 25294 1707 1 4 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.395 -3.276 25294 1708 1 4 . 1 1 113 113 GLN CB C 113 28.164 28.164 30.746 -2.582 25294 1709 1 4 . 1 1 114 114 ASP N N 114 126.272 126.272 128.249 -1.977 25294 1710 1 4 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.608 -0.281 25294 1711 1 4 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.449 -3.676 25294 1712 1 4 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.336 -3.481 25294 1713 1 4 . 1 1 115 115 ALA N N 115 120.134 120.134 121.939 -1.805 25294 1714 1 4 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.376 -0.677 25294 1715 1 4 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.867 -2.966 25294 1716 1 4 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.723 -1.972 25294 1717 1 4 . 1 1 116 116 ALA N N 116 121.377 121.377 124.907 -3.530 25294 1718 1 4 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.291 -0.338 25294 1719 1 4 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.410 -2.422 25294 1720 1 4 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.790 -3.590 25294 1721 1 4 . 1 1 117 117 LYS N N 117 121.536 121.536 123.019 -1.483 25294 1722 1 4 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.529 -0.390 25294 1723 1 4 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.915 -2.269 25294 1724 1 4 . 1 1 117 117 LYS CB C 117 30.579 30.579 32.317 -1.738 25294 1725 1 5 . 1 1 5 5 SER N N 5 116.267 116.267 114.423 1.844 25294 1726 1 5 . 1 1 5 5 SER HA H 5 4.349 4.349 4.651 -0.302 25294 1727 1 5 . 1 1 5 5 SER CA C 5 55.478 55.478 58.292 -2.814 25294 1728 1 5 . 1 1 5 5 SER CB C 5 61.191 61.191 64.130 -2.939 25294 1729 1 5 . 1 1 6 6 ASP N N 6 123.039 123.039 122.150 0.889 25294 1730 1 5 . 1 1 6 6 ASP HA H 6 4.827 4.827 5.105 -0.278 25294 1731 1 5 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.158 -2.487 25294 1732 1 5 . 1 1 6 6 ASP CB C 6 38.656 38.656 40.723 -2.067 25294 1733 1 5 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.371 -0.054 25294 1734 1 5 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.454 -3.307 25294 1735 1 5 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.336 -2.858 25294 1736 1 5 . 1 1 8 8 ASP N N 8 119.159 119.159 116.301 2.858 25294 1737 1 5 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.718 -0.153 25294 1738 1 5 . 1 1 8 8 ASP CA C 8 51.860 51.860 53.925 -2.065 25294 1739 1 5 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.726 -3.001 25294 1740 1 5 . 1 1 9 9 GLY N N 9 108.837 108.837 108.171 0.666 25294 1741 1 5 . 1 1 9 9 GLY CA C 9 43.136 43.136 44.975 -1.839 25294 1742 1 5 . 1 1 10 10 LEU N N 10 121.571 121.571 119.501 2.070 25294 1743 1 5 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.464 -0.197 25294 1744 1 5 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.225 -1.834 25294 1745 1 5 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.804 -2.941 25294 1746 1 5 . 1 1 11 11 ALA N N 11 125.169 125.169 123.386 1.783 25294 1747 1 5 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.455 -0.119 25294 1748 1 5 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.466 -2.482 25294 1749 1 5 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.551 -2.369 25294 1750 1 5 . 1 1 12 12 ASP N N 12 122.672 122.672 123.288 -0.616 25294 1751 1 5 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.063 -0.327 25294 1752 1 5 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.527 -1.825 25294 1753 1 5 . 1 1 12 12 ASP CB C 12 37.831 37.831 42.885 -5.054 25294 1754 1 5 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.545 -0.241 25294 1755 1 5 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.463 -2.863 25294 1756 1 5 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.833 -3.317 25294 1757 1 5 . 1 1 14 14 MET N N 14 120.151 120.151 120.066 0.085 25294 1758 1 5 . 1 1 14 14 MET HA H 14 3.780 3.780 4.431 -0.651 25294 1759 1 5 . 1 1 14 14 MET CA C 14 55.822 55.822 55.664 0.157 25294 1760 1 5 . 1 1 14 14 MET CB C 14 30.909 30.909 31.618 -0.709 25294 1761 1 5 . 1 1 15 15 LYS N N 15 123.897 123.897 124.429 -0.532 25294 1762 1 5 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.253 0.204 25294 1763 1 5 . 1 1 15 15 LYS CA C 15 51.407 51.407 56.401 -4.994 25294 1764 1 5 . 1 1 15 15 LYS CB C 15 32.453 32.453 33.121 -0.668 25294 1765 1 5 . 1 1 16 16 TRP N N 16 125.776 125.776 125.648 0.128 25294 1766 1 5 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.184 -0.109 25294 1767 1 5 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.603 -2.951 25294 1768 1 5 . 1 1 16 16 TRP CB C 16 28.000 28.000 31.278 -3.278 25294 1769 1 5 . 1 1 17 17 SER N N 17 120.772 120.772 116.201 4.571 25294 1770 1 5 . 1 1 17 17 SER HA H 17 4.403 4.403 4.659 -0.256 25294 1771 1 5 . 1 1 17 17 SER CA C 17 56.167 56.167 58.629 -2.462 25294 1772 1 5 . 1 1 17 17 SER CB C 17 60.833 60.833 64.535 -3.702 25294 1773 1 5 . 1 1 18 18 LYS N N 18 121.096 121.096 122.729 -1.633 25294 1774 1 5 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.647 0.071 25294 1775 1 5 . 1 1 18 18 LYS CA C 18 53.735 53.735 56.102 -2.367 25294 1776 1 5 . 1 1 18 18 LYS CB C 18 32.917 32.917 34.641 -1.724 25294 1777 1 5 . 1 1 19 19 VAL N N 19 116.358 116.358 120.391 -4.033 25294 1778 1 5 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.663 -0.240 25294 1779 1 5 . 1 1 19 19 VAL CA C 19 55.230 55.230 57.407 -2.177 25294 1780 1 5 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.286 -3.260 25294 1781 1 5 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.495 -0.192 25294 1782 1 5 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.489 -2.720 25294 1783 1 5 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.328 -2.775 25294 1784 1 5 . 1 1 21 21 SER N N 21 118.882 118.882 116.911 1.971 25294 1785 1 5 . 1 1 21 21 SER HA H 21 4.084 4.084 4.300 -0.216 25294 1786 1 5 . 1 1 21 21 SER CA C 21 57.657 57.657 59.972 -2.316 25294 1787 1 5 . 1 1 21 21 SER CB C 21 60.173 60.173 62.966 -2.793 25294 1788 1 5 . 1 1 22 22 GLY N N 22 109.523 109.523 110.588 -1.065 25294 1789 1 5 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.805 -2.401 25294 1790 1 5 . 1 1 23 23 LEU N N 23 123.003 123.003 122.302 0.701 25294 1791 1 5 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.371 -0.337 25294 1792 1 5 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.307 -1.704 25294 1793 1 5 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.565 -2.494 25294 1794 1 5 . 1 1 24 24 LYS N N 24 129.004 129.004 127.077 1.927 25294 1795 1 5 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.486 0.024 25294 1796 1 5 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.257 -2.019 25294 1797 1 5 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.025 -0.864 25294 1798 1 5 . 1 1 25 25 ASN N N 25 126.336 126.336 121.428 4.908 25294 1799 1 5 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.412 -0.088 25294 1800 1 5 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.997 -2.377 25294 1801 1 5 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.440 -3.455 25294 1802 1 5 . 1 1 26 26 GLY N N 26 103.076 103.076 102.367 0.709 25294 1803 1 5 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.793 -1.244 25294 1804 1 5 . 1 1 27 27 GLU N N 27 120.878 120.878 124.004 -3.126 25294 1805 1 5 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.790 0.412 25294 1806 1 5 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.697 -4.464 25294 1807 1 5 . 1 1 27 27 GLU CB C 27 30.761 30.761 30.829 -0.068 25294 1808 1 5 . 1 1 28 28 LEU N N 28 128.583 128.583 128.452 0.131 25294 1809 1 5 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.664 -0.109 25294 1810 1 5 . 1 1 28 28 LEU CA C 28 50.324 50.324 52.779 -2.455 25294 1811 1 5 . 1 1 28 28 LEU CB C 28 43.517 43.517 41.993 1.524 25294 1812 1 5 . 1 1 29 29 LYS N N 29 127.554 127.554 125.531 2.023 25294 1813 1 5 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.454 0.447 25294 1814 1 5 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.609 -3.770 25294 1815 1 5 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.626 -3.103 25294 1816 1 5 . 1 1 30 30 VAL N N 30 127.915 127.915 123.667 4.248 25294 1817 1 5 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.477 -0.293 25294 1818 1 5 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.340 -2.032 25294 1819 1 5 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.798 -3.528 25294 1820 1 5 . 1 1 31 31 GLU N N 31 125.151 125.151 123.489 1.662 25294 1821 1 5 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.737 -0.376 25294 1822 1 5 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.581 -0.481 25294 1823 1 5 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.473 -3.770 25294 1824 1 5 . 1 1 32 32 ALA N N 32 126.271 126.271 120.267 6.004 25294 1825 1 5 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.166 -0.150 25294 1826 1 5 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.360 -1.233 25294 1827 1 5 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.449 -3.183 25294 1828 1 5 . 1 1 33 33 GLU N N 33 113.076 113.076 115.336 -2.260 25294 1829 1 5 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.329 -0.364 25294 1830 1 5 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.142 -0.157 25294 1831 1 5 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.431 -3.502 25294 1832 1 5 . 1 1 34 34 GLY N N 34 104.905 104.905 106.713 -1.808 25294 1833 1 5 . 1 1 34 34 GLY CA C 34 40.707 40.707 44.761 -4.054 25294 1834 1 5 . 1 1 35 35 GLY N N 35 105.946 105.946 105.072 0.874 25294 1835 1 5 . 1 1 35 35 GLY CA C 35 42.988 42.988 45.368 -2.381 25294 1836 1 5 . 1 1 36 36 SER N N 36 116.044 116.044 114.671 1.373 25294 1837 1 5 . 1 1 36 36 SER HA H 36 5.539 5.539 5.507 0.032 25294 1838 1 5 . 1 1 36 36 SER CA C 36 54.323 54.323 57.242 -2.919 25294 1839 1 5 . 1 1 36 36 SER CB C 36 62.808 62.808 66.037 -3.229 25294 1840 1 5 . 1 1 37 37 SER N N 37 119.501 119.501 120.831 -1.330 25294 1841 1 5 . 1 1 37 37 SER HA H 37 4.712 4.712 4.780 -0.068 25294 1842 1 5 . 1 1 37 37 SER CA C 37 55.548 55.548 57.781 -2.233 25294 1843 1 5 . 1 1 37 37 SER CB C 37 63.943 63.943 66.629 -2.686 25294 1844 1 5 . 1 1 38 38 LEU N N 38 125.962 125.962 125.064 0.898 25294 1845 1 5 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.101 0.152 25294 1846 1 5 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.589 -2.807 25294 1847 1 5 . 1 1 38 38 LEU CB C 38 42.834 42.834 44.997 -2.163 25294 1848 1 5 . 1 1 39 39 PHE N N 39 124.707 124.707 125.902 -1.195 25294 1849 1 5 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.194 -0.055 25294 1850 1 5 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.498 -3.367 25294 1851 1 5 . 1 1 39 39 PHE CB C 39 38.952 38.952 39.415 -0.463 25294 1852 1 5 . 1 1 40 40 ALA N N 40 124.994 124.994 126.294 -1.300 25294 1853 1 5 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.001 0.634 25294 1854 1 5 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.605 -2.304 25294 1855 1 5 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.445 0.001 25294 1856 1 5 . 1 1 41 41 CYS N N 41 125.757 125.757 125.328 0.429 25294 1857 1 5 . 1 1 41 41 CYS HA H 41 4.146 4.146 3.869 0.277 25294 1858 1 5 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.555 -3.090 25294 1859 1 5 . 1 1 41 41 CYS CB C 41 25.973 25.973 28.377 -2.404 25294 1860 1 5 . 1 1 42 42 LYS N N 42 129.019 129.019 127.421 1.598 25294 1861 1 5 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.366 -0.106 25294 1862 1 5 . 1 1 42 42 LYS CA C 42 54.851 54.851 56.964 -2.113 25294 1863 1 5 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.968 -0.861 25294 1864 1 5 . 1 1 43 43 ASN N N 43 113.240 113.240 115.553 -2.313 25294 1865 1 5 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.599 -0.074 25294 1866 1 5 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.466 -3.231 25294 1867 1 5 . 1 1 43 43 ASN CB C 43 34.861 34.861 40.599 -5.738 25294 1868 1 5 . 1 1 44 44 TYR N N 44 119.335 119.335 118.301 1.034 25294 1869 1 5 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.566 -0.009 25294 1870 1 5 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.604 -1.886 25294 1871 1 5 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.818 -4.446 25294 1872 1 5 . 1 1 45 45 LYS N N 45 120.676 120.676 123.340 -2.664 25294 1873 1 5 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.702 -0.666 25294 1874 1 5 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.352 -1.814 25294 1875 1 5 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.673 -2.440 25294 1876 1 5 . 1 1 46 46 SER N N 46 108.797 108.797 114.487 -5.690 25294 1877 1 5 . 1 1 46 46 SER HA H 46 4.388 4.388 4.676 -0.288 25294 1878 1 5 . 1 1 46 46 SER CA C 46 53.664 53.664 58.239 -4.575 25294 1879 1 5 . 1 1 46 46 SER CB C 46 61.810 61.810 63.733 -1.923 25294 1880 1 5 . 1 1 47 47 PHE N N 47 117.325 117.325 119.502 -2.177 25294 1881 1 5 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.261 -0.619 25294 1882 1 5 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.893 -3.276 25294 1883 1 5 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.448 -5.347 25294 1884 1 5 . 1 1 48 48 TRP N N 48 117.090 117.090 117.927 -0.837 25294 1885 1 5 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.134 0.101 25294 1886 1 5 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.154 -1.662 25294 1887 1 5 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.155 -1.260 25294 1888 1 5 . 1 1 49 49 ILE N N 49 119.682 119.682 121.828 -2.146 25294 1889 1 5 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.324 -0.293 25294 1890 1 5 . 1 1 49 49 ILE CA C 49 60.473 60.473 60.806 -0.333 25294 1891 1 5 . 1 1 49 49 ILE CB C 49 36.436 36.436 35.712 0.724 25294 1892 1 5 . 1 1 50 50 SER N N 50 124.071 124.071 124.266 -0.195 25294 1893 1 5 . 1 1 50 50 SER HA H 50 4.708 4.708 4.764 -0.056 25294 1894 1 5 . 1 1 50 50 SER CA C 50 56.110 56.110 60.320 -4.210 25294 1895 1 5 . 1 1 50 50 SER CB C 50 63.816 63.816 64.176 -0.360 25294 1896 1 5 . 1 1 51 51 SER N N 51 111.253 111.253 116.073 -4.820 25294 1897 1 5 . 1 1 51 51 SER HA H 51 4.557 4.557 4.579 -0.022 25294 1898 1 5 . 1 1 51 51 SER CA C 51 55.564 55.564 56.995 -1.431 25294 1899 1 5 . 1 1 51 51 SER CB C 51 62.821 62.821 66.104 -3.283 25294 1900 1 5 . 1 1 52 52 VAL N N 52 121.147 121.147 121.613 -0.466 25294 1901 1 5 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.819 -0.088 25294 1902 1 5 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.398 -0.272 25294 1903 1 5 . 1 1 52 52 VAL CB C 52 32.500 32.500 34.583 -2.083 25294 1904 1 5 . 1 1 53 53 LYS N N 53 126.128 126.128 126.020 0.108 25294 1905 1 5 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.980 0.027 25294 1906 1 5 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.820 -3.097 25294 1907 1 5 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.920 -2.148 25294 1908 1 5 . 1 1 54 54 GLU N N 54 124.160 124.160 123.262 0.898 25294 1909 1 5 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.734 1.024 25294 1910 1 5 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.812 -2.553 25294 1911 1 5 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.919 -0.860 25294 1912 1 5 . 1 1 55 55 GLU N N 55 127.218 127.218 118.010 9.208 25294 1913 1 5 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.401 -0.493 25294 1914 1 5 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.515 -1.969 25294 1915 1 5 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.867 -5.573 25294 1916 1 5 . 1 1 56 56 GLY N N 56 104.894 104.894 107.733 -2.839 25294 1917 1 5 . 1 1 56 56 GLY CA C 56 42.881 42.881 45.095 -2.214 25294 1918 1 5 . 1 1 57 57 LYS N N 57 120.444 120.444 117.459 2.985 25294 1919 1 5 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.799 -0.235 25294 1920 1 5 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.456 -2.497 25294 1921 1 5 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.591 -2.403 25294 1922 1 5 . 1 1 58 58 PHE N N 58 121.824 121.824 119.117 2.707 25294 1923 1 5 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.412 -0.641 25294 1924 1 5 . 1 1 58 58 PHE CA C 58 56.165 56.165 55.514 0.651 25294 1925 1 5 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.721 -3.819 25294 1926 1 5 . 1 1 59 59 LYS N N 59 123.205 123.205 123.812 -0.607 25294 1927 1 5 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.786 -0.335 25294 1928 1 5 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.951 -3.966 25294 1929 1 5 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.070 -4.279 25294 1930 1 5 . 1 1 60 60 GLU N N 60 122.647 122.647 118.627 4.020 25294 1931 1 5 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.570 -0.310 25294 1932 1 5 . 1 1 60 60 GLU CA C 60 53.906 53.906 54.818 -0.912 25294 1933 1 5 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.895 -3.232 25294 1934 1 5 . 1 1 61 61 ASN N N 61 119.907 119.907 117.453 2.454 25294 1935 1 5 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.184 -0.339 25294 1936 1 5 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.423 -2.671 25294 1937 1 5 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.130 -4.107 25294 1938 1 5 . 1 1 62 62 THR N N 62 113.271 113.271 112.527 0.744 25294 1939 1 5 . 1 1 62 62 THR HA H 62 4.308 4.308 4.442 -0.134 25294 1940 1 5 . 1 1 62 62 THR CA C 62 59.310 59.310 62.520 -3.210 25294 1941 1 5 . 1 1 62 62 THR CB C 62 66.813 66.813 69.287 -2.474 25294 1942 1 5 . 1 1 63 63 SER N N 63 116.521 116.521 114.646 1.875 25294 1943 1 5 . 1 1 63 63 SER HA H 63 4.650 4.650 4.673 -0.023 25294 1944 1 5 . 1 1 63 63 SER CA C 63 54.094 54.094 57.985 -3.891 25294 1945 1 5 . 1 1 63 63 SER CB C 63 61.617 61.617 64.604 -2.987 25294 1946 1 5 . 1 1 64 64 TYR N N 64 120.183 120.183 120.228 -0.045 25294 1947 1 5 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.730 0.108 25294 1948 1 5 . 1 1 64 64 TYR CA C 64 56.403 56.403 59.483 -3.080 25294 1949 1 5 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.831 -3.262 25294 1950 1 5 . 1 1 65 65 LYS N N 65 115.195 115.195 115.670 -0.475 25294 1951 1 5 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.625 0.096 25294 1952 1 5 . 1 1 65 65 LYS CA C 65 52.706 52.706 55.691 -2.985 25294 1953 1 5 . 1 1 65 65 LYS CB C 65 31.820 31.820 33.460 -1.640 25294 1954 1 5 . 1 1 66 66 GLU N N 66 117.231 117.231 120.143 -2.912 25294 1955 1 5 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.059 0.154 25294 1956 1 5 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.447 -2.834 25294 1957 1 5 . 1 1 66 66 GLU CB C 66 30.793 30.793 32.906 -2.113 25294 1958 1 5 . 1 1 67 67 PHE N N 67 121.532 121.532 123.095 -1.563 25294 1959 1 5 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.805 -0.375 25294 1960 1 5 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.385 -1.116 25294 1961 1 5 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.412 -2.137 25294 1962 1 5 . 1 1 68 68 ASP N N 68 128.157 128.157 126.176 1.981 25294 1963 1 5 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.972 -0.544 25294 1964 1 5 . 1 1 68 68 ASP CA C 68 49.556 49.556 51.932 -2.376 25294 1965 1 5 . 1 1 68 68 ASP CB C 68 38.424 38.424 43.368 -4.944 25294 1966 1 5 . 1 1 69 69 GLY N N 69 114.151 114.151 108.561 5.590 25294 1967 1 5 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.394 -3.495 25294 1968 1 5 . 1 1 70 70 GLY N N 70 113.714 113.714 111.015 2.699 25294 1969 1 5 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.850 -1.856 25294 1970 1 5 . 1 1 71 71 TRP N N 71 117.823 117.823 120.666 -2.843 25294 1971 1 5 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.534 0.274 25294 1972 1 5 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.405 -3.628 25294 1973 1 5 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.857 -4.212 25294 1974 1 5 . 1 1 72 72 TYR N N 72 114.204 114.204 120.373 -6.169 25294 1975 1 5 . 1 1 72 72 TYR HA H 72 5.125 5.125 5.162 -0.037 25294 1976 1 5 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.688 -5.253 25294 1977 1 5 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.656 -2.036 25294 1978 1 5 . 1 1 73 73 LEU N N 73 121.469 121.469 127.838 -6.369 25294 1979 1 5 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.778 -0.011 25294 1980 1 5 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.858 -2.526 25294 1981 1 5 . 1 1 73 73 LEU CB C 73 43.403 43.403 45.379 -1.976 25294 1982 1 5 . 1 1 74 74 VAL N N 74 124.558 124.558 126.080 -1.522 25294 1983 1 5 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.367 0.416 25294 1984 1 5 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.478 -3.666 25294 1985 1 5 . 1 1 74 74 VAL CB C 74 31.820 31.820 32.174 -0.354 25294 1986 1 5 . 1 1 75 75 LYS N N 75 125.824 125.824 127.660 -1.836 25294 1987 1 5 . 1 1 75 75 LYS HA H 75 5.110 5.110 4.973 0.137 25294 1988 1 5 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.226 -2.422 25294 1989 1 5 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.121 -1.546 25294 1990 1 5 . 1 1 76 76 ILE N N 76 124.647 124.647 127.262 -2.615 25294 1991 1 5 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.404 0.674 25294 1992 1 5 . 1 1 76 76 ILE CA C 76 57.367 57.367 61.419 -4.052 25294 1993 1 5 . 1 1 76 76 ILE CB C 76 37.593 37.593 38.052 -0.459 25294 1994 1 5 . 1 1 77 77 GLU N N 77 128.081 128.081 128.770 -0.689 25294 1995 1 5 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.602 -0.158 25294 1996 1 5 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.111 -2.640 25294 1997 1 5 . 1 1 77 77 GLU CB C 77 29.914 29.914 32.303 -2.389 25294 1998 1 5 . 1 1 78 78 ASP N N 78 126.158 126.158 126.213 -0.055 25294 1999 1 5 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.194 -0.094 25294 2000 1 5 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.125 -3.062 25294 2001 1 5 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.405 -3.667 25294 2002 1 5 . 1 1 79 79 ASN N N 79 118.653 118.653 117.032 1.621 25294 2003 1 5 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.874 -0.228 25294 2004 1 5 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.081 -1.872 25294 2005 1 5 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.550 -5.200 25294 2006 1 5 . 1 1 80 80 GLU N N 80 120.378 120.378 122.076 -1.698 25294 2007 1 5 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.236 0.273 25294 2008 1 5 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.225 -2.365 25294 2009 1 5 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.790 -1.117 25294 2010 1 5 . 1 1 81 81 LEU N N 81 125.771 125.771 129.696 -3.925 25294 2011 1 5 . 1 1 81 81 LEU HA H 81 4.966 4.966 4.570 0.396 25294 2012 1 5 . 1 1 81 81 LEU CA C 81 51.014 51.014 55.809 -4.795 25294 2013 1 5 . 1 1 81 81 LEU CB C 81 42.550 42.550 42.817 -0.267 25294 2014 1 5 . 1 1 82 82 LYS N N 82 128.076 128.076 127.337 0.739 25294 2015 1 5 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.549 -0.304 25294 2016 1 5 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.587 -2.255 25294 2017 1 5 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.205 -4.026 25294 2018 1 5 . 1 1 83 83 VAL N N 83 124.216 124.216 118.281 5.935 25294 2019 1 5 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.084 -0.176 25294 2020 1 5 . 1 1 83 83 VAL CA C 83 58.380 58.380 58.890 -0.510 25294 2021 1 5 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.882 -2.714 25294 2022 1 5 . 1 1 84 84 ILE N N 84 129.084 129.084 124.137 4.947 25294 2023 1 5 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.787 -0.257 25294 2024 1 5 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.993 -1.587 25294 2025 1 5 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.353 -3.187 25294 2026 1 5 . 1 1 85 85 ILE N N 85 127.360 127.360 124.911 2.449 25294 2027 1 5 . 1 1 85 85 ILE HA H 85 4.585 4.585 5.000 -0.415 25294 2028 1 5 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.589 -1.129 25294 2029 1 5 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.117 -1.619 25294 2030 1 5 . 1 1 86 86 ASN N N 86 128.337 128.337 124.488 3.849 25294 2031 1 5 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.930 -0.164 25294 2032 1 5 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.126 -2.944 25294 2033 1 5 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.163 -3.272 25294 2034 1 5 . 1 1 87 87 ARG N N 87 119.368 119.368 119.620 -0.252 25294 2035 1 5 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.217 -0.226 25294 2036 1 5 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.981 -2.783 25294 2037 1 5 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.570 -2.167 25294 2038 1 5 . 1 1 88 88 ASN N N 88 125.082 125.082 123.233 1.849 25294 2039 1 5 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.675 0.050 25294 2040 1 5 . 1 1 88 88 ASN CA C 88 49.103 49.103 52.737 -3.634 25294 2041 1 5 . 1 1 88 88 ASN CB C 88 34.757 34.757 39.717 -4.960 25294 2042 1 5 . 1 1 89 89 GLU N N 89 125.309 125.309 120.910 4.399 25294 2043 1 5 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.318 0.040 25294 2044 1 5 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.357 -3.344 25294 2045 1 5 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.898 -2.814 25294 2046 1 5 . 1 1 90 90 THR N N 90 112.516 112.516 111.704 0.812 25294 2047 1 5 . 1 1 90 90 THR HA H 90 4.534 4.534 4.581 -0.047 25294 2048 1 5 . 1 1 90 90 THR CA C 90 58.161 58.161 60.042 -1.881 25294 2049 1 5 . 1 1 90 90 THR CB C 90 68.409 68.409 71.944 -3.535 25294 2050 1 5 . 1 1 91 91 ASN N N 91 116.717 116.717 119.876 -3.159 25294 2051 1 5 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.805 -0.098 25294 2052 1 5 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.885 -4.089 25294 2053 1 5 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.214 -2.740 25294 2054 1 5 . 1 1 92 92 ALA N N 92 122.025 122.025 121.942 0.083 25294 2055 1 5 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.568 0.068 25294 2056 1 5 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.278 -2.229 25294 2057 1 5 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.272 -0.556 25294 2058 1 5 . 1 1 93 93 SER N N 93 115.895 115.895 120.173 -4.278 25294 2059 1 5 . 1 1 93 93 SER HA H 93 4.536 4.536 4.615 -0.079 25294 2060 1 5 . 1 1 93 93 SER CA C 93 54.865 54.865 58.434 -3.569 25294 2061 1 5 . 1 1 93 93 SER CB C 93 61.292 61.292 64.240 -2.948 25294 2062 1 5 . 1 1 94 94 ARG N N 94 119.529 119.529 118.487 1.042 25294 2063 1 5 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.820 0.094 25294 2064 1 5 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.577 -2.481 25294 2065 1 5 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.198 -3.686 25294 2066 1 5 . 1 1 95 95 SER N N 95 114.542 114.542 113.374 1.168 25294 2067 1 5 . 1 1 95 95 SER HA H 95 5.926 5.926 4.966 0.960 25294 2068 1 5 . 1 1 95 95 SER CA C 95 54.219 54.219 57.291 -3.072 25294 2069 1 5 . 1 1 95 95 SER CB C 95 65.271 65.271 65.987 -0.716 25294 2070 1 5 . 1 1 96 96 PHE N N 96 117.183 117.183 118.486 -1.303 25294 2071 1 5 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.194 0.144 25294 2072 1 5 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.643 -2.163 25294 2073 1 5 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.664 -4.796 25294 2074 1 5 . 1 1 97 97 THR N N 97 115.263 115.263 117.758 -2.495 25294 2075 1 5 . 1 1 97 97 THR HA H 97 5.250 5.250 5.246 0.004 25294 2076 1 5 . 1 1 97 97 THR CA C 97 58.178 58.178 61.898 -3.720 25294 2077 1 5 . 1 1 97 97 THR CB C 97 69.068 69.068 71.924 -2.856 25294 2078 1 5 . 1 1 98 98 VAL N N 98 125.442 125.442 119.927 5.515 25294 2079 1 5 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.963 -0.106 25294 2080 1 5 . 1 1 98 98 VAL CA C 98 57.409 57.409 59.532 -2.123 25294 2081 1 5 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.263 -1.334 25294 2082 1 5 . 1 1 99 99 CYS N N 99 127.111 127.111 125.149 1.962 25294 2083 1 5 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.076 0.270 25294 2084 1 5 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.613 -2.662 25294 2085 1 5 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.527 -4.585 25294 2086 1 5 . 1 1 100 100 VAL N N 100 120.146 120.146 122.353 -2.207 25294 2087 1 5 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.293 0.090 25294 2088 1 5 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.367 -3.654 25294 2089 1 5 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.004 -1.361 25294 2090 1 5 . 1 1 101 101 GLU N N 101 118.807 118.807 117.385 1.422 25294 2091 1 5 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.646 0.106 25294 2092 1 5 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.753 -2.318 25294 2093 1 5 . 1 1 101 101 GLU CB C 101 31.721 31.721 32.868 -1.147 25294 2094 1 5 . 1 1 102 102 ALA N N 102 124.088 124.088 123.479 0.609 25294 2095 1 5 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.729 -0.873 25294 2096 1 5 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.432 -2.554 25294 2097 1 5 . 1 1 102 102 ALA CB C 102 18.025 18.025 18.983 -0.958 25294 2098 1 5 . 1 1 103 103 GLY N N 103 111.186 111.186 108.961 2.225 25294 2099 1 5 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.278 -1.635 25294 2100 1 5 . 1 1 104 104 ASN N N 104 123.092 123.092 119.844 3.248 25294 2101 1 5 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.777 -0.105 25294 2102 1 5 . 1 1 104 104 ASN CA C 104 50.696 50.696 52.600 -1.904 25294 2103 1 5 . 1 1 104 104 ASN CB C 104 36.407 36.407 40.358 -3.951 25294 2104 1 5 . 1 1 105 105 ALA N N 105 122.653 122.653 120.568 2.085 25294 2105 1 5 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.335 0.096 25294 2106 1 5 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.636 -2.968 25294 2107 1 5 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.723 -1.787 25294 2108 1 5 . 1 1 106 106 PHE N N 106 116.011 116.011 116.981 -0.970 25294 2109 1 5 . 1 1 106 106 PHE HA H 106 5.417 5.417 4.858 0.559 25294 2110 1 5 . 1 1 106 106 PHE CA C 106 53.558 53.558 57.225 -3.667 25294 2111 1 5 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.416 -1.932 25294 2112 1 5 . 1 1 107 107 ASP N N 107 121.992 121.992 123.331 -1.339 25294 2113 1 5 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.697 -0.103 25294 2114 1 5 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.423 -2.899 25294 2115 1 5 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.310 -1.220 25294 2116 1 5 . 1 1 108 108 GLU N N 108 119.354 119.354 123.382 -4.028 25294 2117 1 5 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.585 0.424 25294 2118 1 5 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.636 -2.648 25294 2119 1 5 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.508 -1.191 25294 2120 1 5 . 1 1 109 109 PHE N N 109 122.098 122.098 124.905 -2.807 25294 2121 1 5 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.838 0.120 25294 2122 1 5 . 1 1 109 109 PHE CA C 109 52.787 52.787 55.196 -2.409 25294 2123 1 5 . 1 1 109 109 PHE CB C 109 40.443 40.443 39.890 0.553 25294 2124 1 5 . 1 1 110 110 LYS N N 110 124.500 124.500 125.349 -0.849 25294 2125 1 5 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.547 0.145 25294 2126 1 5 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.397 -3.506 25294 2127 1 5 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.086 0.926 25294 2128 1 5 . 1 1 111 111 PHE N N 111 125.010 125.010 125.151 -0.141 25294 2129 1 5 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.232 -0.478 25294 2130 1 5 . 1 1 111 111 PHE CA C 111 58.184 58.184 58.047 0.137 25294 2131 1 5 . 1 1 111 111 PHE CB C 111 38.380 38.380 41.063 -2.683 25294 2132 1 5 . 1 1 112 112 VAL N N 112 122.957 122.957 122.279 0.678 25294 2133 1 5 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.638 -0.198 25294 2134 1 5 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.758 -3.502 25294 2135 1 5 . 1 1 112 112 VAL CB C 112 31.093 31.093 33.831 -2.738 25294 2136 1 5 . 1 1 113 113 GLN N N 113 130.864 130.864 127.496 3.368 25294 2137 1 5 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.697 0.622 25294 2138 1 5 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.622 -3.503 25294 2139 1 5 . 1 1 113 113 GLN CB C 113 28.164 28.164 30.877 -2.713 25294 2140 1 5 . 1 1 114 114 ASP N N 114 126.272 126.272 128.284 -2.012 25294 2141 1 5 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.502 -0.175 25294 2142 1 5 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.354 -3.581 25294 2143 1 5 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.192 -2.337 25294 2144 1 5 . 1 1 115 115 ALA N N 115 120.134 120.134 121.808 -1.674 25294 2145 1 5 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.378 -0.679 25294 2146 1 5 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.917 -3.017 25294 2147 1 5 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.699 -1.948 25294 2148 1 5 . 1 1 116 116 ALA N N 116 121.377 121.377 124.362 -2.985 25294 2149 1 5 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.302 -0.349 25294 2150 1 5 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.403 -2.415 25294 2151 1 5 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.757 -3.557 25294 2152 1 5 . 1 1 117 117 LYS N N 117 121.536 121.536 123.914 -2.378 25294 2153 1 5 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.487 -0.348 25294 2154 1 5 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.462 -1.816 25294 2155 1 5 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.541 -0.962 25294 2156 1 6 . 1 1 5 5 SER N N 5 116.267 116.267 115.029 1.238 25294 2157 1 6 . 1 1 5 5 SER HA H 5 4.349 4.349 4.705 -0.356 25294 2158 1 6 . 1 1 5 5 SER CA C 5 55.478 55.478 57.588 -2.110 25294 2159 1 6 . 1 1 5 5 SER CB C 5 61.191 61.191 63.995 -2.804 25294 2160 1 6 . 1 1 6 6 ASP N N 6 123.039 123.039 124.495 -1.456 25294 2161 1 6 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.887 -0.060 25294 2162 1 6 . 1 1 6 6 ASP CA C 6 49.671 49.671 51.884 -2.213 25294 2163 1 6 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.512 -2.856 25294 2164 1 6 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.344 -0.027 25294 2165 1 6 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.315 -3.168 25294 2166 1 6 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.086 -2.608 25294 2167 1 6 . 1 1 8 8 ASP N N 8 119.159 119.159 119.300 -0.141 25294 2168 1 6 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.778 -0.213 25294 2169 1 6 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.432 -2.572 25294 2170 1 6 . 1 1 8 8 ASP CB C 8 38.725 38.725 40.205 -1.480 25294 2171 1 6 . 1 1 9 9 GLY N N 9 108.837 108.837 108.881 -0.044 25294 2172 1 6 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.635 -2.499 25294 2173 1 6 . 1 1 10 10 LEU N N 10 121.571 121.571 118.584 2.987 25294 2174 1 6 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.845 -0.578 25294 2175 1 6 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.137 -1.746 25294 2176 1 6 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.301 -2.438 25294 2177 1 6 . 1 1 11 11 ALA N N 11 125.169 125.169 122.076 3.093 25294 2178 1 6 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.575 -0.239 25294 2179 1 6 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.352 -2.368 25294 2180 1 6 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.512 -2.330 25294 2181 1 6 . 1 1 12 12 ASP N N 12 122.672 122.672 124.800 -2.128 25294 2182 1 6 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.804 -0.068 25294 2183 1 6 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.463 -2.761 25294 2184 1 6 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.486 -3.655 25294 2185 1 6 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.557 -0.253 25294 2186 1 6 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.165 -2.565 25294 2187 1 6 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.743 -3.227 25294 2188 1 6 . 1 1 14 14 MET N N 14 120.151 120.151 119.415 0.736 25294 2189 1 6 . 1 1 14 14 MET HA H 14 3.780 3.780 4.434 -0.654 25294 2190 1 6 . 1 1 14 14 MET CA C 14 55.822 55.822 55.383 0.439 25294 2191 1 6 . 1 1 14 14 MET CB C 14 30.909 30.909 32.330 -1.421 25294 2192 1 6 . 1 1 15 15 LYS N N 15 123.897 123.897 123.699 0.198 25294 2193 1 6 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.401 0.056 25294 2194 1 6 . 1 1 15 15 LYS CA C 15 51.407 51.407 56.085 -4.678 25294 2195 1 6 . 1 1 15 15 LYS CB C 15 32.453 32.453 33.234 -0.781 25294 2196 1 6 . 1 1 16 16 TRP N N 16 125.776 125.776 123.116 2.660 25294 2197 1 6 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.254 -0.179 25294 2198 1 6 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.694 -3.042 25294 2199 1 6 . 1 1 16 16 TRP CB C 16 28.000 28.000 32.624 -4.625 25294 2200 1 6 . 1 1 17 17 SER N N 17 120.772 120.772 115.620 5.152 25294 2201 1 6 . 1 1 17 17 SER HA H 17 4.403 4.403 4.591 -0.188 25294 2202 1 6 . 1 1 17 17 SER CA C 17 56.167 56.167 58.738 -2.571 25294 2203 1 6 . 1 1 17 17 SER CB C 17 60.833 60.833 64.600 -3.768 25294 2204 1 6 . 1 1 18 18 LYS N N 18 121.096 121.096 122.162 -1.066 25294 2205 1 6 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.557 0.161 25294 2206 1 6 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.173 -1.438 25294 2207 1 6 . 1 1 18 18 LYS CB C 18 32.917 32.917 34.392 -1.475 25294 2208 1 6 . 1 1 19 19 VAL N N 19 116.358 116.358 118.631 -2.273 25294 2209 1 6 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.518 -0.095 25294 2210 1 6 . 1 1 19 19 VAL CA C 19 55.230 55.230 57.812 -2.582 25294 2211 1 6 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.079 -3.053 25294 2212 1 6 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.356 -0.053 25294 2213 1 6 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.730 -2.960 25294 2214 1 6 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.173 -2.620 25294 2215 1 6 . 1 1 21 21 SER N N 21 118.882 118.882 119.080 -0.198 25294 2216 1 6 . 1 1 21 21 SER HA H 21 4.084 4.084 4.118 -0.034 25294 2217 1 6 . 1 1 21 21 SER CA C 21 57.657 57.657 59.264 -1.607 25294 2218 1 6 . 1 1 21 21 SER CB C 21 60.173 60.173 62.986 -2.813 25294 2219 1 6 . 1 1 22 22 GLY N N 22 109.523 109.523 107.694 1.829 25294 2220 1 6 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.644 -2.240 25294 2221 1 6 . 1 1 23 23 LEU N N 23 123.003 123.003 121.012 1.991 25294 2222 1 6 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.311 -0.277 25294 2223 1 6 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.517 -1.914 25294 2224 1 6 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.525 -2.454 25294 2225 1 6 . 1 1 24 24 LYS N N 24 129.004 129.004 127.487 1.517 25294 2226 1 6 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.520 -0.010 25294 2227 1 6 . 1 1 24 24 LYS CA C 24 53.237 53.237 54.689 -1.452 25294 2228 1 6 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.948 -1.787 25294 2229 1 6 . 1 1 25 25 ASN N N 25 126.336 126.336 123.066 3.270 25294 2230 1 6 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.419 -0.095 25294 2231 1 6 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.122 -2.502 25294 2232 1 6 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.096 -3.111 25294 2233 1 6 . 1 1 26 26 GLY N N 26 103.076 103.076 103.311 -0.235 25294 2234 1 6 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.885 -1.336 25294 2235 1 6 . 1 1 27 27 GLU N N 27 120.878 120.878 122.446 -1.568 25294 2236 1 6 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.927 0.275 25294 2237 1 6 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.179 -3.946 25294 2238 1 6 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.352 -0.591 25294 2239 1 6 . 1 1 28 28 LEU N N 28 128.583 128.583 127.189 1.394 25294 2240 1 6 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.495 0.060 25294 2241 1 6 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.032 -2.708 25294 2242 1 6 . 1 1 28 28 LEU CB C 28 43.517 43.517 42.070 1.447 25294 2243 1 6 . 1 1 29 29 LYS N N 29 127.554 127.554 126.354 1.200 25294 2244 1 6 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.843 0.058 25294 2245 1 6 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.227 -2.388 25294 2246 1 6 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.750 -3.227 25294 2247 1 6 . 1 1 30 30 VAL N N 30 127.915 127.915 124.361 3.554 25294 2248 1 6 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.574 -0.390 25294 2249 1 6 . 1 1 30 30 VAL CA C 30 58.308 58.308 59.893 -1.585 25294 2250 1 6 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.891 -3.621 25294 2251 1 6 . 1 1 31 31 GLU N N 31 125.151 125.151 120.790 4.361 25294 2252 1 6 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.707 -0.346 25294 2253 1 6 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.157 -0.057 25294 2254 1 6 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.721 -4.018 25294 2255 1 6 . 1 1 32 32 ALA N N 32 126.271 126.271 123.161 3.110 25294 2256 1 6 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.353 -0.337 25294 2257 1 6 . 1 1 32 32 ALA CA C 32 53.127 53.127 52.651 0.476 25294 2258 1 6 . 1 1 32 32 ALA CB C 32 15.266 15.266 17.289 -2.023 25294 2259 1 6 . 1 1 33 33 GLU N N 33 113.076 113.076 116.859 -3.783 25294 2260 1 6 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.481 -0.516 25294 2261 1 6 . 1 1 33 33 GLU CA C 33 55.985 55.985 55.736 0.249 25294 2262 1 6 . 1 1 33 33 GLU CB C 33 26.929 26.929 32.728 -5.799 25294 2263 1 6 . 1 1 34 34 GLY N N 34 104.905 104.905 109.652 -4.747 25294 2264 1 6 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.469 -4.762 25294 2265 1 6 . 1 1 35 35 GLY N N 35 105.946 105.946 107.255 -1.309 25294 2266 1 6 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.398 -1.410 25294 2267 1 6 . 1 1 36 36 SER N N 36 116.044 116.044 117.369 -1.325 25294 2268 1 6 . 1 1 36 36 SER HA H 36 5.539 5.539 4.988 0.551 25294 2269 1 6 . 1 1 36 36 SER CA C 36 54.323 54.323 58.281 -3.958 25294 2270 1 6 . 1 1 36 36 SER CB C 36 62.808 62.808 64.411 -1.603 25294 2271 1 6 . 1 1 37 37 SER N N 37 119.501 119.501 115.038 4.463 25294 2272 1 6 . 1 1 37 37 SER HA H 37 4.712 4.712 4.746 -0.034 25294 2273 1 6 . 1 1 37 37 SER CA C 37 55.548 55.548 57.586 -2.038 25294 2274 1 6 . 1 1 37 37 SER CB C 37 63.943 63.943 65.811 -1.868 25294 2275 1 6 . 1 1 38 38 LEU N N 38 125.962 125.962 122.029 3.933 25294 2276 1 6 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.576 0.677 25294 2277 1 6 . 1 1 38 38 LEU CA C 38 51.782 51.782 55.250 -3.468 25294 2278 1 6 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.652 -2.818 25294 2279 1 6 . 1 1 39 39 PHE N N 39 124.707 124.707 124.633 0.074 25294 2280 1 6 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.212 -0.073 25294 2281 1 6 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.901 -3.770 25294 2282 1 6 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.704 -1.752 25294 2283 1 6 . 1 1 40 40 ALA N N 40 124.994 124.994 126.900 -1.906 25294 2284 1 6 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.199 0.436 25294 2285 1 6 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.239 -1.938 25294 2286 1 6 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.902 -0.456 25294 2287 1 6 . 1 1 41 41 CYS N N 41 125.757 125.757 125.589 0.168 25294 2288 1 6 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.201 -0.055 25294 2289 1 6 . 1 1 41 41 CYS CA C 41 56.465 56.465 58.851 -2.386 25294 2290 1 6 . 1 1 41 41 CYS CB C 41 25.973 25.973 28.614 -2.641 25294 2291 1 6 . 1 1 42 42 LYS N N 42 129.019 129.019 127.075 1.944 25294 2292 1 6 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.317 -0.057 25294 2293 1 6 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.503 -2.652 25294 2294 1 6 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.712 -0.605 25294 2295 1 6 . 1 1 43 43 ASN N N 43 113.240 113.240 116.823 -3.583 25294 2296 1 6 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.584 -0.059 25294 2297 1 6 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.693 -3.458 25294 2298 1 6 . 1 1 43 43 ASN CB C 43 34.861 34.861 40.474 -5.613 25294 2299 1 6 . 1 1 44 44 TYR N N 44 119.335 119.335 118.911 0.424 25294 2300 1 6 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.606 -0.049 25294 2301 1 6 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.874 -2.156 25294 2302 1 6 . 1 1 44 44 TYR CB C 44 37.372 37.372 40.511 -3.139 25294 2303 1 6 . 1 1 45 45 LYS N N 45 120.676 120.676 123.434 -2.758 25294 2304 1 6 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.751 -0.715 25294 2305 1 6 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.425 -1.887 25294 2306 1 6 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.526 -2.293 25294 2307 1 6 . 1 1 46 46 SER N N 46 108.797 108.797 115.277 -6.480 25294 2308 1 6 . 1 1 46 46 SER HA H 46 4.388 4.388 4.755 -0.367 25294 2309 1 6 . 1 1 46 46 SER CA C 46 53.664 53.664 58.549 -4.885 25294 2310 1 6 . 1 1 46 46 SER CB C 46 61.810 61.810 63.405 -1.595 25294 2311 1 6 . 1 1 47 47 PHE N N 47 117.325 117.325 118.853 -1.528 25294 2312 1 6 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.315 -0.673 25294 2313 1 6 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.815 -3.198 25294 2314 1 6 . 1 1 47 47 PHE CB C 47 37.101 37.101 41.817 -4.716 25294 2315 1 6 . 1 1 48 48 TRP N N 48 117.090 117.090 117.310 -0.220 25294 2316 1 6 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.114 0.121 25294 2317 1 6 . 1 1 48 48 TRP CA C 48 53.492 53.492 54.886 -1.394 25294 2318 1 6 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.157 -1.262 25294 2319 1 6 . 1 1 49 49 ILE N N 49 119.682 119.682 119.849 -0.167 25294 2320 1 6 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.347 -0.316 25294 2321 1 6 . 1 1 49 49 ILE CA C 49 60.473 60.473 60.289 0.184 25294 2322 1 6 . 1 1 49 49 ILE CB C 49 36.436 36.436 38.014 -1.578 25294 2323 1 6 . 1 1 50 50 SER N N 50 124.071 124.071 122.302 1.769 25294 2324 1 6 . 1 1 50 50 SER HA H 50 4.708 4.708 4.631 0.077 25294 2325 1 6 . 1 1 50 50 SER CA C 50 56.110 56.110 58.377 -2.267 25294 2326 1 6 . 1 1 50 50 SER CB C 50 63.816 63.816 64.581 -0.764 25294 2327 1 6 . 1 1 51 51 SER N N 51 111.253 111.253 114.498 -3.245 25294 2328 1 6 . 1 1 51 51 SER HA H 51 4.557 4.557 4.766 -0.209 25294 2329 1 6 . 1 1 51 51 SER CA C 51 55.564 55.564 57.742 -2.178 25294 2330 1 6 . 1 1 51 51 SER CB C 51 62.821 62.821 65.775 -2.954 25294 2331 1 6 . 1 1 52 52 VAL N N 52 121.147 121.147 121.529 -0.382 25294 2332 1 6 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.487 0.244 25294 2333 1 6 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.742 -1.616 25294 2334 1 6 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.657 -3.157 25294 2335 1 6 . 1 1 53 53 LYS N N 53 126.128 126.128 125.037 1.091 25294 2336 1 6 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.638 0.369 25294 2337 1 6 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.481 -2.758 25294 2338 1 6 . 1 1 53 53 LYS CB C 53 33.772 33.772 34.342 -0.570 25294 2339 1 6 . 1 1 54 54 GLU N N 54 124.160 124.160 124.146 0.014 25294 2340 1 6 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.798 0.960 25294 2341 1 6 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.909 -2.650 25294 2342 1 6 . 1 1 54 54 GLU CB C 54 31.059 31.059 30.804 0.255 25294 2343 1 6 . 1 1 55 55 GLU N N 55 127.218 127.218 118.615 8.603 25294 2344 1 6 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.366 -0.458 25294 2345 1 6 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.245 -1.699 25294 2346 1 6 . 1 1 55 55 GLU CB C 55 25.294 25.294 31.211 -5.917 25294 2347 1 6 . 1 1 56 56 GLY N N 56 104.894 104.894 108.397 -3.503 25294 2348 1 6 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.352 -3.471 25294 2349 1 6 . 1 1 57 57 LYS N N 57 120.444 120.444 116.544 3.900 25294 2350 1 6 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.810 -0.246 25294 2351 1 6 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.188 -2.229 25294 2352 1 6 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.044 -2.856 25294 2353 1 6 . 1 1 58 58 PHE N N 58 121.824 121.824 119.325 2.499 25294 2354 1 6 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.439 -0.668 25294 2355 1 6 . 1 1 58 58 PHE CA C 58 56.165 56.165 57.026 -0.861 25294 2356 1 6 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.843 -3.941 25294 2357 1 6 . 1 1 59 59 LYS N N 59 123.205 123.205 120.128 3.077 25294 2358 1 6 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.786 -0.335 25294 2359 1 6 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.033 -4.048 25294 2360 1 6 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.879 -5.088 25294 2361 1 6 . 1 1 60 60 GLU N N 60 122.647 122.647 120.170 2.477 25294 2362 1 6 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.344 -0.084 25294 2363 1 6 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.715 -2.809 25294 2364 1 6 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.403 -2.740 25294 2365 1 6 . 1 1 61 61 ASN N N 61 119.907 119.907 120.292 -0.385 25294 2366 1 6 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.082 -0.237 25294 2367 1 6 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.242 -2.490 25294 2368 1 6 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.107 -4.084 25294 2369 1 6 . 1 1 62 62 THR N N 62 113.271 113.271 114.102 -0.831 25294 2370 1 6 . 1 1 62 62 THR HA H 62 4.308 4.308 4.538 -0.230 25294 2371 1 6 . 1 1 62 62 THR CA C 62 59.310 59.310 61.830 -2.520 25294 2372 1 6 . 1 1 62 62 THR CB C 62 66.813 66.813 69.280 -2.467 25294 2373 1 6 . 1 1 63 63 SER N N 63 116.521 116.521 116.962 -0.441 25294 2374 1 6 . 1 1 63 63 SER HA H 63 4.650 4.650 4.813 -0.163 25294 2375 1 6 . 1 1 63 63 SER CA C 63 54.094 54.094 58.016 -3.922 25294 2376 1 6 . 1 1 63 63 SER CB C 63 61.617 61.617 64.415 -2.798 25294 2377 1 6 . 1 1 64 64 TYR N N 64 120.183 120.183 126.965 -6.782 25294 2378 1 6 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.577 0.261 25294 2379 1 6 . 1 1 64 64 TYR CA C 64 56.403 56.403 59.586 -3.183 25294 2380 1 6 . 1 1 64 64 TYR CB C 64 36.569 36.569 38.809 -2.240 25294 2381 1 6 . 1 1 65 65 LYS N N 65 115.195 115.195 115.868 -0.673 25294 2382 1 6 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.509 0.212 25294 2383 1 6 . 1 1 65 65 LYS CA C 65 52.706 52.706 55.810 -3.104 25294 2384 1 6 . 1 1 65 65 LYS CB C 65 31.820 31.820 33.391 -1.571 25294 2385 1 6 . 1 1 66 66 GLU N N 66 117.231 117.231 119.444 -2.213 25294 2386 1 6 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.207 0.006 25294 2387 1 6 . 1 1 66 66 GLU CA C 66 52.613 52.613 54.818 -2.205 25294 2388 1 6 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.897 -3.104 25294 2389 1 6 . 1 1 67 67 PHE N N 67 121.532 121.532 123.159 -1.627 25294 2390 1 6 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.908 -0.478 25294 2391 1 6 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.745 -1.476 25294 2392 1 6 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.091 -1.816 25294 2393 1 6 . 1 1 68 68 ASP N N 68 128.157 128.157 127.169 0.988 25294 2394 1 6 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.970 -0.542 25294 2395 1 6 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.978 -3.422 25294 2396 1 6 . 1 1 68 68 ASP CB C 68 38.424 38.424 41.437 -3.013 25294 2397 1 6 . 1 1 69 69 GLY N N 69 114.151 114.151 109.887 4.264 25294 2398 1 6 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.769 -3.870 25294 2399 1 6 . 1 1 70 70 GLY N N 70 113.714 113.714 110.323 3.391 25294 2400 1 6 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.580 -1.586 25294 2401 1 6 . 1 1 71 71 TRP N N 71 117.823 117.823 121.186 -3.363 25294 2402 1 6 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.782 0.026 25294 2403 1 6 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.469 -3.692 25294 2404 1 6 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.988 -4.343 25294 2405 1 6 . 1 1 72 72 TYR N N 72 114.204 114.204 120.075 -5.871 25294 2406 1 6 . 1 1 72 72 TYR HA H 72 5.125 5.125 5.394 -0.269 25294 2407 1 6 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.891 -5.455 25294 2408 1 6 . 1 1 72 72 TYR CB C 72 38.620 38.620 41.540 -2.920 25294 2409 1 6 . 1 1 73 73 LEU N N 73 121.469 121.469 125.361 -3.892 25294 2410 1 6 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.896 -0.129 25294 2411 1 6 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.907 -2.575 25294 2412 1 6 . 1 1 73 73 LEU CB C 73 43.403 43.403 45.980 -2.577 25294 2413 1 6 . 1 1 74 74 VAL N N 74 124.558 124.558 126.000 -1.442 25294 2414 1 6 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.667 0.116 25294 2415 1 6 . 1 1 74 74 VAL CA C 74 57.812 57.812 59.884 -2.072 25294 2416 1 6 . 1 1 74 74 VAL CB C 74 31.820 31.820 32.886 -1.066 25294 2417 1 6 . 1 1 75 75 LYS N N 75 125.824 125.824 125.963 -0.139 25294 2418 1 6 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.173 -0.063 25294 2419 1 6 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.115 -2.311 25294 2420 1 6 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.104 -2.529 25294 2421 1 6 . 1 1 76 76 ILE N N 76 124.647 124.647 124.993 -0.346 25294 2422 1 6 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.422 0.656 25294 2423 1 6 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.765 -3.398 25294 2424 1 6 . 1 1 76 76 ILE CB C 76 37.593 37.593 38.801 -1.208 25294 2425 1 6 . 1 1 77 77 GLU N N 77 128.081 128.081 128.447 -0.366 25294 2426 1 6 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.653 -0.209 25294 2427 1 6 . 1 1 77 77 GLU CA C 77 52.471 52.471 54.917 -2.446 25294 2428 1 6 . 1 1 77 77 GLU CB C 77 29.914 29.914 32.376 -2.462 25294 2429 1 6 . 1 1 78 78 ASP N N 78 126.158 126.158 125.942 0.216 25294 2430 1 6 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.254 -0.154 25294 2431 1 6 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.312 -3.249 25294 2432 1 6 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.467 -3.729 25294 2433 1 6 . 1 1 79 79 ASN N N 79 118.653 118.653 116.777 1.876 25294 2434 1 6 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.098 -0.452 25294 2435 1 6 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.159 -1.950 25294 2436 1 6 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.632 -5.282 25294 2437 1 6 . 1 1 80 80 GLU N N 80 120.378 120.378 122.484 -2.106 25294 2438 1 6 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.163 0.346 25294 2439 1 6 . 1 1 80 80 GLU CA C 80 52.860 52.860 56.088 -3.228 25294 2440 1 6 . 1 1 80 80 GLU CB C 80 29.673 29.673 31.233 -1.560 25294 2441 1 6 . 1 1 81 81 LEU N N 81 125.771 125.771 128.527 -2.756 25294 2442 1 6 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.464 -0.498 25294 2443 1 6 . 1 1 81 81 LEU CA C 81 51.014 51.014 53.561 -2.547 25294 2444 1 6 . 1 1 81 81 LEU CB C 81 42.550 42.550 44.951 -2.401 25294 2445 1 6 . 1 1 82 82 LYS N N 82 128.076 128.076 124.265 3.811 25294 2446 1 6 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.350 -0.105 25294 2447 1 6 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.707 -2.375 25294 2448 1 6 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.428 -4.249 25294 2449 1 6 . 1 1 83 83 VAL N N 83 124.216 124.216 117.060 7.156 25294 2450 1 6 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.199 -0.291 25294 2451 1 6 . 1 1 83 83 VAL CA C 83 58.380 58.380 58.973 -0.593 25294 2452 1 6 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.343 -3.175 25294 2453 1 6 . 1 1 84 84 ILE N N 84 129.084 129.084 124.687 4.397 25294 2454 1 6 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.465 0.065 25294 2455 1 6 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.126 -1.720 25294 2456 1 6 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.191 -3.025 25294 2457 1 6 . 1 1 85 85 ILE N N 85 127.360 127.360 124.725 2.635 25294 2458 1 6 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.759 -0.174 25294 2459 1 6 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.761 -1.300 25294 2460 1 6 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.259 -1.761 25294 2461 1 6 . 1 1 86 86 ASN N N 86 128.337 128.337 126.474 1.863 25294 2462 1 6 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.763 0.003 25294 2463 1 6 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.670 -3.488 25294 2464 1 6 . 1 1 86 86 ASN CB C 86 36.891 36.891 39.632 -2.741 25294 2465 1 6 . 1 1 87 87 ARG N N 87 119.368 119.368 120.606 -1.238 25294 2466 1 6 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.151 -0.160 25294 2467 1 6 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.614 -2.416 25294 2468 1 6 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.860 -2.457 25294 2469 1 6 . 1 1 88 88 ASN N N 88 125.082 125.082 123.253 1.829 25294 2470 1 6 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.641 0.084 25294 2471 1 6 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.100 -3.998 25294 2472 1 6 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.633 -3.877 25294 2473 1 6 . 1 1 89 89 GLU N N 89 125.309 125.309 122.529 2.780 25294 2474 1 6 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.224 0.134 25294 2475 1 6 . 1 1 89 89 GLU CA C 89 53.013 53.013 57.214 -4.201 25294 2476 1 6 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.869 -2.785 25294 2477 1 6 . 1 1 90 90 THR N N 90 112.516 112.516 111.611 0.905 25294 2478 1 6 . 1 1 90 90 THR HA H 90 4.534 4.534 4.319 0.215 25294 2479 1 6 . 1 1 90 90 THR CA C 90 58.161 58.161 60.405 -2.244 25294 2480 1 6 . 1 1 90 90 THR CB C 90 68.409 68.409 70.724 -2.315 25294 2481 1 6 . 1 1 91 91 ASN N N 91 116.717 116.717 117.409 -0.692 25294 2482 1 6 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.665 0.042 25294 2483 1 6 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.679 -3.883 25294 2484 1 6 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.497 -3.023 25294 2485 1 6 . 1 1 92 92 ALA N N 92 122.025 122.025 121.155 0.870 25294 2486 1 6 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.509 0.127 25294 2487 1 6 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.360 -2.311 25294 2488 1 6 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.934 -1.218 25294 2489 1 6 . 1 1 93 93 SER N N 93 115.895 115.895 117.500 -1.605 25294 2490 1 6 . 1 1 93 93 SER HA H 93 4.536 4.536 4.527 0.009 25294 2491 1 6 . 1 1 93 93 SER CA C 93 54.865 54.865 58.822 -3.957 25294 2492 1 6 . 1 1 93 93 SER CB C 93 61.292 61.292 64.462 -3.170 25294 2493 1 6 . 1 1 94 94 ARG N N 94 119.529 119.529 118.354 1.175 25294 2494 1 6 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.721 0.193 25294 2495 1 6 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.776 -2.680 25294 2496 1 6 . 1 1 94 94 ARG CB C 94 29.512 29.512 32.408 -2.896 25294 2497 1 6 . 1 1 95 95 SER N N 95 114.542 114.542 113.155 1.387 25294 2498 1 6 . 1 1 95 95 SER HA H 95 5.926 5.926 5.056 0.870 25294 2499 1 6 . 1 1 95 95 SER CA C 95 54.219 54.219 58.009 -3.790 25294 2500 1 6 . 1 1 95 95 SER CB C 95 65.271 65.271 65.826 -0.555 25294 2501 1 6 . 1 1 96 96 PHE N N 96 117.183 117.183 119.860 -2.677 25294 2502 1 6 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.300 0.038 25294 2503 1 6 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.648 -2.168 25294 2504 1 6 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.372 -4.504 25294 2505 1 6 . 1 1 97 97 THR N N 97 115.263 115.263 116.564 -1.301 25294 2506 1 6 . 1 1 97 97 THR HA H 97 5.250 5.250 5.229 0.021 25294 2507 1 6 . 1 1 97 97 THR CA C 97 58.178 58.178 61.861 -3.683 25294 2508 1 6 . 1 1 97 97 THR CB C 97 69.068 69.068 72.275 -3.208 25294 2509 1 6 . 1 1 98 98 VAL N N 98 125.442 125.442 118.309 7.133 25294 2510 1 6 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.617 0.240 25294 2511 1 6 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.196 -2.787 25294 2512 1 6 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.189 -1.260 25294 2513 1 6 . 1 1 99 99 CYS N N 99 127.111 127.111 124.937 2.174 25294 2514 1 6 . 1 1 99 99 CYS HA H 99 5.346 5.346 4.689 0.657 25294 2515 1 6 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.567 -2.616 25294 2516 1 6 . 1 1 99 99 CYS CB C 99 25.942 25.942 29.969 -4.027 25294 2517 1 6 . 1 1 100 100 VAL N N 100 120.146 120.146 123.355 -3.209 25294 2518 1 6 . 1 1 100 100 VAL HA H 100 5.383 5.383 4.570 0.813 25294 2519 1 6 . 1 1 100 100 VAL CA C 100 55.713 55.713 60.106 -4.393 25294 2520 1 6 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.074 -1.431 25294 2521 1 6 . 1 1 101 101 GLU N N 101 118.807 118.807 128.088 -9.281 25294 2522 1 6 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.364 0.388 25294 2523 1 6 . 1 1 101 101 GLU CA C 101 51.435 51.435 55.949 -4.514 25294 2524 1 6 . 1 1 101 101 GLU CB C 101 31.721 31.721 31.060 0.661 25294 2525 1 6 . 1 1 102 102 ALA N N 102 124.088 124.088 127.246 -3.158 25294 2526 1 6 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.842 -0.985 25294 2527 1 6 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.816 -2.938 25294 2528 1 6 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.657 -1.632 25294 2529 1 6 . 1 1 103 103 GLY N N 103 111.186 111.186 112.902 -1.716 25294 2530 1 6 . 1 1 103 103 GLY CA C 103 44.643 44.643 47.136 -2.493 25294 2531 1 6 . 1 1 104 104 ASN N N 104 123.092 123.092 122.920 0.172 25294 2532 1 6 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.825 -0.153 25294 2533 1 6 . 1 1 104 104 ASN CA C 104 50.696 50.696 52.986 -2.290 25294 2534 1 6 . 1 1 104 104 ASN CB C 104 36.407 36.407 40.000 -3.593 25294 2535 1 6 . 1 1 105 105 ALA N N 105 122.653 122.653 121.501 1.152 25294 2536 1 6 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.314 0.117 25294 2537 1 6 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.161 -2.493 25294 2538 1 6 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.861 -1.925 25294 2539 1 6 . 1 1 106 106 PHE N N 106 116.011 116.011 114.816 1.195 25294 2540 1 6 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.282 0.135 25294 2541 1 6 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.002 -2.444 25294 2542 1 6 . 1 1 106 106 PHE CB C 106 40.484 40.484 40.932 -0.448 25294 2543 1 6 . 1 1 107 107 ASP N N 107 121.992 121.992 125.791 -3.799 25294 2544 1 6 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.565 0.029 25294 2545 1 6 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.087 -2.563 25294 2546 1 6 . 1 1 107 107 ASP CB C 107 43.091 43.091 42.088 1.003 25294 2547 1 6 . 1 1 108 108 GLU N N 108 119.354 119.354 123.733 -4.379 25294 2548 1 6 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.204 0.805 25294 2549 1 6 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.210 -2.222 25294 2550 1 6 . 1 1 108 108 GLU CB C 108 31.317 31.317 31.538 -0.221 25294 2551 1 6 . 1 1 109 109 PHE N N 109 122.098 122.098 118.679 3.419 25294 2552 1 6 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.691 0.267 25294 2553 1 6 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.537 -3.750 25294 2554 1 6 . 1 1 109 109 PHE CB C 109 40.443 40.443 42.948 -2.505 25294 2555 1 6 . 1 1 110 110 LYS N N 110 124.500 124.500 121.022 3.478 25294 2556 1 6 . 1 1 110 110 LYS HA H 110 4.692 4.692 5.041 -0.349 25294 2557 1 6 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.212 -3.321 25294 2558 1 6 . 1 1 110 110 LYS CB C 110 33.012 33.012 35.948 -2.936 25294 2559 1 6 . 1 1 111 111 PHE N N 111 125.010 125.010 122.605 2.405 25294 2560 1 6 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.250 -0.496 25294 2561 1 6 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.107 1.077 25294 2562 1 6 . 1 1 111 111 PHE CB C 111 38.380 38.380 43.242 -4.862 25294 2563 1 6 . 1 1 112 112 VAL N N 112 122.957 122.957 123.396 -0.439 25294 2564 1 6 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.763 -0.323 25294 2565 1 6 . 1 1 112 112 VAL CA C 112 58.256 58.256 59.952 -1.696 25294 2566 1 6 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.674 -4.581 25294 2567 1 6 . 1 1 113 113 GLN N N 113 130.864 130.864 128.453 2.411 25294 2568 1 6 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.079 0.240 25294 2569 1 6 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.305 -2.186 25294 2570 1 6 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.949 -4.785 25294 2571 1 6 . 1 1 114 114 ASP N N 114 126.272 126.272 125.544 0.728 25294 2572 1 6 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.640 -0.313 25294 2573 1 6 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.047 -3.274 25294 2574 1 6 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.358 -2.503 25294 2575 1 6 . 1 1 115 115 ALA N N 115 120.134 120.134 122.042 -1.908 25294 2576 1 6 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.378 -0.679 25294 2577 1 6 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.884 -2.983 25294 2578 1 6 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.836 -2.085 25294 2579 1 6 . 1 1 116 116 ALA N N 116 121.377 121.377 124.631 -3.254 25294 2580 1 6 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.265 -0.312 25294 2581 1 6 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.852 -2.864 25294 2582 1 6 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.605 -3.405 25294 2583 1 6 . 1 1 117 117 LYS N N 117 121.536 121.536 122.459 -0.923 25294 2584 1 6 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.477 -0.338 25294 2585 1 6 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.689 -2.043 25294 2586 1 6 . 1 1 117 117 LYS CB C 117 30.579 30.579 32.138 -1.559 25294 2587 1 7 . 1 1 5 5 SER N N 5 116.267 116.267 116.301 -0.034 25294 2588 1 7 . 1 1 5 5 SER HA H 5 4.349 4.349 4.616 -0.267 25294 2589 1 7 . 1 1 5 5 SER CA C 5 55.478 55.478 57.495 -2.017 25294 2590 1 7 . 1 1 5 5 SER CB C 5 61.191 61.191 65.139 -3.949 25294 2591 1 7 . 1 1 6 6 ASP N N 6 123.039 123.039 122.981 0.058 25294 2592 1 7 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.834 -0.007 25294 2593 1 7 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.578 -2.908 25294 2594 1 7 . 1 1 6 6 ASP CB C 6 38.656 38.656 42.046 -3.390 25294 2595 1 7 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.456 -0.139 25294 2596 1 7 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.431 -3.284 25294 2597 1 7 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.002 -2.524 25294 2598 1 7 . 1 1 8 8 ASP N N 8 119.159 119.159 117.147 2.012 25294 2599 1 7 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.829 -0.264 25294 2600 1 7 . 1 1 8 8 ASP CA C 8 51.860 51.860 53.961 -2.100 25294 2601 1 7 . 1 1 8 8 ASP CB C 8 38.725 38.725 42.289 -3.564 25294 2602 1 7 . 1 1 9 9 GLY N N 9 108.837 108.837 109.551 -0.714 25294 2603 1 7 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.147 -2.011 25294 2604 1 7 . 1 1 10 10 LEU N N 10 121.571 121.571 119.240 2.331 25294 2605 1 7 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.920 -0.653 25294 2606 1 7 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.447 -1.056 25294 2607 1 7 . 1 1 10 10 LEU CB C 10 39.863 39.863 44.208 -4.345 25294 2608 1 7 . 1 1 11 11 ALA N N 11 125.169 125.169 122.804 2.365 25294 2609 1 7 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.526 -0.190 25294 2610 1 7 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.599 -2.615 25294 2611 1 7 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.871 -2.689 25294 2612 1 7 . 1 1 12 12 ASP N N 12 122.672 122.672 120.046 2.626 25294 2613 1 7 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.069 -0.333 25294 2614 1 7 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.204 -2.502 25294 2615 1 7 . 1 1 12 12 ASP CB C 12 37.831 37.831 43.020 -5.189 25294 2616 1 7 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.498 -0.194 25294 2617 1 7 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.530 -2.930 25294 2618 1 7 . 1 1 13 13 PRO CB C 13 29.516 29.516 33.281 -3.765 25294 2619 1 7 . 1 1 14 14 MET N N 14 120.151 120.151 116.262 3.889 25294 2620 1 7 . 1 1 14 14 MET HA H 14 3.780 3.780 4.698 -0.918 25294 2621 1 7 . 1 1 14 14 MET CA C 14 55.822 55.822 55.829 -0.007 25294 2622 1 7 . 1 1 14 14 MET CB C 14 30.909 30.909 32.798 -1.889 25294 2623 1 7 . 1 1 15 15 LYS N N 15 123.897 123.897 122.926 0.971 25294 2624 1 7 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.693 -0.236 25294 2625 1 7 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.289 -3.882 25294 2626 1 7 . 1 1 15 15 LYS CB C 15 32.453 32.453 34.243 -1.790 25294 2627 1 7 . 1 1 16 16 TRP N N 16 125.776 125.776 127.380 -1.604 25294 2628 1 7 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.092 -0.017 25294 2629 1 7 . 1 1 16 16 TRP CA C 16 53.652 53.652 57.146 -3.494 25294 2630 1 7 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.003 -2.003 25294 2631 1 7 . 1 1 17 17 SER N N 17 120.772 120.772 120.344 0.428 25294 2632 1 7 . 1 1 17 17 SER HA H 17 4.403 4.403 4.557 -0.154 25294 2633 1 7 . 1 1 17 17 SER CA C 17 56.167 56.167 58.970 -2.803 25294 2634 1 7 . 1 1 17 17 SER CB C 17 60.833 60.833 63.525 -2.692 25294 2635 1 7 . 1 1 18 18 LYS N N 18 121.096 121.096 121.473 -0.377 25294 2636 1 7 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.599 0.119 25294 2637 1 7 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.929 -2.194 25294 2638 1 7 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.192 -2.275 25294 2639 1 7 . 1 1 19 19 VAL N N 19 116.358 116.358 119.830 -3.472 25294 2640 1 7 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.378 0.045 25294 2641 1 7 . 1 1 19 19 VAL CA C 19 55.230 55.230 57.174 -1.944 25294 2642 1 7 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.336 -3.310 25294 2643 1 7 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.353 -0.050 25294 2644 1 7 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.864 -3.094 25294 2645 1 7 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.166 -2.613 25294 2646 1 7 . 1 1 21 21 SER N N 21 118.882 118.882 120.024 -1.142 25294 2647 1 7 . 1 1 21 21 SER HA H 21 4.084 4.084 4.044 0.040 25294 2648 1 7 . 1 1 21 21 SER CA C 21 57.657 57.657 60.088 -2.431 25294 2649 1 7 . 1 1 21 21 SER CB C 21 60.173 60.173 62.868 -2.695 25294 2650 1 7 . 1 1 22 22 GLY N N 22 109.523 109.523 107.470 2.053 25294 2651 1 7 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.666 -2.263 25294 2652 1 7 . 1 1 23 23 LEU N N 23 123.003 123.003 122.047 0.956 25294 2653 1 7 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.380 -0.346 25294 2654 1 7 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.363 -1.760 25294 2655 1 7 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.342 -2.271 25294 2656 1 7 . 1 1 24 24 LYS N N 24 129.004 129.004 129.769 -0.765 25294 2657 1 7 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.510 -0.000 25294 2658 1 7 . 1 1 24 24 LYS CA C 24 53.237 53.237 54.471 -1.234 25294 2659 1 7 . 1 1 24 24 LYS CB C 24 32.161 32.161 32.101 0.060 25294 2660 1 7 . 1 1 25 25 ASN N N 25 126.336 126.336 123.563 2.773 25294 2661 1 7 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.411 -0.087 25294 2662 1 7 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.683 -3.063 25294 2663 1 7 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.744 -2.759 25294 2664 1 7 . 1 1 26 26 GLY N N 26 103.076 103.076 103.405 -0.329 25294 2665 1 7 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.094 -1.545 25294 2666 1 7 . 1 1 27 27 GLU N N 27 120.878 120.878 122.486 -1.608 25294 2667 1 7 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.702 0.500 25294 2668 1 7 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.728 -4.495 25294 2669 1 7 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.391 -0.630 25294 2670 1 7 . 1 1 28 28 LEU N N 28 128.583 128.583 125.498 3.085 25294 2671 1 7 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.550 0.005 25294 2672 1 7 . 1 1 28 28 LEU CA C 28 50.324 50.324 52.797 -2.473 25294 2673 1 7 . 1 1 28 28 LEU CB C 28 43.517 43.517 41.947 1.569 25294 2674 1 7 . 1 1 29 29 LYS N N 29 127.554 127.554 125.152 2.402 25294 2675 1 7 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.309 0.592 25294 2676 1 7 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.855 -4.016 25294 2677 1 7 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.757 -3.234 25294 2678 1 7 . 1 1 30 30 VAL N N 30 127.915 127.915 123.424 4.491 25294 2679 1 7 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.415 -0.231 25294 2680 1 7 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.217 -1.909 25294 2681 1 7 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.336 -4.066 25294 2682 1 7 . 1 1 31 31 GLU N N 31 125.151 125.151 125.182 -0.031 25294 2683 1 7 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.518 -0.157 25294 2684 1 7 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.929 -0.829 25294 2685 1 7 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.250 -3.547 25294 2686 1 7 . 1 1 32 32 ALA N N 32 126.271 126.271 120.427 5.844 25294 2687 1 7 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.283 -0.267 25294 2688 1 7 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.783 -1.656 25294 2689 1 7 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.505 -3.239 25294 2690 1 7 . 1 1 33 33 GLU N N 33 113.076 113.076 115.219 -2.143 25294 2691 1 7 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.296 -0.331 25294 2692 1 7 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.522 -0.537 25294 2693 1 7 . 1 1 33 33 GLU CB C 33 26.929 26.929 29.799 -2.870 25294 2694 1 7 . 1 1 34 34 GLY N N 34 104.905 104.905 108.010 -3.105 25294 2695 1 7 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.121 -4.414 25294 2696 1 7 . 1 1 35 35 GLY N N 35 105.946 105.946 106.605 -0.659 25294 2697 1 7 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.396 -1.408 25294 2698 1 7 . 1 1 36 36 SER N N 36 116.044 116.044 115.455 0.589 25294 2699 1 7 . 1 1 36 36 SER HA H 36 5.539 5.539 5.276 0.263 25294 2700 1 7 . 1 1 36 36 SER CA C 36 54.323 54.323 58.198 -3.875 25294 2701 1 7 . 1 1 36 36 SER CB C 36 62.808 62.808 64.397 -1.589 25294 2702 1 7 . 1 1 37 37 SER N N 37 119.501 119.501 114.465 5.036 25294 2703 1 7 . 1 1 37 37 SER HA H 37 4.712 4.712 4.770 -0.058 25294 2704 1 7 . 1 1 37 37 SER CA C 37 55.548 55.548 57.645 -2.097 25294 2705 1 7 . 1 1 37 37 SER CB C 37 63.943 63.943 65.677 -1.734 25294 2706 1 7 . 1 1 38 38 LEU N N 38 125.962 125.962 120.655 5.307 25294 2707 1 7 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.981 0.272 25294 2708 1 7 . 1 1 38 38 LEU CA C 38 51.782 51.782 55.135 -3.353 25294 2709 1 7 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.813 -2.979 25294 2710 1 7 . 1 1 39 39 PHE N N 39 124.707 124.707 124.629 0.078 25294 2711 1 7 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.263 -0.124 25294 2712 1 7 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.791 -3.660 25294 2713 1 7 . 1 1 39 39 PHE CB C 39 38.952 38.952 41.686 -2.734 25294 2714 1 7 . 1 1 40 40 ALA N N 40 124.994 124.994 127.310 -2.316 25294 2715 1 7 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.235 0.400 25294 2716 1 7 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.312 -2.011 25294 2717 1 7 . 1 1 40 40 ALA CB C 40 19.446 19.446 21.001 -1.555 25294 2718 1 7 . 1 1 41 41 CYS N N 41 125.757 125.757 125.105 0.652 25294 2719 1 7 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.138 0.008 25294 2720 1 7 . 1 1 41 41 CYS CA C 41 56.465 56.465 60.140 -3.675 25294 2721 1 7 . 1 1 41 41 CYS CB C 41 25.973 25.973 28.098 -2.125 25294 2722 1 7 . 1 1 42 42 LYS N N 42 129.019 129.019 128.273 0.746 25294 2723 1 7 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.289 -0.029 25294 2724 1 7 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.083 -2.232 25294 2725 1 7 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.136 -0.029 25294 2726 1 7 . 1 1 43 43 ASN N N 43 113.240 113.240 115.089 -1.849 25294 2727 1 7 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.573 -0.048 25294 2728 1 7 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.355 -3.120 25294 2729 1 7 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.516 -4.655 25294 2730 1 7 . 1 1 44 44 TYR N N 44 119.335 119.335 122.147 -2.812 25294 2731 1 7 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.574 -0.017 25294 2732 1 7 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.199 -2.481 25294 2733 1 7 . 1 1 44 44 TYR CB C 44 37.372 37.372 38.021 -0.649 25294 2734 1 7 . 1 1 45 45 LYS N N 45 120.676 120.676 124.318 -3.642 25294 2735 1 7 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.554 -0.518 25294 2736 1 7 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.630 -2.092 25294 2737 1 7 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.511 -2.279 25294 2738 1 7 . 1 1 46 46 SER N N 46 108.797 108.797 112.377 -3.580 25294 2739 1 7 . 1 1 46 46 SER HA H 46 4.388 4.388 4.801 -0.413 25294 2740 1 7 . 1 1 46 46 SER CA C 46 53.664 53.664 57.783 -4.119 25294 2741 1 7 . 1 1 46 46 SER CB C 46 61.810 61.810 63.318 -1.508 25294 2742 1 7 . 1 1 47 47 PHE N N 47 117.325 117.325 118.855 -1.530 25294 2743 1 7 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.508 -0.866 25294 2744 1 7 . 1 1 47 47 PHE CA C 47 53.617 53.617 57.235 -3.618 25294 2745 1 7 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.315 -5.214 25294 2746 1 7 . 1 1 48 48 TRP N N 48 117.090 117.090 118.575 -1.485 25294 2747 1 7 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.120 0.115 25294 2748 1 7 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.554 -2.062 25294 2749 1 7 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.258 -1.363 25294 2750 1 7 . 1 1 49 49 ILE N N 49 119.682 119.682 120.277 -0.595 25294 2751 1 7 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.377 -0.346 25294 2752 1 7 . 1 1 49 49 ILE CA C 49 60.473 60.473 60.941 -0.468 25294 2753 1 7 . 1 1 49 49 ILE CB C 49 36.436 36.436 37.128 -0.692 25294 2754 1 7 . 1 1 50 50 SER N N 50 124.071 124.071 123.332 0.739 25294 2755 1 7 . 1 1 50 50 SER HA H 50 4.708 4.708 4.805 -0.097 25294 2756 1 7 . 1 1 50 50 SER CA C 50 56.110 56.110 58.181 -2.071 25294 2757 1 7 . 1 1 50 50 SER CB C 50 63.816 63.816 65.489 -1.673 25294 2758 1 7 . 1 1 51 51 SER N N 51 111.253 111.253 115.952 -4.699 25294 2759 1 7 . 1 1 51 51 SER HA H 51 4.557 4.557 4.809 -0.252 25294 2760 1 7 . 1 1 51 51 SER CA C 51 55.564 55.564 57.977 -2.413 25294 2761 1 7 . 1 1 51 51 SER CB C 51 62.821 62.821 66.773 -3.952 25294 2762 1 7 . 1 1 52 52 VAL N N 52 121.147 121.147 122.696 -1.549 25294 2763 1 7 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.394 0.337 25294 2764 1 7 . 1 1 52 52 VAL CA C 52 59.126 59.126 61.163 -2.037 25294 2765 1 7 . 1 1 52 52 VAL CB C 52 32.500 32.500 34.249 -1.749 25294 2766 1 7 . 1 1 53 53 LYS N N 53 126.128 126.128 127.652 -1.524 25294 2767 1 7 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.445 0.562 25294 2768 1 7 . 1 1 53 53 LYS CA C 53 51.723 51.723 55.372 -3.649 25294 2769 1 7 . 1 1 53 53 LYS CB C 53 33.772 33.772 33.620 0.152 25294 2770 1 7 . 1 1 54 54 GLU N N 54 124.160 124.160 125.161 -1.001 25294 2771 1 7 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.245 1.513 25294 2772 1 7 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.921 -2.662 25294 2773 1 7 . 1 1 54 54 GLU CB C 54 31.059 31.059 30.416 0.643 25294 2774 1 7 . 1 1 55 55 GLU N N 55 127.218 127.218 117.912 9.306 25294 2775 1 7 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.503 -0.595 25294 2776 1 7 . 1 1 55 55 GLU CA C 55 54.546 54.546 55.525 -0.979 25294 2777 1 7 . 1 1 55 55 GLU CB C 55 25.294 25.294 31.122 -5.829 25294 2778 1 7 . 1 1 56 56 GLY N N 56 104.894 104.894 108.155 -3.261 25294 2779 1 7 . 1 1 56 56 GLY CA C 56 42.881 42.881 45.470 -2.589 25294 2780 1 7 . 1 1 57 57 LYS N N 57 120.444 120.444 118.683 1.761 25294 2781 1 7 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.643 -0.079 25294 2782 1 7 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.058 -2.099 25294 2783 1 7 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.491 -2.303 25294 2784 1 7 . 1 1 58 58 PHE N N 58 121.824 121.824 119.884 1.940 25294 2785 1 7 . 1 1 58 58 PHE HA H 58 4.771 4.771 4.578 0.193 25294 2786 1 7 . 1 1 58 58 PHE CA C 58 56.165 56.165 58.355 -2.189 25294 2787 1 7 . 1 1 58 58 PHE CB C 58 36.902 36.902 39.781 -2.879 25294 2788 1 7 . 1 1 59 59 LYS N N 59 123.205 123.205 122.318 0.887 25294 2789 1 7 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.809 -0.358 25294 2790 1 7 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.020 -4.035 25294 2791 1 7 . 1 1 59 59 LYS CB C 59 29.791 29.791 35.298 -5.507 25294 2792 1 7 . 1 1 60 60 GLU N N 60 122.647 122.647 118.982 3.665 25294 2793 1 7 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.555 -0.295 25294 2794 1 7 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.722 -1.816 25294 2795 1 7 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.823 -3.160 25294 2796 1 7 . 1 1 61 61 ASN N N 61 119.907 119.907 117.438 2.469 25294 2797 1 7 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.124 -0.279 25294 2798 1 7 . 1 1 61 61 ASN CA C 61 50.752 50.752 52.923 -2.171 25294 2799 1 7 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.696 -4.673 25294 2800 1 7 . 1 1 62 62 THR N N 62 113.271 113.271 113.586 -0.315 25294 2801 1 7 . 1 1 62 62 THR HA H 62 4.308 4.308 4.440 -0.132 25294 2802 1 7 . 1 1 62 62 THR CA C 62 59.310 59.310 62.278 -2.968 25294 2803 1 7 . 1 1 62 62 THR CB C 62 66.813 66.813 69.060 -2.247 25294 2804 1 7 . 1 1 63 63 SER N N 63 116.521 116.521 115.084 1.437 25294 2805 1 7 . 1 1 63 63 SER HA H 63 4.650 4.650 4.677 -0.027 25294 2806 1 7 . 1 1 63 63 SER CA C 63 54.094 54.094 57.597 -3.503 25294 2807 1 7 . 1 1 63 63 SER CB C 63 61.617 61.617 64.890 -3.273 25294 2808 1 7 . 1 1 64 64 TYR N N 64 120.183 120.183 118.954 1.229 25294 2809 1 7 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.991 -0.153 25294 2810 1 7 . 1 1 64 64 TYR CA C 64 56.403 56.403 57.933 -1.530 25294 2811 1 7 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.008 -2.439 25294 2812 1 7 . 1 1 65 65 LYS N N 65 115.195 115.195 116.377 -1.182 25294 2813 1 7 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.455 0.266 25294 2814 1 7 . 1 1 65 65 LYS CA C 65 52.706 52.706 57.091 -4.385 25294 2815 1 7 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.434 -2.614 25294 2816 1 7 . 1 1 66 66 GLU N N 66 117.231 117.231 119.426 -2.195 25294 2817 1 7 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.307 -0.094 25294 2818 1 7 . 1 1 66 66 GLU CA C 66 52.613 52.613 54.562 -1.949 25294 2819 1 7 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.264 -2.471 25294 2820 1 7 . 1 1 67 67 PHE N N 67 121.532 121.532 121.906 -0.374 25294 2821 1 7 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.793 -0.363 25294 2822 1 7 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.145 -0.876 25294 2823 1 7 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.747 -2.472 25294 2824 1 7 . 1 1 68 68 ASP N N 68 128.157 128.157 126.100 2.057 25294 2825 1 7 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.841 -0.413 25294 2826 1 7 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.866 -3.310 25294 2827 1 7 . 1 1 68 68 ASP CB C 68 38.424 38.424 43.069 -4.645 25294 2828 1 7 . 1 1 69 69 GLY N N 69 114.151 114.151 111.259 2.892 25294 2829 1 7 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.913 -4.014 25294 2830 1 7 . 1 1 70 70 GLY N N 70 113.714 113.714 110.819 2.895 25294 2831 1 7 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.620 -1.626 25294 2832 1 7 . 1 1 71 71 TRP N N 71 117.823 117.823 122.265 -4.442 25294 2833 1 7 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.555 0.253 25294 2834 1 7 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.763 -3.986 25294 2835 1 7 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.948 -4.303 25294 2836 1 7 . 1 1 72 72 TYR N N 72 114.204 114.204 119.744 -5.540 25294 2837 1 7 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.869 0.256 25294 2838 1 7 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.731 -5.296 25294 2839 1 7 . 1 1 72 72 TYR CB C 72 38.620 38.620 39.616 -0.996 25294 2840 1 7 . 1 1 73 73 LEU N N 73 121.469 121.469 128.548 -7.079 25294 2841 1 7 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.661 0.106 25294 2842 1 7 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.279 -1.947 25294 2843 1 7 . 1 1 73 73 LEU CB C 73 43.403 43.403 45.105 -1.702 25294 2844 1 7 . 1 1 74 74 VAL N N 74 124.558 124.558 128.360 -3.802 25294 2845 1 7 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.092 0.691 25294 2846 1 7 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.371 -3.559 25294 2847 1 7 . 1 1 74 74 VAL CB C 74 31.820 31.820 31.773 0.047 25294 2848 1 7 . 1 1 75 75 LYS N N 75 125.824 125.824 127.917 -2.093 25294 2849 1 7 . 1 1 75 75 LYS HA H 75 5.110 5.110 4.971 0.139 25294 2850 1 7 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.474 -2.670 25294 2851 1 7 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.839 -2.264 25294 2852 1 7 . 1 1 76 76 ILE N N 76 124.647 124.647 125.992 -1.345 25294 2853 1 7 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.393 0.685 25294 2854 1 7 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.448 -3.081 25294 2855 1 7 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.133 -1.540 25294 2856 1 7 . 1 1 77 77 GLU N N 77 128.081 128.081 129.001 -0.920 25294 2857 1 7 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.462 -0.018 25294 2858 1 7 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.912 -3.441 25294 2859 1 7 . 1 1 77 77 GLU CB C 77 29.914 29.914 30.407 -0.493 25294 2860 1 7 . 1 1 78 78 ASP N N 78 126.158 126.158 124.926 1.232 25294 2861 1 7 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.153 -0.053 25294 2862 1 7 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.254 -3.191 25294 2863 1 7 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.713 -3.975 25294 2864 1 7 . 1 1 79 79 ASN N N 79 118.653 118.653 121.191 -2.538 25294 2865 1 7 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.067 -0.421 25294 2866 1 7 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.160 -1.951 25294 2867 1 7 . 1 1 79 79 ASN CB C 79 35.350 35.350 39.335 -3.985 25294 2868 1 7 . 1 1 80 80 GLU N N 80 120.378 120.378 120.384 -0.006 25294 2869 1 7 . 1 1 80 80 GLU HA H 80 5.509 5.509 4.990 0.519 25294 2870 1 7 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.883 -3.022 25294 2871 1 7 . 1 1 80 80 GLU CB C 80 29.673 29.673 32.147 -2.474 25294 2872 1 7 . 1 1 81 81 LEU N N 81 125.771 125.771 128.420 -2.649 25294 2873 1 7 . 1 1 81 81 LEU HA H 81 4.966 4.966 4.817 0.149 25294 2874 1 7 . 1 1 81 81 LEU CA C 81 51.014 51.014 55.398 -4.384 25294 2875 1 7 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.293 -0.743 25294 2876 1 7 . 1 1 82 82 LYS N N 82 128.076 128.076 125.691 2.385 25294 2877 1 7 . 1 1 82 82 LYS HA H 82 5.245 5.245 4.853 0.392 25294 2878 1 7 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.740 -2.408 25294 2879 1 7 . 1 1 82 82 LYS CB C 82 32.179 32.179 35.264 -3.085 25294 2880 1 7 . 1 1 83 83 VAL N N 83 124.216 124.216 119.155 5.061 25294 2881 1 7 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.013 -0.105 25294 2882 1 7 . 1 1 83 83 VAL CA C 83 58.380 58.380 59.795 -1.415 25294 2883 1 7 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.373 -2.205 25294 2884 1 7 . 1 1 84 84 ILE N N 84 129.084 129.084 122.292 6.792 25294 2885 1 7 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.287 0.243 25294 2886 1 7 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.163 -1.757 25294 2887 1 7 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.249 -2.083 25294 2888 1 7 . 1 1 85 85 ILE N N 85 127.360 127.360 128.024 -0.664 25294 2889 1 7 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.642 -0.057 25294 2890 1 7 . 1 1 85 85 ILE CA C 85 58.460 58.460 60.044 -1.585 25294 2891 1 7 . 1 1 85 85 ILE CB C 85 38.498 38.498 38.755 -0.257 25294 2892 1 7 . 1 1 86 86 ASN N N 86 128.337 128.337 124.394 3.943 25294 2893 1 7 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.794 -0.028 25294 2894 1 7 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.439 -3.257 25294 2895 1 7 . 1 1 86 86 ASN CB C 86 36.891 36.891 39.890 -2.999 25294 2896 1 7 . 1 1 87 87 ARG N N 87 119.368 119.368 120.339 -0.971 25294 2897 1 7 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.374 -0.383 25294 2898 1 7 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.419 -2.221 25294 2899 1 7 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.619 -2.216 25294 2900 1 7 . 1 1 88 88 ASN N N 88 125.082 125.082 125.395 -0.313 25294 2901 1 7 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.522 0.203 25294 2902 1 7 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.187 -4.084 25294 2903 1 7 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.680 -3.923 25294 2904 1 7 . 1 1 89 89 GLU N N 89 125.309 125.309 123.044 2.265 25294 2905 1 7 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.241 0.117 25294 2906 1 7 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.633 -3.620 25294 2907 1 7 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.502 -2.418 25294 2908 1 7 . 1 1 90 90 THR N N 90 112.516 112.516 112.457 0.059 25294 2909 1 7 . 1 1 90 90 THR HA H 90 4.534 4.534 4.553 -0.019 25294 2910 1 7 . 1 1 90 90 THR CA C 90 58.161 58.161 60.055 -1.894 25294 2911 1 7 . 1 1 90 90 THR CB C 90 68.409 68.409 71.980 -3.571 25294 2912 1 7 . 1 1 91 91 ASN N N 91 116.717 116.717 119.599 -2.882 25294 2913 1 7 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.582 0.125 25294 2914 1 7 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.793 -3.997 25294 2915 1 7 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.129 -2.655 25294 2916 1 7 . 1 1 92 92 ALA N N 92 122.025 122.025 122.146 -0.121 25294 2917 1 7 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.573 0.063 25294 2918 1 7 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.444 -2.396 25294 2919 1 7 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.996 -1.280 25294 2920 1 7 . 1 1 93 93 SER N N 93 115.895 115.895 119.136 -3.241 25294 2921 1 7 . 1 1 93 93 SER HA H 93 4.536 4.536 4.626 -0.090 25294 2922 1 7 . 1 1 93 93 SER CA C 93 54.865 54.865 59.079 -4.214 25294 2923 1 7 . 1 1 93 93 SER CB C 93 61.292 61.292 63.984 -2.692 25294 2924 1 7 . 1 1 94 94 ARG N N 94 119.529 119.529 122.874 -3.345 25294 2925 1 7 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.826 0.088 25294 2926 1 7 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.514 -2.417 25294 2927 1 7 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.443 -3.931 25294 2928 1 7 . 1 1 95 95 SER N N 95 114.542 114.542 114.203 0.339 25294 2929 1 7 . 1 1 95 95 SER HA H 95 5.926 5.926 4.916 1.010 25294 2930 1 7 . 1 1 95 95 SER CA C 95 54.219 54.219 57.950 -3.731 25294 2931 1 7 . 1 1 95 95 SER CB C 95 65.271 65.271 66.661 -1.390 25294 2932 1 7 . 1 1 96 96 PHE N N 96 117.183 117.183 119.123 -1.940 25294 2933 1 7 . 1 1 96 96 PHE HA H 96 5.338 5.338 4.918 0.420 25294 2934 1 7 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.836 -2.356 25294 2935 1 7 . 1 1 96 96 PHE CB C 96 38.868 38.868 44.061 -5.193 25294 2936 1 7 . 1 1 97 97 THR N N 97 115.263 115.263 116.310 -1.047 25294 2937 1 7 . 1 1 97 97 THR HA H 97 5.250 5.250 5.075 0.175 25294 2938 1 7 . 1 1 97 97 THR CA C 97 58.178 58.178 61.783 -3.605 25294 2939 1 7 . 1 1 97 97 THR CB C 97 69.068 69.068 71.603 -2.535 25294 2940 1 7 . 1 1 98 98 VAL N N 98 125.442 125.442 126.554 -1.112 25294 2941 1 7 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.260 0.597 25294 2942 1 7 . 1 1 98 98 VAL CA C 98 57.409 57.409 61.427 -4.018 25294 2943 1 7 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.219 -1.290 25294 2944 1 7 . 1 1 99 99 CYS N N 99 127.111 127.111 126.540 0.571 25294 2945 1 7 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.309 0.037 25294 2946 1 7 . 1 1 99 99 CYS CA C 99 53.951 53.951 55.851 -1.900 25294 2947 1 7 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.367 -4.425 25294 2948 1 7 . 1 1 100 100 VAL N N 100 120.146 120.146 120.537 -0.391 25294 2949 1 7 . 1 1 100 100 VAL HA H 100 5.383 5.383 4.957 0.426 25294 2950 1 7 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.642 -3.929 25294 2951 1 7 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.221 -2.578 25294 2952 1 7 . 1 1 101 101 GLU N N 101 118.807 118.807 124.873 -6.066 25294 2953 1 7 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.745 0.007 25294 2954 1 7 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.105 -2.670 25294 2955 1 7 . 1 1 101 101 GLU CB C 101 31.721 31.721 32.939 -1.218 25294 2956 1 7 . 1 1 102 102 ALA N N 102 124.088 124.088 126.649 -2.561 25294 2957 1 7 . 1 1 102 102 ALA HA H 102 3.857 3.857 5.032 -1.175 25294 2958 1 7 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.563 -2.685 25294 2959 1 7 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.469 -1.444 25294 2960 1 7 . 1 1 103 103 GLY N N 103 111.186 111.186 109.034 2.152 25294 2961 1 7 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.042 -1.399 25294 2962 1 7 . 1 1 104 104 ASN N N 104 123.092 123.092 122.010 1.082 25294 2963 1 7 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.547 0.125 25294 2964 1 7 . 1 1 104 104 ASN CA C 104 50.696 50.696 54.294 -3.598 25294 2965 1 7 . 1 1 104 104 ASN CB C 104 36.407 36.407 38.912 -2.505 25294 2966 1 7 . 1 1 105 105 ALA N N 105 122.653 122.653 119.050 3.603 25294 2967 1 7 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.526 -0.095 25294 2968 1 7 . 1 1 105 105 ALA CA C 105 48.668 48.668 50.614 -1.946 25294 2969 1 7 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.504 -2.568 25294 2970 1 7 . 1 1 106 106 PHE N N 106 116.011 116.011 114.607 1.404 25294 2971 1 7 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.556 -0.139 25294 2972 1 7 . 1 1 106 106 PHE CA C 106 53.558 53.558 55.839 -2.281 25294 2973 1 7 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.561 -2.077 25294 2974 1 7 . 1 1 107 107 ASP N N 107 121.992 121.992 118.831 3.161 25294 2975 1 7 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.773 -0.179 25294 2976 1 7 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.785 -2.261 25294 2977 1 7 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.978 -1.887 25294 2978 1 7 . 1 1 108 108 GLU N N 108 119.354 119.354 121.577 -2.223 25294 2979 1 7 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.669 0.340 25294 2980 1 7 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.222 -3.235 25294 2981 1 7 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.374 -1.057 25294 2982 1 7 . 1 1 109 109 PHE N N 109 122.098 122.098 126.358 -4.260 25294 2983 1 7 . 1 1 109 109 PHE HA H 109 4.958 4.958 5.015 -0.057 25294 2984 1 7 . 1 1 109 109 PHE CA C 109 52.787 52.787 54.997 -2.210 25294 2985 1 7 . 1 1 109 109 PHE CB C 109 40.443 40.443 39.865 0.578 25294 2986 1 7 . 1 1 110 110 LYS N N 110 124.500 124.500 126.215 -1.715 25294 2987 1 7 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.641 0.051 25294 2988 1 7 . 1 1 110 110 LYS CA C 110 51.891 51.891 54.492 -2.601 25294 2989 1 7 . 1 1 110 110 LYS CB C 110 33.012 33.012 31.673 1.339 25294 2990 1 7 . 1 1 111 111 PHE N N 111 125.010 125.010 124.939 0.071 25294 2991 1 7 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.007 -0.253 25294 2992 1 7 . 1 1 111 111 PHE CA C 111 58.184 58.184 59.082 -0.898 25294 2993 1 7 . 1 1 111 111 PHE CB C 111 38.380 38.380 40.264 -1.885 25294 2994 1 7 . 1 1 112 112 VAL N N 112 122.957 122.957 122.646 0.311 25294 2995 1 7 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.640 -0.200 25294 2996 1 7 . 1 1 112 112 VAL CA C 112 58.256 58.256 60.805 -2.549 25294 2997 1 7 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.941 -4.848 25294 2998 1 7 . 1 1 113 113 GLN N N 113 130.864 130.864 128.742 2.122 25294 2999 1 7 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.167 0.152 25294 3000 1 7 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.679 -2.560 25294 3001 1 7 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.292 -4.128 25294 3002 1 7 . 1 1 114 114 ASP N N 114 126.272 126.272 126.820 -0.548 25294 3003 1 7 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.685 -0.358 25294 3004 1 7 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.058 -3.285 25294 3005 1 7 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.581 -2.726 25294 3006 1 7 . 1 1 115 115 ALA N N 115 120.134 120.134 121.827 -1.693 25294 3007 1 7 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.433 -0.734 25294 3008 1 7 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.706 -2.805 25294 3009 1 7 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.848 -2.097 25294 3010 1 7 . 1 1 116 116 ALA N N 116 121.377 121.377 124.531 -3.154 25294 3011 1 7 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.269 -0.316 25294 3012 1 7 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.498 -2.510 25294 3013 1 7 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.710 -3.510 25294 3014 1 7 . 1 1 117 117 LYS N N 117 121.536 121.536 122.272 -0.736 25294 3015 1 7 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.488 -0.349 25294 3016 1 7 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.913 -2.267 25294 3017 1 7 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.712 -1.133 25294 3018 1 8 . 1 1 5 5 SER N N 5 116.267 116.267 117.795 -1.528 25294 3019 1 8 . 1 1 5 5 SER HA H 5 4.349 4.349 4.672 -0.323 25294 3020 1 8 . 1 1 5 5 SER CA C 5 55.478 55.478 57.339 -1.861 25294 3021 1 8 . 1 1 5 5 SER CB C 5 61.191 61.191 65.609 -4.418 25294 3022 1 8 . 1 1 6 6 ASP N N 6 123.039 123.039 121.654 1.385 25294 3023 1 8 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.949 -0.122 25294 3024 1 8 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.352 -2.681 25294 3025 1 8 . 1 1 6 6 ASP CB C 6 38.656 38.656 40.255 -1.599 25294 3026 1 8 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.349 -0.032 25294 3027 1 8 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.909 -3.762 25294 3028 1 8 . 1 1 7 7 PRO CB C 7 29.478 29.478 31.761 -2.283 25294 3029 1 8 . 1 1 8 8 ASP N N 8 119.159 119.159 117.451 1.708 25294 3030 1 8 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.732 -0.167 25294 3031 1 8 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.106 -2.246 25294 3032 1 8 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.397 -2.672 25294 3033 1 8 . 1 1 9 9 GLY N N 9 108.837 108.837 109.977 -1.140 25294 3034 1 8 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.275 -2.139 25294 3035 1 8 . 1 1 10 10 LEU N N 10 121.571 121.571 119.179 2.392 25294 3036 1 8 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.705 -0.438 25294 3037 1 8 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.255 -0.864 25294 3038 1 8 . 1 1 10 10 LEU CB C 10 39.863 39.863 43.094 -3.231 25294 3039 1 8 . 1 1 11 11 ALA N N 11 125.169 125.169 122.217 2.952 25294 3040 1 8 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.621 -0.285 25294 3041 1 8 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.316 -2.332 25294 3042 1 8 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.602 -2.420 25294 3043 1 8 . 1 1 12 12 ASP N N 12 122.672 122.672 124.588 -1.916 25294 3044 1 8 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.890 -0.154 25294 3045 1 8 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.244 -2.542 25294 3046 1 8 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.960 -4.129 25294 3047 1 8 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.496 -0.192 25294 3048 1 8 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.864 -3.264 25294 3049 1 8 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.815 -3.299 25294 3050 1 8 . 1 1 14 14 MET N N 14 120.151 120.151 117.610 2.541 25294 3051 1 8 . 1 1 14 14 MET HA H 14 3.780 3.780 4.724 -0.944 25294 3052 1 8 . 1 1 14 14 MET CA C 14 55.822 55.822 54.983 0.839 25294 3053 1 8 . 1 1 14 14 MET CB C 14 30.909 30.909 33.752 -2.843 25294 3054 1 8 . 1 1 15 15 LYS N N 15 123.897 123.897 121.910 1.987 25294 3055 1 8 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.683 -0.226 25294 3056 1 8 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.281 -3.874 25294 3057 1 8 . 1 1 15 15 LYS CB C 15 32.453 32.453 33.785 -1.332 25294 3058 1 8 . 1 1 16 16 TRP N N 16 125.776 125.776 127.167 -1.391 25294 3059 1 8 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.018 0.057 25294 3060 1 8 . 1 1 16 16 TRP CA C 16 53.652 53.652 57.326 -3.674 25294 3061 1 8 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.462 -2.462 25294 3062 1 8 . 1 1 17 17 SER N N 17 120.772 120.772 118.614 2.158 25294 3063 1 8 . 1 1 17 17 SER HA H 17 4.403 4.403 4.643 -0.240 25294 3064 1 8 . 1 1 17 17 SER CA C 17 56.167 56.167 58.783 -2.616 25294 3065 1 8 . 1 1 17 17 SER CB C 17 60.833 60.833 64.064 -3.231 25294 3066 1 8 . 1 1 18 18 LYS N N 18 121.096 121.096 122.236 -1.140 25294 3067 1 8 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.673 0.045 25294 3068 1 8 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.493 -1.758 25294 3069 1 8 . 1 1 18 18 LYS CB C 18 32.917 32.917 36.136 -3.219 25294 3070 1 8 . 1 1 19 19 VAL N N 19 116.358 116.358 117.527 -1.169 25294 3071 1 8 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.584 -0.161 25294 3072 1 8 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.296 -3.066 25294 3073 1 8 . 1 1 19 19 VAL CB C 19 31.026 31.026 33.910 -2.884 25294 3074 1 8 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.525 -0.222 25294 3075 1 8 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.336 -2.566 25294 3076 1 8 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.484 -2.931 25294 3077 1 8 . 1 1 21 21 SER N N 21 118.882 118.882 115.939 2.943 25294 3078 1 8 . 1 1 21 21 SER HA H 21 4.084 4.084 4.282 -0.198 25294 3079 1 8 . 1 1 21 21 SER CA C 21 57.657 57.657 60.138 -2.481 25294 3080 1 8 . 1 1 21 21 SER CB C 21 60.173 60.173 62.787 -2.614 25294 3081 1 8 . 1 1 22 22 GLY N N 22 109.523 109.523 110.312 -0.789 25294 3082 1 8 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.510 -2.106 25294 3083 1 8 . 1 1 23 23 LEU N N 23 123.003 123.003 121.846 1.157 25294 3084 1 8 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.121 -0.087 25294 3085 1 8 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.375 -1.772 25294 3086 1 8 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.040 -1.969 25294 3087 1 8 . 1 1 24 24 LYS N N 24 129.004 129.004 128.469 0.535 25294 3088 1 8 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.442 0.068 25294 3089 1 8 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.173 -1.936 25294 3090 1 8 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.275 -1.114 25294 3091 1 8 . 1 1 25 25 ASN N N 25 126.336 126.336 124.625 1.711 25294 3092 1 8 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.478 -0.154 25294 3093 1 8 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.809 -2.189 25294 3094 1 8 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.732 -2.747 25294 3095 1 8 . 1 1 26 26 GLY N N 26 103.076 103.076 104.194 -1.118 25294 3096 1 8 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.187 -1.638 25294 3097 1 8 . 1 1 27 27 GLU N N 27 120.878 120.878 122.224 -1.346 25294 3098 1 8 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.891 0.311 25294 3099 1 8 . 1 1 27 27 GLU CA C 27 51.233 51.233 54.834 -3.601 25294 3100 1 8 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.288 -0.527 25294 3101 1 8 . 1 1 28 28 LEU N N 28 128.583 128.583 128.910 -0.327 25294 3102 1 8 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.600 -0.045 25294 3103 1 8 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.657 -3.333 25294 3104 1 8 . 1 1 28 28 LEU CB C 28 43.517 43.517 42.342 1.175 25294 3105 1 8 . 1 1 29 29 LYS N N 29 127.554 127.554 125.343 2.211 25294 3106 1 8 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.663 0.238 25294 3107 1 8 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.501 -2.662 25294 3108 1 8 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.351 -3.828 25294 3109 1 8 . 1 1 30 30 VAL N N 30 127.915 127.915 123.772 4.143 25294 3110 1 8 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.460 -0.276 25294 3111 1 8 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.826 -2.518 25294 3112 1 8 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.661 -3.391 25294 3113 1 8 . 1 1 31 31 GLU N N 31 125.151 125.151 125.919 -0.768 25294 3114 1 8 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.633 -0.272 25294 3115 1 8 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.952 -0.852 25294 3116 1 8 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.716 -3.013 25294 3117 1 8 . 1 1 32 32 ALA N N 32 126.271 126.271 122.150 4.121 25294 3118 1 8 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.262 -0.246 25294 3119 1 8 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.614 -1.487 25294 3120 1 8 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.774 -3.508 25294 3121 1 8 . 1 1 33 33 GLU N N 33 113.076 113.076 115.722 -2.646 25294 3122 1 8 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.226 -0.261 25294 3123 1 8 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.703 -0.718 25294 3124 1 8 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.039 -3.110 25294 3125 1 8 . 1 1 34 34 GLY N N 34 104.905 104.905 108.392 -3.487 25294 3126 1 8 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.343 -4.636 25294 3127 1 8 . 1 1 35 35 GLY N N 35 105.946 105.946 106.435 -0.489 25294 3128 1 8 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.737 -1.749 25294 3129 1 8 . 1 1 36 36 SER N N 36 116.044 116.044 115.732 0.312 25294 3130 1 8 . 1 1 36 36 SER HA H 36 5.539 5.539 5.313 0.226 25294 3131 1 8 . 1 1 36 36 SER CA C 36 54.323 54.323 58.350 -4.027 25294 3132 1 8 . 1 1 36 36 SER CB C 36 62.808 62.808 64.654 -1.846 25294 3133 1 8 . 1 1 37 37 SER N N 37 119.501 119.501 116.094 3.407 25294 3134 1 8 . 1 1 37 37 SER HA H 37 4.712 4.712 4.729 -0.017 25294 3135 1 8 . 1 1 37 37 SER CA C 37 55.548 55.548 57.716 -2.168 25294 3136 1 8 . 1 1 37 37 SER CB C 37 63.943 63.943 66.139 -2.196 25294 3137 1 8 . 1 1 38 38 LEU N N 38 125.962 125.962 122.517 3.445 25294 3138 1 8 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.209 0.044 25294 3139 1 8 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.406 -2.624 25294 3140 1 8 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.775 -2.941 25294 3141 1 8 . 1 1 39 39 PHE N N 39 124.707 124.707 123.995 0.712 25294 3142 1 8 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.204 -0.065 25294 3143 1 8 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.529 -3.397 25294 3144 1 8 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.268 -1.316 25294 3145 1 8 . 1 1 40 40 ALA N N 40 124.994 124.994 127.961 -2.967 25294 3146 1 8 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.141 0.494 25294 3147 1 8 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.476 -2.175 25294 3148 1 8 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.095 0.351 25294 3149 1 8 . 1 1 41 41 CYS N N 41 125.757 125.757 123.632 2.125 25294 3150 1 8 . 1 1 41 41 CYS HA H 41 4.146 4.146 3.993 0.153 25294 3151 1 8 . 1 1 41 41 CYS CA C 41 56.465 56.465 61.746 -5.282 25294 3152 1 8 . 1 1 41 41 CYS CB C 41 25.973 25.973 29.083 -3.110 25294 3153 1 8 . 1 1 42 42 LYS N N 42 129.019 129.019 123.855 5.164 25294 3154 1 8 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.565 -0.305 25294 3155 1 8 . 1 1 42 42 LYS CA C 42 54.851 54.851 55.566 -0.715 25294 3156 1 8 . 1 1 42 42 LYS CB C 42 32.107 32.107 33.780 -1.673 25294 3157 1 8 . 1 1 43 43 ASN N N 43 113.240 113.240 117.126 -3.886 25294 3158 1 8 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.605 -0.080 25294 3159 1 8 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.095 -2.860 25294 3160 1 8 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.799 -4.938 25294 3161 1 8 . 1 1 44 44 TYR N N 44 119.335 119.335 118.586 0.749 25294 3162 1 8 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.669 -0.112 25294 3163 1 8 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.220 -2.502 25294 3164 1 8 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.373 -4.001 25294 3165 1 8 . 1 1 45 45 LYS N N 45 120.676 120.676 121.783 -1.107 25294 3166 1 8 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.796 -0.760 25294 3167 1 8 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.221 -1.683 25294 3168 1 8 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.968 -2.736 25294 3169 1 8 . 1 1 46 46 SER N N 46 108.797 108.797 113.806 -5.009 25294 3170 1 8 . 1 1 46 46 SER HA H 46 4.388 4.388 4.672 -0.284 25294 3171 1 8 . 1 1 46 46 SER CA C 46 53.664 53.664 58.597 -4.933 25294 3172 1 8 . 1 1 46 46 SER CB C 46 61.810 61.810 63.827 -2.017 25294 3173 1 8 . 1 1 47 47 PHE N N 47 117.325 117.325 118.963 -1.638 25294 3174 1 8 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.516 -0.874 25294 3175 1 8 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.513 -2.896 25294 3176 1 8 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.563 -5.462 25294 3177 1 8 . 1 1 48 48 TRP N N 48 117.090 117.090 118.223 -1.133 25294 3178 1 8 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.188 0.047 25294 3179 1 8 . 1 1 48 48 TRP CA C 48 53.492 53.492 54.776 -1.284 25294 3180 1 8 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.380 -1.485 25294 3181 1 8 . 1 1 49 49 ILE N N 49 119.682 119.682 119.809 -0.127 25294 3182 1 8 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.141 -0.110 25294 3183 1 8 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.520 -1.047 25294 3184 1 8 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.608 -0.173 25294 3185 1 8 . 1 1 50 50 SER N N 50 124.071 124.071 121.938 2.133 25294 3186 1 8 . 1 1 50 50 SER HA H 50 4.708 4.708 4.821 -0.113 25294 3187 1 8 . 1 1 50 50 SER CA C 50 56.110 56.110 58.106 -1.996 25294 3188 1 8 . 1 1 50 50 SER CB C 50 63.816 63.816 65.245 -1.429 25294 3189 1 8 . 1 1 51 51 SER N N 51 111.253 111.253 115.968 -4.715 25294 3190 1 8 . 1 1 51 51 SER HA H 51 4.557 4.557 4.683 -0.126 25294 3191 1 8 . 1 1 51 51 SER CA C 51 55.564 55.564 57.587 -2.023 25294 3192 1 8 . 1 1 51 51 SER CB C 51 62.821 62.821 66.093 -3.272 25294 3193 1 8 . 1 1 52 52 VAL N N 52 121.147 121.147 120.275 0.872 25294 3194 1 8 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.749 -0.018 25294 3195 1 8 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.779 -0.653 25294 3196 1 8 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.966 -3.466 25294 3197 1 8 . 1 1 53 53 LYS N N 53 126.128 126.128 121.296 4.832 25294 3198 1 8 . 1 1 53 53 LYS HA H 53 5.007 5.007 5.015 -0.008 25294 3199 1 8 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.716 -2.993 25294 3200 1 8 . 1 1 53 53 LYS CB C 53 33.772 33.772 36.145 -2.373 25294 3201 1 8 . 1 1 54 54 GLU N N 54 124.160 124.160 120.285 3.875 25294 3202 1 8 . 1 1 54 54 GLU HA H 54 4.758 4.758 4.921 -0.163 25294 3203 1 8 . 1 1 54 54 GLU CA C 54 53.259 53.259 57.065 -3.806 25294 3204 1 8 . 1 1 54 54 GLU CB C 54 31.059 31.059 32.537 -1.478 25294 3205 1 8 . 1 1 55 55 GLU N N 55 127.218 127.218 119.017 8.201 25294 3206 1 8 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.542 -0.634 25294 3207 1 8 . 1 1 55 55 GLU CA C 55 54.546 54.546 55.898 -1.352 25294 3208 1 8 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.164 -4.870 25294 3209 1 8 . 1 1 56 56 GLY N N 56 104.894 104.894 108.718 -3.824 25294 3210 1 8 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.402 -3.521 25294 3211 1 8 . 1 1 57 57 LYS N N 57 120.444 120.444 117.741 2.703 25294 3212 1 8 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.726 -0.162 25294 3213 1 8 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.126 -2.167 25294 3214 1 8 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.002 -2.814 25294 3215 1 8 . 1 1 58 58 PHE N N 58 121.824 121.824 121.097 0.727 25294 3216 1 8 . 1 1 58 58 PHE HA H 58 4.771 4.771 4.992 -0.221 25294 3217 1 8 . 1 1 58 58 PHE CA C 58 56.165 56.165 55.787 0.378 25294 3218 1 8 . 1 1 58 58 PHE CB C 58 36.902 36.902 39.770 -2.868 25294 3219 1 8 . 1 1 59 59 LYS N N 59 123.205 123.205 123.705 -0.500 25294 3220 1 8 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.593 -0.142 25294 3221 1 8 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.622 -4.637 25294 3222 1 8 . 1 1 59 59 LYS CB C 59 29.791 29.791 33.329 -3.538 25294 3223 1 8 . 1 1 60 60 GLU N N 60 122.647 122.647 119.613 3.034 25294 3224 1 8 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.566 -0.306 25294 3225 1 8 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.758 -1.851 25294 3226 1 8 . 1 1 60 60 GLU CB C 60 27.663 27.663 31.040 -3.377 25294 3227 1 8 . 1 1 61 61 ASN N N 61 119.907 119.907 119.451 0.456 25294 3228 1 8 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.093 -0.248 25294 3229 1 8 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.694 -2.942 25294 3230 1 8 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.317 -4.294 25294 3231 1 8 . 1 1 62 62 THR N N 62 113.271 113.271 114.922 -1.651 25294 3232 1 8 . 1 1 62 62 THR HA H 62 4.308 4.308 4.450 -0.142 25294 3233 1 8 . 1 1 62 62 THR CA C 62 59.310 59.310 62.526 -3.216 25294 3234 1 8 . 1 1 62 62 THR CB C 62 66.813 66.813 69.526 -2.713 25294 3235 1 8 . 1 1 63 63 SER N N 63 116.521 116.521 116.407 0.114 25294 3236 1 8 . 1 1 63 63 SER HA H 63 4.650 4.650 4.695 -0.045 25294 3237 1 8 . 1 1 63 63 SER CA C 63 54.094 54.094 57.691 -3.597 25294 3238 1 8 . 1 1 63 63 SER CB C 63 61.617 61.617 65.384 -3.767 25294 3239 1 8 . 1 1 64 64 TYR N N 64 120.183 120.183 120.502 -0.319 25294 3240 1 8 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.868 -0.030 25294 3241 1 8 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.582 -2.179 25294 3242 1 8 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.532 -2.963 25294 3243 1 8 . 1 1 65 65 LYS N N 65 115.195 115.195 117.727 -2.532 25294 3244 1 8 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.541 0.180 25294 3245 1 8 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.629 -3.923 25294 3246 1 8 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.146 -2.326 25294 3247 1 8 . 1 1 66 66 GLU N N 66 117.231 117.231 118.536 -1.305 25294 3248 1 8 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.100 0.113 25294 3249 1 8 . 1 1 66 66 GLU CA C 66 52.613 52.613 54.998 -2.385 25294 3250 1 8 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.434 -2.641 25294 3251 1 8 . 1 1 67 67 PHE N N 67 121.532 121.532 121.830 -0.298 25294 3252 1 8 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.789 -0.359 25294 3253 1 8 . 1 1 67 67 PHE CA C 67 56.269 56.269 58.159 -1.890 25294 3254 1 8 . 1 1 67 67 PHE CB C 67 40.275 40.275 43.148 -2.873 25294 3255 1 8 . 1 1 68 68 ASP N N 68 128.157 128.157 124.993 3.164 25294 3256 1 8 . 1 1 68 68 ASP HA H 68 4.428 4.428 5.178 -0.750 25294 3257 1 8 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.061 -2.505 25294 3258 1 8 . 1 1 68 68 ASP CB C 68 38.424 38.424 43.452 -5.028 25294 3259 1 8 . 1 1 69 69 GLY N N 69 114.151 114.151 108.433 5.718 25294 3260 1 8 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.311 -3.412 25294 3261 1 8 . 1 1 70 70 GLY N N 70 113.714 113.714 110.549 3.165 25294 3262 1 8 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.588 -1.594 25294 3263 1 8 . 1 1 71 71 TRP N N 71 117.823 117.823 119.413 -1.590 25294 3264 1 8 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.781 0.027 25294 3265 1 8 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.599 -2.822 25294 3266 1 8 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.431 -4.786 25294 3267 1 8 . 1 1 72 72 TYR N N 72 114.204 114.204 120.552 -6.348 25294 3268 1 8 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.520 0.605 25294 3269 1 8 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.138 -5.703 25294 3270 1 8 . 1 1 72 72 TYR CB C 72 38.620 38.620 41.116 -2.496 25294 3271 1 8 . 1 1 73 73 LEU N N 73 121.469 121.469 125.744 -4.275 25294 3272 1 8 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.860 -0.093 25294 3273 1 8 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.481 -2.149 25294 3274 1 8 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.339 -2.936 25294 3275 1 8 . 1 1 74 74 VAL N N 74 124.558 124.558 124.316 0.242 25294 3276 1 8 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.566 0.217 25294 3277 1 8 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.638 -2.826 25294 3278 1 8 . 1 1 74 74 VAL CB C 74 31.820 31.820 33.791 -1.971 25294 3279 1 8 . 1 1 75 75 LYS N N 75 125.824 125.824 126.850 -1.026 25294 3280 1 8 . 1 1 75 75 LYS HA H 75 5.110 5.110 4.917 0.193 25294 3281 1 8 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.717 -2.913 25294 3282 1 8 . 1 1 75 75 LYS CB C 75 34.575 34.575 35.839 -1.264 25294 3283 1 8 . 1 1 76 76 ILE N N 76 124.647 124.647 126.974 -2.327 25294 3284 1 8 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.379 0.699 25294 3285 1 8 . 1 1 76 76 ILE CA C 76 57.367 57.367 61.371 -4.004 25294 3286 1 8 . 1 1 76 76 ILE CB C 76 37.593 37.593 38.241 -0.648 25294 3287 1 8 . 1 1 77 77 GLU N N 77 128.081 128.081 128.909 -0.828 25294 3288 1 8 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.591 -0.147 25294 3289 1 8 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.121 -2.650 25294 3290 1 8 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.062 -1.148 25294 3291 1 8 . 1 1 78 78 ASP N N 78 126.158 126.158 125.060 1.098 25294 3292 1 8 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.268 -0.168 25294 3293 1 8 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.537 -3.474 25294 3294 1 8 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.256 -3.518 25294 3295 1 8 . 1 1 79 79 ASN N N 79 118.653 118.653 115.577 3.076 25294 3296 1 8 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.047 -0.401 25294 3297 1 8 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.505 -2.296 25294 3298 1 8 . 1 1 79 79 ASN CB C 79 35.350 35.350 41.127 -5.777 25294 3299 1 8 . 1 1 80 80 GLU N N 80 120.378 120.378 122.439 -2.061 25294 3300 1 8 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.290 0.219 25294 3301 1 8 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.211 -2.351 25294 3302 1 8 . 1 1 80 80 GLU CB C 80 29.673 29.673 31.217 -1.544 25294 3303 1 8 . 1 1 81 81 LEU N N 81 125.771 125.771 129.071 -3.300 25294 3304 1 8 . 1 1 81 81 LEU HA H 81 4.966 4.966 4.612 0.354 25294 3305 1 8 . 1 1 81 81 LEU CA C 81 51.014 51.014 55.506 -4.492 25294 3306 1 8 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.005 -0.455 25294 3307 1 8 . 1 1 82 82 LYS N N 82 128.076 128.076 126.816 1.260 25294 3308 1 8 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.513 -0.268 25294 3309 1 8 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.524 -2.192 25294 3310 1 8 . 1 1 82 82 LYS CB C 82 32.179 32.179 35.516 -3.337 25294 3311 1 8 . 1 1 83 83 VAL N N 83 124.216 124.216 116.951 7.265 25294 3312 1 8 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.158 -0.250 25294 3313 1 8 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.224 -1.844 25294 3314 1 8 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.675 -3.507 25294 3315 1 8 . 1 1 84 84 ILE N N 84 129.084 129.084 125.283 3.801 25294 3316 1 8 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.403 0.127 25294 3317 1 8 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.541 -2.135 25294 3318 1 8 . 1 1 84 84 ILE CB C 84 38.166 38.166 39.922 -1.756 25294 3319 1 8 . 1 1 85 85 ILE N N 85 127.360 127.360 127.801 -0.441 25294 3320 1 8 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.489 0.096 25294 3321 1 8 . 1 1 85 85 ILE CA C 85 58.460 58.460 60.417 -1.957 25294 3322 1 8 . 1 1 85 85 ILE CB C 85 38.498 38.498 39.685 -1.187 25294 3323 1 8 . 1 1 86 86 ASN N N 86 128.337 128.337 121.838 6.499 25294 3324 1 8 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.941 -0.175 25294 3325 1 8 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.502 -2.320 25294 3326 1 8 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.531 -3.640 25294 3327 1 8 . 1 1 87 87 ARG N N 87 119.368 119.368 121.025 -1.657 25294 3328 1 8 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.342 -0.351 25294 3329 1 8 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.456 -2.258 25294 3330 1 8 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.822 -2.419 25294 3331 1 8 . 1 1 88 88 ASN N N 88 125.082 125.082 123.606 1.476 25294 3332 1 8 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.654 0.071 25294 3333 1 8 . 1 1 88 88 ASN CA C 88 49.103 49.103 52.840 -3.737 25294 3334 1 8 . 1 1 88 88 ASN CB C 88 34.757 34.757 39.757 -5.000 25294 3335 1 8 . 1 1 89 89 GLU N N 89 125.309 125.309 122.574 2.735 25294 3336 1 8 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.424 -0.066 25294 3337 1 8 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.227 -3.214 25294 3338 1 8 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.942 -2.858 25294 3339 1 8 . 1 1 90 90 THR N N 90 112.516 112.516 112.852 -0.336 25294 3340 1 8 . 1 1 90 90 THR HA H 90 4.534 4.534 4.592 -0.058 25294 3341 1 8 . 1 1 90 90 THR CA C 90 58.161 58.161 60.211 -2.050 25294 3342 1 8 . 1 1 90 90 THR CB C 90 68.409 68.409 71.787 -3.378 25294 3343 1 8 . 1 1 91 91 ASN N N 91 116.717 116.717 118.070 -1.353 25294 3344 1 8 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.712 -0.005 25294 3345 1 8 . 1 1 91 91 ASN CA C 91 49.796 49.796 52.332 -2.536 25294 3346 1 8 . 1 1 91 91 ASN CB C 91 35.474 35.474 37.282 -1.808 25294 3347 1 8 . 1 1 92 92 ALA N N 92 122.025 122.025 122.940 -0.915 25294 3348 1 8 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.596 0.040 25294 3349 1 8 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.773 -2.724 25294 3350 1 8 . 1 1 92 92 ALA CB C 92 19.716 19.716 21.085 -1.369 25294 3351 1 8 . 1 1 93 93 SER N N 93 115.895 115.895 115.918 -0.023 25294 3352 1 8 . 1 1 93 93 SER HA H 93 4.536 4.536 5.178 -0.642 25294 3353 1 8 . 1 1 93 93 SER CA C 93 54.865 54.865 56.814 -1.949 25294 3354 1 8 . 1 1 93 93 SER CB C 93 61.292 61.292 64.570 -3.278 25294 3355 1 8 . 1 1 94 94 ARG N N 94 119.529 119.529 125.566 -6.037 25294 3356 1 8 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.615 0.299 25294 3357 1 8 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.103 -2.007 25294 3358 1 8 . 1 1 94 94 ARG CB C 94 29.512 29.512 30.967 -1.455 25294 3359 1 8 . 1 1 95 95 SER N N 95 114.542 114.542 114.019 0.523 25294 3360 1 8 . 1 1 95 95 SER HA H 95 5.926 5.926 4.816 1.110 25294 3361 1 8 . 1 1 95 95 SER CA C 95 54.219 54.219 57.011 -2.792 25294 3362 1 8 . 1 1 95 95 SER CB C 95 65.271 65.271 64.945 0.326 25294 3363 1 8 . 1 1 96 96 PHE N N 96 117.183 117.183 117.372 -0.189 25294 3364 1 8 . 1 1 96 96 PHE HA H 96 5.338 5.338 4.962 0.376 25294 3365 1 8 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.383 -1.903 25294 3366 1 8 . 1 1 96 96 PHE CB C 96 38.868 38.868 40.293 -1.425 25294 3367 1 8 . 1 1 97 97 THR N N 97 115.263 115.263 114.509 0.754 25294 3368 1 8 . 1 1 97 97 THR HA H 97 5.250 5.250 5.122 0.128 25294 3369 1 8 . 1 1 97 97 THR CA C 97 58.178 58.178 61.342 -3.164 25294 3370 1 8 . 1 1 97 97 THR CB C 97 69.068 69.068 72.122 -3.054 25294 3371 1 8 . 1 1 98 98 VAL N N 98 125.442 125.442 122.707 2.735 25294 3372 1 8 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.350 0.507 25294 3373 1 8 . 1 1 98 98 VAL CA C 98 57.409 57.409 61.202 -3.793 25294 3374 1 8 . 1 1 98 98 VAL CB C 98 32.929 32.929 35.126 -2.197 25294 3375 1 8 . 1 1 99 99 CYS N N 99 127.111 127.111 127.259 -0.148 25294 3376 1 8 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.194 0.152 25294 3377 1 8 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.635 -2.684 25294 3378 1 8 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.506 -4.564 25294 3379 1 8 . 1 1 100 100 VAL N N 100 120.146 120.146 122.232 -2.086 25294 3380 1 8 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.055 0.328 25294 3381 1 8 . 1 1 100 100 VAL CA C 100 55.713 55.713 58.968 -3.255 25294 3382 1 8 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.273 -1.630 25294 3383 1 8 . 1 1 101 101 GLU N N 101 118.807 118.807 118.927 -0.120 25294 3384 1 8 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.380 0.372 25294 3385 1 8 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.523 -2.088 25294 3386 1 8 . 1 1 101 101 GLU CB C 101 31.721 31.721 32.894 -1.173 25294 3387 1 8 . 1 1 102 102 ALA N N 102 124.088 124.088 124.429 -0.341 25294 3388 1 8 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.839 -0.982 25294 3389 1 8 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.459 -2.581 25294 3390 1 8 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.799 -1.774 25294 3391 1 8 . 1 1 103 103 GLY N N 103 111.186 111.186 109.000 2.186 25294 3392 1 8 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.331 -0.688 25294 3393 1 8 . 1 1 104 104 ASN N N 104 123.092 123.092 125.339 -2.247 25294 3394 1 8 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.816 -0.144 25294 3395 1 8 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.010 -2.314 25294 3396 1 8 . 1 1 104 104 ASN CB C 104 36.407 36.407 37.936 -1.529 25294 3397 1 8 . 1 1 105 105 ALA N N 105 122.653 122.653 120.514 2.139 25294 3398 1 8 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.520 -0.089 25294 3399 1 8 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.817 -3.149 25294 3400 1 8 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.058 -2.122 25294 3401 1 8 . 1 1 106 106 PHE N N 106 116.011 116.011 118.368 -2.357 25294 3402 1 8 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.012 0.405 25294 3403 1 8 . 1 1 106 106 PHE CA C 106 53.558 53.558 57.424 -3.866 25294 3404 1 8 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.322 -1.839 25294 3405 1 8 . 1 1 107 107 ASP N N 107 121.992 121.992 126.107 -4.115 25294 3406 1 8 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.778 -0.184 25294 3407 1 8 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.470 -2.946 25294 3408 1 8 . 1 1 107 107 ASP CB C 107 43.091 43.091 42.693 0.398 25294 3409 1 8 . 1 1 108 108 GLU N N 108 119.354 119.354 124.373 -5.019 25294 3410 1 8 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.707 0.302 25294 3411 1 8 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.425 -3.437 25294 3412 1 8 . 1 1 108 108 GLU CB C 108 31.317 31.317 31.286 0.031 25294 3413 1 8 . 1 1 109 109 PHE N N 109 122.098 122.098 122.054 0.044 25294 3414 1 8 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.874 0.084 25294 3415 1 8 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.448 -3.661 25294 3416 1 8 . 1 1 109 109 PHE CB C 109 40.443 40.443 42.123 -1.681 25294 3417 1 8 . 1 1 110 110 LYS N N 110 124.500 124.500 122.641 1.859 25294 3418 1 8 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.654 0.038 25294 3419 1 8 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.606 -3.715 25294 3420 1 8 . 1 1 110 110 LYS CB C 110 33.012 33.012 34.806 -1.794 25294 3421 1 8 . 1 1 111 111 PHE N N 111 125.010 125.010 122.329 2.681 25294 3422 1 8 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.592 -0.838 25294 3423 1 8 . 1 1 111 111 PHE CA C 111 58.184 58.184 55.808 2.376 25294 3424 1 8 . 1 1 111 111 PHE CB C 111 38.380 38.380 42.614 -4.234 25294 3425 1 8 . 1 1 112 112 VAL N N 112 122.957 122.957 120.023 2.934 25294 3426 1 8 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.622 -0.182 25294 3427 1 8 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.195 -2.939 25294 3428 1 8 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.721 -4.628 25294 3429 1 8 . 1 1 113 113 GLN N N 113 130.864 130.864 125.634 5.230 25294 3430 1 8 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.156 0.163 25294 3431 1 8 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.022 -2.903 25294 3432 1 8 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.401 -4.237 25294 3433 1 8 . 1 1 114 114 ASP N N 114 126.272 126.272 125.519 0.753 25294 3434 1 8 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.480 -0.153 25294 3435 1 8 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.110 -2.337 25294 3436 1 8 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.755 -2.900 25294 3437 1 8 . 1 1 115 115 ALA N N 115 120.134 120.134 122.597 -2.463 25294 3438 1 8 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.522 -0.823 25294 3439 1 8 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.081 -3.179 25294 3440 1 8 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.847 -2.096 25294 3441 1 8 . 1 1 116 116 ALA N N 116 121.377 121.377 125.572 -4.195 25294 3442 1 8 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.242 -0.289 25294 3443 1 8 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.114 -2.126 25294 3444 1 8 . 1 1 116 116 ALA CB C 116 16.200 16.200 18.882 -2.682 25294 3445 1 8 . 1 1 117 117 LYS N N 117 121.536 121.536 125.692 -4.156 25294 3446 1 8 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.391 -0.252 25294 3447 1 8 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.831 -2.185 25294 3448 1 8 . 1 1 117 117 LYS CB C 117 30.579 30.579 32.028 -1.449 25294 3449 1 9 . 1 1 5 5 SER N N 5 116.267 116.267 118.014 -1.747 25294 3450 1 9 . 1 1 5 5 SER HA H 5 4.349 4.349 4.640 -0.291 25294 3451 1 9 . 1 1 5 5 SER CA C 5 55.478 55.478 57.367 -1.889 25294 3452 1 9 . 1 1 5 5 SER CB C 5 61.191 61.191 64.828 -3.637 25294 3453 1 9 . 1 1 6 6 ASP N N 6 123.039 123.039 120.673 2.366 25294 3454 1 9 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.997 -0.170 25294 3455 1 9 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.039 -2.368 25294 3456 1 9 . 1 1 6 6 ASP CB C 6 38.656 38.656 39.987 -1.331 25294 3457 1 9 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.305 0.012 25294 3458 1 9 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.028 -2.881 25294 3459 1 9 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.123 -2.644 25294 3460 1 9 . 1 1 8 8 ASP N N 8 119.159 119.159 119.396 -0.237 25294 3461 1 9 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.865 -0.300 25294 3462 1 9 . 1 1 8 8 ASP CA C 8 51.860 51.860 53.715 -1.855 25294 3463 1 9 . 1 1 8 8 ASP CB C 8 38.725 38.725 40.350 -1.625 25294 3464 1 9 . 1 1 9 9 GLY N N 9 108.837 108.837 107.825 1.012 25294 3465 1 9 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.337 -2.201 25294 3466 1 9 . 1 1 10 10 LEU N N 10 121.571 121.571 120.090 1.481 25294 3467 1 9 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.773 -0.506 25294 3468 1 9 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.086 -1.695 25294 3469 1 9 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.833 -2.970 25294 3470 1 9 . 1 1 11 11 ALA N N 11 125.169 125.169 122.737 2.432 25294 3471 1 9 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.503 -0.167 25294 3472 1 9 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.396 -2.412 25294 3473 1 9 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.982 -2.800 25294 3474 1 9 . 1 1 12 12 ASP N N 12 122.672 122.672 121.222 1.450 25294 3475 1 9 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.115 -0.379 25294 3476 1 9 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.547 -1.845 25294 3477 1 9 . 1 1 12 12 ASP CB C 12 37.831 37.831 43.067 -5.236 25294 3478 1 9 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.478 -0.174 25294 3479 1 9 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.662 -3.062 25294 3480 1 9 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.397 -2.881 25294 3481 1 9 . 1 1 14 14 MET N N 14 120.151 120.151 120.092 0.059 25294 3482 1 9 . 1 1 14 14 MET HA H 14 3.780 3.780 4.702 -0.922 25294 3483 1 9 . 1 1 14 14 MET CA C 14 55.822 55.822 55.867 -0.045 25294 3484 1 9 . 1 1 14 14 MET CB C 14 30.909 30.909 33.148 -2.239 25294 3485 1 9 . 1 1 15 15 LYS N N 15 123.897 123.897 121.846 2.051 25294 3486 1 9 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.639 -0.182 25294 3487 1 9 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.538 -4.131 25294 3488 1 9 . 1 1 15 15 LYS CB C 15 32.453 32.453 34.657 -2.204 25294 3489 1 9 . 1 1 16 16 TRP N N 16 125.776 125.776 126.768 -0.992 25294 3490 1 9 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.373 -0.298 25294 3491 1 9 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.477 -2.825 25294 3492 1 9 . 1 1 16 16 TRP CB C 16 28.000 28.000 29.858 -1.858 25294 3493 1 9 . 1 1 17 17 SER N N 17 120.772 120.772 120.254 0.518 25294 3494 1 9 . 1 1 17 17 SER HA H 17 4.403 4.403 4.455 -0.053 25294 3495 1 9 . 1 1 17 17 SER CA C 17 56.167 56.167 59.943 -3.776 25294 3496 1 9 . 1 1 17 17 SER CB C 17 60.833 60.833 63.435 -2.602 25294 3497 1 9 . 1 1 18 18 LYS N N 18 121.096 121.096 120.889 0.207 25294 3498 1 9 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.634 0.084 25294 3499 1 9 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.774 -2.039 25294 3500 1 9 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.971 -3.054 25294 3501 1 9 . 1 1 19 19 VAL N N 19 116.358 116.358 118.667 -2.309 25294 3502 1 9 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.778 -0.355 25294 3503 1 9 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.326 -3.096 25294 3504 1 9 . 1 1 19 19 VAL CB C 19 31.026 31.026 33.820 -2.794 25294 3505 1 9 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.453 -0.150 25294 3506 1 9 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.267 -2.497 25294 3507 1 9 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.328 -2.775 25294 3508 1 9 . 1 1 21 21 SER N N 21 118.882 118.882 116.962 1.920 25294 3509 1 9 . 1 1 21 21 SER HA H 21 4.084 4.084 4.196 -0.112 25294 3510 1 9 . 1 1 21 21 SER CA C 21 57.657 57.657 60.274 -2.617 25294 3511 1 9 . 1 1 21 21 SER CB C 21 60.173 60.173 62.807 -2.634 25294 3512 1 9 . 1 1 22 22 GLY N N 22 109.523 109.523 110.317 -0.794 25294 3513 1 9 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.717 -2.313 25294 3514 1 9 . 1 1 23 23 LEU N N 23 123.003 123.003 122.105 0.898 25294 3515 1 9 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.304 -0.270 25294 3516 1 9 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.367 -1.764 25294 3517 1 9 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.327 -2.256 25294 3518 1 9 . 1 1 24 24 LYS N N 24 129.004 129.004 128.321 0.683 25294 3519 1 9 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.484 0.026 25294 3520 1 9 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.720 -2.483 25294 3521 1 9 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.979 -1.818 25294 3522 1 9 . 1 1 25 25 ASN N N 25 126.336 126.336 124.404 1.932 25294 3523 1 9 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.438 -0.114 25294 3524 1 9 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.308 -2.688 25294 3525 1 9 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.103 -3.119 25294 3526 1 9 . 1 1 26 26 GLY N N 26 103.076 103.076 103.159 -0.083 25294 3527 1 9 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.802 -1.253 25294 3528 1 9 . 1 1 27 27 GLU N N 27 120.878 120.878 122.860 -1.982 25294 3529 1 9 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.068 0.134 25294 3530 1 9 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.430 -4.197 25294 3531 1 9 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.434 -0.673 25294 3532 1 9 . 1 1 28 28 LEU N N 28 128.583 128.583 125.417 3.166 25294 3533 1 9 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.463 0.092 25294 3534 1 9 . 1 1 28 28 LEU CA C 28 50.324 50.324 52.611 -2.287 25294 3535 1 9 . 1 1 28 28 LEU CB C 28 43.517 43.517 41.055 2.462 25294 3536 1 9 . 1 1 29 29 LYS N N 29 127.554 127.554 125.063 2.491 25294 3537 1 9 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.774 0.127 25294 3538 1 9 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.355 -3.516 25294 3539 1 9 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.419 -3.896 25294 3540 1 9 . 1 1 30 30 VAL N N 30 127.915 127.915 122.072 5.843 25294 3541 1 9 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.344 -0.160 25294 3542 1 9 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.228 -1.920 25294 3543 1 9 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.860 -3.590 25294 3544 1 9 . 1 1 31 31 GLU N N 31 125.151 125.151 120.133 5.018 25294 3545 1 9 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.565 -0.204 25294 3546 1 9 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.405 -0.305 25294 3547 1 9 . 1 1 31 31 GLU CB C 31 27.703 27.703 32.228 -4.525 25294 3548 1 9 . 1 1 32 32 ALA N N 32 126.271 126.271 123.533 2.738 25294 3549 1 9 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.290 -0.274 25294 3550 1 9 . 1 1 32 32 ALA CA C 32 53.127 53.127 52.726 0.401 25294 3551 1 9 . 1 1 32 32 ALA CB C 32 15.266 15.266 17.176 -1.910 25294 3552 1 9 . 1 1 33 33 GLU N N 33 113.076 113.076 116.555 -3.479 25294 3553 1 9 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.499 -0.534 25294 3554 1 9 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.269 -0.284 25294 3555 1 9 . 1 1 33 33 GLU CB C 33 26.929 26.929 32.232 -5.303 25294 3556 1 9 . 1 1 34 34 GLY N N 34 104.905 104.905 107.884 -2.979 25294 3557 1 9 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.185 -4.478 25294 3558 1 9 . 1 1 35 35 GLY N N 35 105.946 105.946 106.210 -0.264 25294 3559 1 9 . 1 1 35 35 GLY CA C 35 42.988 42.988 45.182 -2.194 25294 3560 1 9 . 1 1 36 36 SER N N 36 116.044 116.044 114.144 1.900 25294 3561 1 9 . 1 1 36 36 SER HA H 36 5.539 5.539 5.448 0.091 25294 3562 1 9 . 1 1 36 36 SER CA C 36 54.323 54.323 57.233 -2.910 25294 3563 1 9 . 1 1 36 36 SER CB C 36 62.808 62.808 66.047 -3.240 25294 3564 1 9 . 1 1 37 37 SER N N 37 119.501 119.501 113.742 5.759 25294 3565 1 9 . 1 1 37 37 SER HA H 37 4.712 4.712 4.702 0.010 25294 3566 1 9 . 1 1 37 37 SER CA C 37 55.548 55.548 57.143 -1.595 25294 3567 1 9 . 1 1 37 37 SER CB C 37 63.943 63.943 66.590 -2.647 25294 3568 1 9 . 1 1 38 38 LEU N N 38 125.962 125.962 121.877 4.085 25294 3569 1 9 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.202 0.051 25294 3570 1 9 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.670 -2.889 25294 3571 1 9 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.956 -3.122 25294 3572 1 9 . 1 1 39 39 PHE N N 39 124.707 124.707 123.492 1.215 25294 3573 1 9 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.400 -0.261 25294 3574 1 9 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.891 -3.760 25294 3575 1 9 . 1 1 39 39 PHE CB C 39 38.952 38.952 41.489 -2.537 25294 3576 1 9 . 1 1 40 40 ALA N N 40 124.994 124.994 127.242 -2.248 25294 3577 1 9 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.056 0.579 25294 3578 1 9 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.571 -2.270 25294 3579 1 9 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.541 -0.095 25294 3580 1 9 . 1 1 41 41 CYS N N 41 125.757 125.757 125.670 0.087 25294 3581 1 9 . 1 1 41 41 CYS HA H 41 4.146 4.146 3.930 0.216 25294 3582 1 9 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.418 -2.953 25294 3583 1 9 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.110 -1.137 25294 3584 1 9 . 1 1 42 42 LYS N N 42 129.019 129.019 125.557 3.462 25294 3585 1 9 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.125 0.135 25294 3586 1 9 . 1 1 42 42 LYS CA C 42 54.851 54.851 58.291 -3.440 25294 3587 1 9 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.793 -0.686 25294 3588 1 9 . 1 1 43 43 ASN N N 43 113.240 113.240 116.292 -3.052 25294 3589 1 9 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.622 -0.097 25294 3590 1 9 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.206 -2.971 25294 3591 1 9 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.769 -4.908 25294 3592 1 9 . 1 1 44 44 TYR N N 44 119.335 119.335 118.480 0.855 25294 3593 1 9 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.664 -0.107 25294 3594 1 9 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.156 -1.438 25294 3595 1 9 . 1 1 44 44 TYR CB C 44 37.372 37.372 39.730 -2.358 25294 3596 1 9 . 1 1 45 45 LYS N N 45 120.676 120.676 124.836 -4.160 25294 3597 1 9 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.551 -0.515 25294 3598 1 9 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.512 -1.974 25294 3599 1 9 . 1 1 45 45 LYS CB C 45 30.233 30.233 31.300 -1.067 25294 3600 1 9 . 1 1 46 46 SER N N 46 108.797 108.797 113.632 -4.835 25294 3601 1 9 . 1 1 46 46 SER HA H 46 4.388 4.388 4.741 -0.353 25294 3602 1 9 . 1 1 46 46 SER CA C 46 53.664 53.664 58.032 -4.368 25294 3603 1 9 . 1 1 46 46 SER CB C 46 61.810 61.810 64.363 -2.553 25294 3604 1 9 . 1 1 47 47 PHE N N 47 117.325 117.325 120.217 -2.892 25294 3605 1 9 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.333 -0.691 25294 3606 1 9 . 1 1 47 47 PHE CA C 47 53.617 53.617 55.594 -1.977 25294 3607 1 9 . 1 1 47 47 PHE CB C 47 37.101 37.101 41.925 -4.824 25294 3608 1 9 . 1 1 48 48 TRP N N 48 117.090 117.090 118.231 -1.141 25294 3609 1 9 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.003 0.232 25294 3610 1 9 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.849 -2.357 25294 3611 1 9 . 1 1 48 48 TRP CB C 48 29.895 29.895 30.892 -0.997 25294 3612 1 9 . 1 1 49 49 ILE N N 49 119.682 119.682 119.338 0.344 25294 3613 1 9 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.714 -0.683 25294 3614 1 9 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.063 -0.590 25294 3615 1 9 . 1 1 49 49 ILE CB C 49 36.436 36.436 38.253 -1.817 25294 3616 1 9 . 1 1 50 50 SER N N 50 124.071 124.071 121.152 2.919 25294 3617 1 9 . 1 1 50 50 SER HA H 50 4.708 4.708 4.959 -0.251 25294 3618 1 9 . 1 1 50 50 SER CA C 50 56.110 56.110 57.610 -1.500 25294 3619 1 9 . 1 1 50 50 SER CB C 50 63.816 63.816 64.742 -0.925 25294 3620 1 9 . 1 1 51 51 SER N N 51 111.253 111.253 115.154 -3.901 25294 3621 1 9 . 1 1 51 51 SER HA H 51 4.557 4.557 4.967 -0.410 25294 3622 1 9 . 1 1 51 51 SER CA C 51 55.564 55.564 57.649 -2.085 25294 3623 1 9 . 1 1 51 51 SER CB C 51 62.821 62.821 66.582 -3.760 25294 3624 1 9 . 1 1 52 52 VAL N N 52 121.147 121.147 119.177 1.970 25294 3625 1 9 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.608 0.123 25294 3626 1 9 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.853 -0.727 25294 3627 1 9 . 1 1 52 52 VAL CB C 52 32.500 32.500 36.363 -3.863 25294 3628 1 9 . 1 1 53 53 LYS N N 53 126.128 126.128 122.207 3.921 25294 3629 1 9 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.937 0.070 25294 3630 1 9 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.122 -2.399 25294 3631 1 9 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.364 -1.593 25294 3632 1 9 . 1 1 54 54 GLU N N 54 124.160 124.160 122.747 1.413 25294 3633 1 9 . 1 1 54 54 GLU HA H 54 4.758 4.758 4.184 0.574 25294 3634 1 9 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.786 -2.527 25294 3635 1 9 . 1 1 54 54 GLU CB C 54 31.059 31.059 32.186 -1.127 25294 3636 1 9 . 1 1 55 55 GLU N N 55 127.218 127.218 119.239 7.979 25294 3637 1 9 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.529 -0.622 25294 3638 1 9 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.436 -1.890 25294 3639 1 9 . 1 1 55 55 GLU CB C 55 25.294 25.294 29.981 -4.687 25294 3640 1 9 . 1 1 56 56 GLY N N 56 104.894 104.894 108.474 -3.580 25294 3641 1 9 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.561 -3.680 25294 3642 1 9 . 1 1 57 57 LYS N N 57 120.444 120.444 117.848 2.596 25294 3643 1 9 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.720 -0.156 25294 3644 1 9 . 1 1 57 57 LYS CA C 57 51.959 51.959 53.835 -1.876 25294 3645 1 9 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.070 -2.882 25294 3646 1 9 . 1 1 58 58 PHE N N 58 121.824 121.824 120.878 0.946 25294 3647 1 9 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.383 -0.612 25294 3648 1 9 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.796 -0.631 25294 3649 1 9 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.455 -3.553 25294 3650 1 9 . 1 1 59 59 LYS N N 59 123.205 123.205 119.800 3.405 25294 3651 1 9 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.710 -0.259 25294 3652 1 9 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.949 -3.964 25294 3653 1 9 . 1 1 59 59 LYS CB C 59 29.791 29.791 35.371 -5.580 25294 3654 1 9 . 1 1 60 60 GLU N N 60 122.647 122.647 119.931 2.716 25294 3655 1 9 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.143 0.117 25294 3656 1 9 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.813 -2.907 25294 3657 1 9 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.186 -2.523 25294 3658 1 9 . 1 1 61 61 ASN N N 61 119.907 119.907 116.305 3.602 25294 3659 1 9 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.169 0.676 25294 3660 1 9 . 1 1 61 61 ASN CA C 61 50.752 50.752 52.355 -1.603 25294 3661 1 9 . 1 1 61 61 ASN CB C 61 36.023 36.023 41.248 -5.226 25294 3662 1 9 . 1 1 62 62 THR N N 62 113.271 113.271 113.054 0.217 25294 3663 1 9 . 1 1 62 62 THR HA H 62 4.308 4.308 4.431 -0.123 25294 3664 1 9 . 1 1 62 62 THR CA C 62 59.310 59.310 62.661 -3.351 25294 3665 1 9 . 1 1 62 62 THR CB C 62 66.813 66.813 69.327 -2.514 25294 3666 1 9 . 1 1 63 63 SER N N 63 116.521 116.521 115.928 0.593 25294 3667 1 9 . 1 1 63 63 SER HA H 63 4.650 4.650 4.264 0.386 25294 3668 1 9 . 1 1 63 63 SER CA C 63 54.094 54.094 57.386 -3.292 25294 3669 1 9 . 1 1 63 63 SER CB C 63 61.617 61.617 64.803 -3.186 25294 3670 1 9 . 1 1 64 64 TYR N N 64 120.183 120.183 117.644 2.539 25294 3671 1 9 . 1 1 64 64 TYR HA H 64 4.838 4.838 5.014 -0.176 25294 3672 1 9 . 1 1 64 64 TYR CA C 64 56.403 56.403 57.015 -0.612 25294 3673 1 9 . 1 1 64 64 TYR CB C 64 36.569 36.569 37.948 -1.379 25294 3674 1 9 . 1 1 65 65 LYS N N 65 115.195 115.195 115.974 -0.779 25294 3675 1 9 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.490 0.231 25294 3676 1 9 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.870 -4.164 25294 3677 1 9 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.304 -2.484 25294 3678 1 9 . 1 1 66 66 GLU N N 66 117.231 117.231 117.078 0.153 25294 3679 1 9 . 1 1 66 66 GLU HA H 66 5.213 5.213 4.931 0.282 25294 3680 1 9 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.327 -2.714 25294 3681 1 9 . 1 1 66 66 GLU CB C 66 30.793 30.793 34.053 -3.260 25294 3682 1 9 . 1 1 67 67 PHE N N 67 121.532 121.532 117.958 3.574 25294 3683 1 9 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.797 -0.367 25294 3684 1 9 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.226 -0.957 25294 3685 1 9 . 1 1 67 67 PHE CB C 67 40.275 40.275 43.454 -3.179 25294 3686 1 9 . 1 1 68 68 ASP N N 68 128.157 128.157 123.749 4.408 25294 3687 1 9 . 1 1 68 68 ASP HA H 68 4.428 4.428 5.039 -0.611 25294 3688 1 9 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.506 -2.950 25294 3689 1 9 . 1 1 68 68 ASP CB C 68 38.424 38.424 42.764 -4.340 25294 3690 1 9 . 1 1 69 69 GLY N N 69 114.151 114.151 112.192 1.959 25294 3691 1 9 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.140 -3.241 25294 3692 1 9 . 1 1 70 70 GLY N N 70 113.714 113.714 110.326 3.388 25294 3693 1 9 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.579 -1.585 25294 3694 1 9 . 1 1 71 71 TRP N N 71 117.823 117.823 121.621 -3.798 25294 3695 1 9 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.541 0.267 25294 3696 1 9 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.577 -3.800 25294 3697 1 9 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.223 -4.578 25294 3698 1 9 . 1 1 72 72 TYR N N 72 114.204 114.204 119.985 -5.781 25294 3699 1 9 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.954 0.171 25294 3700 1 9 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.492 -6.057 25294 3701 1 9 . 1 1 72 72 TYR CB C 72 38.620 38.620 39.694 -1.074 25294 3702 1 9 . 1 1 73 73 LEU N N 73 121.469 121.469 127.727 -6.258 25294 3703 1 9 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.045 -0.278 25294 3704 1 9 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.166 -1.834 25294 3705 1 9 . 1 1 73 73 LEU CB C 73 43.403 43.403 45.897 -2.494 25294 3706 1 9 . 1 1 74 74 VAL N N 74 124.558 124.558 126.078 -1.520 25294 3707 1 9 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.697 0.086 25294 3708 1 9 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.082 -3.270 25294 3709 1 9 . 1 1 74 74 VAL CB C 74 31.820 31.820 33.902 -2.082 25294 3710 1 9 . 1 1 75 75 LYS N N 75 125.824 125.824 126.634 -0.810 25294 3711 1 9 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.011 0.099 25294 3712 1 9 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.686 -2.882 25294 3713 1 9 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.031 -2.456 25294 3714 1 9 . 1 1 76 76 ILE N N 76 124.647 124.647 125.390 -0.743 25294 3715 1 9 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.837 0.241 25294 3716 1 9 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.426 -3.059 25294 3717 1 9 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.607 -2.014 25294 3718 1 9 . 1 1 77 77 GLU N N 77 128.081 128.081 127.494 0.587 25294 3719 1 9 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.676 -0.232 25294 3720 1 9 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.152 -2.681 25294 3721 1 9 . 1 1 77 77 GLU CB C 77 29.914 29.914 32.287 -2.373 25294 3722 1 9 . 1 1 78 78 ASP N N 78 126.158 126.158 125.377 0.781 25294 3723 1 9 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.309 -0.209 25294 3724 1 9 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.410 -3.348 25294 3725 1 9 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.355 -3.617 25294 3726 1 9 . 1 1 79 79 ASN N N 79 118.653 118.653 116.342 2.311 25294 3727 1 9 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.983 -0.337 25294 3728 1 9 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.351 -2.142 25294 3729 1 9 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.714 -5.364 25294 3730 1 9 . 1 1 80 80 GLU N N 80 120.378 120.378 122.369 -1.991 25294 3731 1 9 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.266 0.243 25294 3732 1 9 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.365 -2.505 25294 3733 1 9 . 1 1 80 80 GLU CB C 80 29.673 29.673 31.194 -1.521 25294 3734 1 9 . 1 1 81 81 LEU N N 81 125.771 125.771 129.310 -3.539 25294 3735 1 9 . 1 1 81 81 LEU HA H 81 4.966 4.966 4.946 0.020 25294 3736 1 9 . 1 1 81 81 LEU CA C 81 51.014 51.014 55.018 -4.004 25294 3737 1 9 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.162 -0.612 25294 3738 1 9 . 1 1 82 82 LYS N N 82 128.076 128.076 127.060 1.016 25294 3739 1 9 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.302 -0.057 25294 3740 1 9 . 1 1 82 82 LYS CA C 82 52.332 52.332 55.027 -2.695 25294 3741 1 9 . 1 1 82 82 LYS CB C 82 32.179 32.179 34.872 -2.693 25294 3742 1 9 . 1 1 83 83 VAL N N 83 124.216 124.216 120.652 3.564 25294 3743 1 9 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.997 -0.089 25294 3744 1 9 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.367 -1.987 25294 3745 1 9 . 1 1 83 83 VAL CB C 83 32.168 32.168 36.503 -4.335 25294 3746 1 9 . 1 1 84 84 ILE N N 84 129.084 129.084 125.775 3.309 25294 3747 1 9 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.711 -0.181 25294 3748 1 9 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.968 -1.562 25294 3749 1 9 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.816 -3.650 25294 3750 1 9 . 1 1 85 85 ILE N N 85 127.360 127.360 123.591 3.769 25294 3751 1 9 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.848 -0.263 25294 3752 1 9 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.349 -0.889 25294 3753 1 9 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.961 -2.463 25294 3754 1 9 . 1 1 86 86 ASN N N 86 128.337 128.337 122.923 5.414 25294 3755 1 9 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.971 -0.205 25294 3756 1 9 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.572 -2.390 25294 3757 1 9 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.445 -3.554 25294 3758 1 9 . 1 1 87 87 ARG N N 87 119.368 119.368 119.867 -0.499 25294 3759 1 9 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.102 -0.111 25294 3760 1 9 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.801 -2.603 25294 3761 1 9 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.946 -2.543 25294 3762 1 9 . 1 1 88 88 ASN N N 88 125.082 125.082 121.437 3.645 25294 3763 1 9 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.511 0.214 25294 3764 1 9 . 1 1 88 88 ASN CA C 88 49.103 49.103 52.910 -3.807 25294 3765 1 9 . 1 1 88 88 ASN CB C 88 34.757 34.757 39.426 -4.669 25294 3766 1 9 . 1 1 89 89 GLU N N 89 125.309 125.309 121.969 3.340 25294 3767 1 9 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.349 0.009 25294 3768 1 9 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.096 -3.083 25294 3769 1 9 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.513 -2.429 25294 3770 1 9 . 1 1 90 90 THR N N 90 112.516 112.516 111.280 1.236 25294 3771 1 9 . 1 1 90 90 THR HA H 90 4.534 4.534 4.550 -0.016 25294 3772 1 9 . 1 1 90 90 THR CA C 90 58.161 58.161 60.226 -2.065 25294 3773 1 9 . 1 1 90 90 THR CB C 90 68.409 68.409 72.462 -4.053 25294 3774 1 9 . 1 1 91 91 ASN N N 91 116.717 116.717 119.851 -3.134 25294 3775 1 9 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.850 -0.143 25294 3776 1 9 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.353 -3.557 25294 3777 1 9 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.234 -2.760 25294 3778 1 9 . 1 1 92 92 ALA N N 92 122.025 122.025 123.042 -1.017 25294 3779 1 9 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.624 0.012 25294 3780 1 9 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.425 -2.376 25294 3781 1 9 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.541 -0.825 25294 3782 1 9 . 1 1 93 93 SER N N 93 115.895 115.895 119.600 -3.705 25294 3783 1 9 . 1 1 93 93 SER HA H 93 4.536 4.536 4.754 -0.218 25294 3784 1 9 . 1 1 93 93 SER CA C 93 54.865 54.865 58.633 -3.768 25294 3785 1 9 . 1 1 93 93 SER CB C 93 61.292 61.292 64.185 -2.893 25294 3786 1 9 . 1 1 94 94 ARG N N 94 119.529 119.529 118.944 0.585 25294 3787 1 9 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.721 0.193 25294 3788 1 9 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.724 -2.628 25294 3789 1 9 . 1 1 94 94 ARG CB C 94 29.512 29.512 32.845 -3.333 25294 3790 1 9 . 1 1 95 95 SER N N 95 114.542 114.542 113.349 1.193 25294 3791 1 9 . 1 1 95 95 SER HA H 95 5.926 5.926 5.021 0.905 25294 3792 1 9 . 1 1 95 95 SER CA C 95 54.219 54.219 57.464 -3.245 25294 3793 1 9 . 1 1 95 95 SER CB C 95 65.271 65.271 66.319 -1.048 25294 3794 1 9 . 1 1 96 96 PHE N N 96 117.183 117.183 118.454 -1.271 25294 3795 1 9 . 1 1 96 96 PHE HA H 96 5.338 5.338 4.973 0.365 25294 3796 1 9 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.935 -2.455 25294 3797 1 9 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.810 -4.942 25294 3798 1 9 . 1 1 97 97 THR N N 97 115.263 115.263 118.436 -3.173 25294 3799 1 9 . 1 1 97 97 THR HA H 97 5.250 5.250 4.956 0.294 25294 3800 1 9 . 1 1 97 97 THR CA C 97 58.178 58.178 61.865 -3.687 25294 3801 1 9 . 1 1 97 97 THR CB C 97 69.068 69.068 70.386 -1.319 25294 3802 1 9 . 1 1 98 98 VAL N N 98 125.442 125.442 128.183 -2.741 25294 3803 1 9 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.215 0.642 25294 3804 1 9 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.631 -3.222 25294 3805 1 9 . 1 1 98 98 VAL CB C 98 32.929 32.929 30.181 2.748 25294 3806 1 9 . 1 1 99 99 CYS N N 99 127.111 127.111 127.609 -0.498 25294 3807 1 9 . 1 1 99 99 CYS HA H 99 5.346 5.346 4.721 0.625 25294 3808 1 9 . 1 1 99 99 CYS CA C 99 53.951 53.951 59.299 -5.348 25294 3809 1 9 . 1 1 99 99 CYS CB C 99 25.942 25.942 27.691 -1.749 25294 3810 1 9 . 1 1 100 100 VAL N N 100 120.146 120.146 123.242 -3.096 25294 3811 1 9 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.268 0.115 25294 3812 1 9 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.129 -3.416 25294 3813 1 9 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.399 -2.756 25294 3814 1 9 . 1 1 101 101 GLU N N 101 118.807 118.807 122.337 -3.530 25294 3815 1 9 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.878 -0.126 25294 3816 1 9 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.654 -3.219 25294 3817 1 9 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.713 -1.992 25294 3818 1 9 . 1 1 102 102 ALA N N 102 124.088 124.088 127.728 -3.640 25294 3819 1 9 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.753 -0.896 25294 3820 1 9 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.231 -2.353 25294 3821 1 9 . 1 1 102 102 ALA CB C 102 18.025 18.025 20.950 -2.925 25294 3822 1 9 . 1 1 103 103 GLY N N 103 111.186 111.186 106.236 4.950 25294 3823 1 9 . 1 1 103 103 GLY CA C 103 44.643 44.643 47.426 -2.783 25294 3824 1 9 . 1 1 104 104 ASN N N 104 123.092 123.092 115.729 7.363 25294 3825 1 9 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.752 -0.080 25294 3826 1 9 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.153 -2.457 25294 3827 1 9 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.832 -3.425 25294 3828 1 9 . 1 1 105 105 ALA N N 105 122.653 122.653 120.314 2.339 25294 3829 1 9 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.151 0.280 25294 3830 1 9 . 1 1 105 105 ALA CA C 105 48.668 48.668 50.443 -1.775 25294 3831 1 9 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.287 -2.351 25294 3832 1 9 . 1 1 106 106 PHE N N 106 116.011 116.011 114.592 1.419 25294 3833 1 9 . 1 1 106 106 PHE HA H 106 5.417 5.417 4.947 0.470 25294 3834 1 9 . 1 1 106 106 PHE CA C 106 53.558 53.558 55.248 -1.690 25294 3835 1 9 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.299 -1.815 25294 3836 1 9 . 1 1 107 107 ASP N N 107 121.992 121.992 119.282 2.710 25294 3837 1 9 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.894 -0.300 25294 3838 1 9 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.658 -2.134 25294 3839 1 9 . 1 1 107 107 ASP CB C 107 43.091 43.091 45.204 -2.113 25294 3840 1 9 . 1 1 108 108 GLU N N 108 119.354 119.354 120.735 -1.381 25294 3841 1 9 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.684 0.325 25294 3842 1 9 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.538 -3.550 25294 3843 1 9 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.318 -1.001 25294 3844 1 9 . 1 1 109 109 PHE N N 109 122.098 122.098 125.860 -3.762 25294 3845 1 9 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.935 0.023 25294 3846 1 9 . 1 1 109 109 PHE CA C 109 52.787 52.787 54.351 -1.564 25294 3847 1 9 . 1 1 109 109 PHE CB C 109 40.443 40.443 39.780 0.663 25294 3848 1 9 . 1 1 110 110 LYS N N 110 124.500 124.500 126.707 -2.207 25294 3849 1 9 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.711 -0.019 25294 3850 1 9 . 1 1 110 110 LYS CA C 110 51.891 51.891 56.116 -4.225 25294 3851 1 9 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.411 0.601 25294 3852 1 9 . 1 1 111 111 PHE N N 111 125.010 125.010 126.171 -1.161 25294 3853 1 9 . 1 1 111 111 PHE HA H 111 4.754 4.754 4.832 -0.078 25294 3854 1 9 . 1 1 111 111 PHE CA C 111 58.184 58.184 59.482 -1.298 25294 3855 1 9 . 1 1 111 111 PHE CB C 111 38.380 38.380 40.562 -2.182 25294 3856 1 9 . 1 1 112 112 VAL N N 112 122.957 122.957 122.699 0.258 25294 3857 1 9 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.671 -0.231 25294 3858 1 9 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.573 -3.317 25294 3859 1 9 . 1 1 112 112 VAL CB C 112 31.093 31.093 33.796 -2.703 25294 3860 1 9 . 1 1 113 113 GLN N N 113 130.864 130.864 126.853 4.011 25294 3861 1 9 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.515 0.804 25294 3862 1 9 . 1 1 113 113 GLN CA C 113 51.119 51.119 55.651 -4.532 25294 3863 1 9 . 1 1 113 113 GLN CB C 113 28.164 28.164 30.515 -2.351 25294 3864 1 9 . 1 1 114 114 ASP N N 114 126.272 126.272 126.707 -0.435 25294 3865 1 9 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.534 -0.207 25294 3866 1 9 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.002 -3.229 25294 3867 1 9 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.322 -2.467 25294 3868 1 9 . 1 1 115 115 ALA N N 115 120.134 120.134 120.825 -0.691 25294 3869 1 9 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.526 -0.827 25294 3870 1 9 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.395 -2.494 25294 3871 1 9 . 1 1 115 115 ALA CB C 115 17.751 17.751 20.817 -3.066 25294 3872 1 9 . 1 1 116 116 ALA N N 116 121.377 121.377 123.630 -2.253 25294 3873 1 9 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.495 -0.542 25294 3874 1 9 . 1 1 116 116 ALA CA C 116 49.988 49.988 50.931 -0.943 25294 3875 1 9 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.793 -3.592 25294 3876 1 9 . 1 1 117 117 LYS N N 117 121.536 121.536 125.923 -4.387 25294 3877 1 9 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.309 -0.170 25294 3878 1 9 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.879 -2.233 25294 3879 1 9 . 1 1 117 117 LYS CB C 117 30.579 30.579 30.969 -0.390 25294 3880 1 10 . 1 1 5 5 SER N N 5 116.267 116.267 119.397 -3.130 25294 3881 1 10 . 1 1 5 5 SER HA H 5 4.349 4.349 4.661 -0.312 25294 3882 1 10 . 1 1 5 5 SER CA C 5 55.478 55.478 57.285 -1.807 25294 3883 1 10 . 1 1 5 5 SER CB C 5 61.191 61.191 65.052 -3.861 25294 3884 1 10 . 1 1 6 6 ASP N N 6 123.039 123.039 120.388 2.651 25294 3885 1 10 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.993 -0.166 25294 3886 1 10 . 1 1 6 6 ASP CA C 6 49.671 49.671 51.910 -2.239 25294 3887 1 10 . 1 1 6 6 ASP CB C 6 38.656 38.656 39.495 -0.839 25294 3888 1 10 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.278 0.039 25294 3889 1 10 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.263 -3.116 25294 3890 1 10 . 1 1 7 7 PRO CB C 7 29.478 29.478 31.992 -2.514 25294 3891 1 10 . 1 1 8 8 ASP N N 8 119.159 119.159 120.768 -1.609 25294 3892 1 10 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.729 -0.164 25294 3893 1 10 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.328 -2.467 25294 3894 1 10 . 1 1 8 8 ASP CB C 8 38.725 38.725 39.148 -0.423 25294 3895 1 10 . 1 1 9 9 GLY N N 9 108.837 108.837 107.460 1.377 25294 3896 1 10 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.169 -2.034 25294 3897 1 10 . 1 1 10 10 LEU N N 10 121.571 121.571 120.426 1.145 25294 3898 1 10 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.628 -0.361 25294 3899 1 10 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.441 -2.050 25294 3900 1 10 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.483 -2.620 25294 3901 1 10 . 1 1 11 11 ALA N N 11 125.169 125.169 122.236 2.933 25294 3902 1 10 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.540 -0.204 25294 3903 1 10 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.404 -2.420 25294 3904 1 10 . 1 1 11 11 ALA CB C 11 17.182 17.182 20.602 -3.420 25294 3905 1 10 . 1 1 12 12 ASP N N 12 122.672 122.672 122.134 0.538 25294 3906 1 10 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.162 -0.426 25294 3907 1 10 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.177 -1.475 25294 3908 1 10 . 1 1 12 12 ASP CB C 12 37.831 37.831 42.653 -4.822 25294 3909 1 10 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.473 -0.169 25294 3910 1 10 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.443 -2.843 25294 3911 1 10 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.668 -3.152 25294 3912 1 10 . 1 1 14 14 MET N N 14 120.151 120.151 118.684 1.467 25294 3913 1 10 . 1 1 14 14 MET HA H 14 3.780 3.780 4.570 -0.790 25294 3914 1 10 . 1 1 14 14 MET CA C 14 55.822 55.822 54.470 1.352 25294 3915 1 10 . 1 1 14 14 MET CB C 14 30.909 30.909 30.050 0.859 25294 3916 1 10 . 1 1 15 15 LYS N N 15 123.897 123.897 121.701 2.196 25294 3917 1 10 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.048 0.409 25294 3918 1 10 . 1 1 15 15 LYS CA C 15 51.407 51.407 57.182 -5.776 25294 3919 1 10 . 1 1 15 15 LYS CB C 15 32.453 32.453 32.515 -0.062 25294 3920 1 10 . 1 1 16 16 TRP N N 16 125.776 125.776 125.470 0.306 25294 3921 1 10 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.218 -0.143 25294 3922 1 10 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.371 -2.719 25294 3923 1 10 . 1 1 16 16 TRP CB C 16 28.000 28.000 29.788 -1.788 25294 3924 1 10 . 1 1 17 17 SER N N 17 120.772 120.772 119.279 1.493 25294 3925 1 10 . 1 1 17 17 SER HA H 17 4.403 4.403 4.466 -0.063 25294 3926 1 10 . 1 1 17 17 SER CA C 17 56.167 56.167 59.895 -3.728 25294 3927 1 10 . 1 1 17 17 SER CB C 17 60.833 60.833 63.627 -2.795 25294 3928 1 10 . 1 1 18 18 LYS N N 18 121.096 121.096 121.217 -0.121 25294 3929 1 10 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.613 0.105 25294 3930 1 10 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.668 -1.933 25294 3931 1 10 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.084 -2.167 25294 3932 1 10 . 1 1 19 19 VAL N N 19 116.358 116.358 120.271 -3.913 25294 3933 1 10 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.641 -0.218 25294 3934 1 10 . 1 1 19 19 VAL CA C 19 55.230 55.230 57.733 -2.502 25294 3935 1 10 . 1 1 19 19 VAL CB C 19 31.026 31.026 33.406 -2.380 25294 3936 1 10 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.687 -0.384 25294 3937 1 10 . 1 1 20 20 PRO CA C 20 59.770 59.770 61.809 -2.039 25294 3938 1 10 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.932 -3.379 25294 3939 1 10 . 1 1 21 21 SER N N 21 118.882 118.882 115.173 3.709 25294 3940 1 10 . 1 1 21 21 SER HA H 21 4.084 4.084 4.212 -0.128 25294 3941 1 10 . 1 1 21 21 SER CA C 21 57.657 57.657 60.142 -2.485 25294 3942 1 10 . 1 1 21 21 SER CB C 21 60.173 60.173 62.933 -2.760 25294 3943 1 10 . 1 1 22 22 GLY N N 22 109.523 109.523 109.519 0.004 25294 3944 1 10 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.744 -2.340 25294 3945 1 10 . 1 1 23 23 LEU N N 23 123.003 123.003 121.360 1.643 25294 3946 1 10 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.745 -0.711 25294 3947 1 10 . 1 1 23 23 LEU CA C 23 53.603 53.603 54.844 -1.241 25294 3948 1 10 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.955 -2.884 25294 3949 1 10 . 1 1 24 24 LYS N N 24 129.004 129.004 127.868 1.136 25294 3950 1 10 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.535 -0.025 25294 3951 1 10 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.617 -2.381 25294 3952 1 10 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.878 -1.717 25294 3953 1 10 . 1 1 25 25 ASN N N 25 126.336 126.336 124.937 1.399 25294 3954 1 10 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.447 -0.123 25294 3955 1 10 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.650 -2.030 25294 3956 1 10 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.135 -3.150 25294 3957 1 10 . 1 1 26 26 GLY N N 26 103.076 103.076 102.202 0.874 25294 3958 1 10 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.019 -1.470 25294 3959 1 10 . 1 1 27 27 GLU N N 27 120.878 120.878 121.791 -0.913 25294 3960 1 10 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.725 0.477 25294 3961 1 10 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.810 -4.577 25294 3962 1 10 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.322 -0.561 25294 3963 1 10 . 1 1 28 28 LEU N N 28 128.583 128.583 125.904 2.679 25294 3964 1 10 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.962 -0.407 25294 3965 1 10 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.027 -2.703 25294 3966 1 10 . 1 1 28 28 LEU CB C 28 43.517 43.517 42.386 1.131 25294 3967 1 10 . 1 1 29 29 LYS N N 29 127.554 127.554 126.083 1.471 25294 3968 1 10 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.281 0.620 25294 3969 1 10 . 1 1 29 29 LYS CA C 29 52.839 52.839 57.024 -4.185 25294 3970 1 10 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.048 -3.525 25294 3971 1 10 . 1 1 30 30 VAL N N 30 127.915 127.915 123.111 4.804 25294 3972 1 10 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.521 -0.337 25294 3973 1 10 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.367 -2.058 25294 3974 1 10 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.009 -3.739 25294 3975 1 10 . 1 1 31 31 GLU N N 31 125.151 125.151 125.514 -0.363 25294 3976 1 10 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.413 -0.052 25294 3977 1 10 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.589 -1.489 25294 3978 1 10 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.939 -3.236 25294 3979 1 10 . 1 1 32 32 ALA N N 32 126.271 126.271 121.583 4.688 25294 3980 1 10 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.274 -0.258 25294 3981 1 10 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.650 -1.523 25294 3982 1 10 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.602 -3.336 25294 3983 1 10 . 1 1 33 33 GLU N N 33 113.076 113.076 115.310 -2.234 25294 3984 1 10 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.203 -0.238 25294 3985 1 10 . 1 1 33 33 GLU CA C 33 55.985 55.985 57.178 -1.193 25294 3986 1 10 . 1 1 33 33 GLU CB C 33 26.929 26.929 29.805 -2.876 25294 3987 1 10 . 1 1 34 34 GLY N N 34 104.905 104.905 108.285 -3.380 25294 3988 1 10 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.057 -4.350 25294 3989 1 10 . 1 1 35 35 GLY N N 35 105.946 105.946 105.415 0.531 25294 3990 1 10 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.634 -1.646 25294 3991 1 10 . 1 1 36 36 SER N N 36 116.044 116.044 114.475 1.569 25294 3992 1 10 . 1 1 36 36 SER HA H 36 5.539 5.539 5.282 0.257 25294 3993 1 10 . 1 1 36 36 SER CA C 36 54.323 54.323 57.412 -3.089 25294 3994 1 10 . 1 1 36 36 SER CB C 36 62.808 62.808 66.212 -3.404 25294 3995 1 10 . 1 1 37 37 SER N N 37 119.501 119.501 114.419 5.082 25294 3996 1 10 . 1 1 37 37 SER HA H 37 4.712 4.712 4.706 0.006 25294 3997 1 10 . 1 1 37 37 SER CA C 37 55.548 55.548 58.014 -2.466 25294 3998 1 10 . 1 1 37 37 SER CB C 37 63.943 63.943 66.347 -2.404 25294 3999 1 10 . 1 1 38 38 LEU N N 38 125.962 125.962 121.767 4.195 25294 4000 1 10 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.822 0.431 25294 4001 1 10 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.505 -2.723 25294 4002 1 10 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.752 -2.918 25294 4003 1 10 . 1 1 39 39 PHE N N 39 124.707 124.707 123.756 0.951 25294 4004 1 10 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.193 -0.054 25294 4005 1 10 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.033 -3.902 25294 4006 1 10 . 1 1 39 39 PHE CB C 39 38.952 38.952 41.109 -2.157 25294 4007 1 10 . 1 1 40 40 ALA N N 40 124.994 124.994 126.871 -1.877 25294 4008 1 10 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.783 -0.148 25294 4009 1 10 . 1 1 40 40 ALA CA C 40 48.301 48.301 49.706 -1.405 25294 4010 1 10 . 1 1 40 40 ALA CB C 40 19.446 19.446 21.599 -2.153 25294 4011 1 10 . 1 1 41 41 CYS N N 41 125.757 125.757 122.554 3.203 25294 4012 1 10 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.410 -0.264 25294 4013 1 10 . 1 1 41 41 CYS CA C 41 56.465 56.465 56.782 -0.317 25294 4014 1 10 . 1 1 41 41 CYS CB C 41 25.973 25.973 25.814 0.159 25294 4015 1 10 . 1 1 42 42 LYS N N 42 129.019 129.019 129.435 -0.416 25294 4016 1 10 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.240 0.020 25294 4017 1 10 . 1 1 42 42 LYS CA C 42 54.851 54.851 55.928 -1.077 25294 4018 1 10 . 1 1 42 42 LYS CB C 42 32.107 32.107 31.025 1.082 25294 4019 1 10 . 1 1 43 43 ASN N N 43 113.240 113.240 112.933 0.307 25294 4020 1 10 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.581 -0.056 25294 4021 1 10 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.101 -2.866 25294 4022 1 10 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.454 -4.593 25294 4023 1 10 . 1 1 44 44 TYR N N 44 119.335 119.335 118.567 0.768 25294 4024 1 10 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.575 -0.018 25294 4025 1 10 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.791 -2.073 25294 4026 1 10 . 1 1 44 44 TYR CB C 44 37.372 37.372 40.125 -2.753 25294 4027 1 10 . 1 1 45 45 LYS N N 45 120.676 120.676 120.746 -0.070 25294 4028 1 10 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.504 -0.468 25294 4029 1 10 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.645 -2.107 25294 4030 1 10 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.015 -2.782 25294 4031 1 10 . 1 1 46 46 SER N N 46 108.797 108.797 115.153 -6.356 25294 4032 1 10 . 1 1 46 46 SER HA H 46 4.388 4.388 4.814 -0.426 25294 4033 1 10 . 1 1 46 46 SER CA C 46 53.664 53.664 57.244 -3.580 25294 4034 1 10 . 1 1 46 46 SER CB C 46 61.810 61.810 63.157 -1.347 25294 4035 1 10 . 1 1 47 47 PHE N N 47 117.325 117.325 118.914 -1.589 25294 4036 1 10 . 1 1 47 47 PHE HA H 47 4.642 4.642 4.956 -0.314 25294 4037 1 10 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.284 -2.667 25294 4038 1 10 . 1 1 47 47 PHE CB C 47 37.101 37.101 41.708 -4.607 25294 4039 1 10 . 1 1 48 48 TRP N N 48 117.090 117.090 116.407 0.683 25294 4040 1 10 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.256 -0.021 25294 4041 1 10 . 1 1 48 48 TRP CA C 48 53.492 53.492 54.662 -1.170 25294 4042 1 10 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.427 -1.532 25294 4043 1 10 . 1 1 49 49 ILE N N 49 119.682 119.682 120.522 -0.840 25294 4044 1 10 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.298 -0.267 25294 4045 1 10 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.754 -1.281 25294 4046 1 10 . 1 1 49 49 ILE CB C 49 36.436 36.436 37.553 -1.117 25294 4047 1 10 . 1 1 50 50 SER N N 50 124.071 124.071 121.365 2.706 25294 4048 1 10 . 1 1 50 50 SER HA H 50 4.708 4.708 4.928 -0.220 25294 4049 1 10 . 1 1 50 50 SER CA C 50 56.110 56.110 58.316 -2.206 25294 4050 1 10 . 1 1 50 50 SER CB C 50 63.816 63.816 65.326 -1.510 25294 4051 1 10 . 1 1 51 51 SER N N 51 111.253 111.253 117.721 -6.468 25294 4052 1 10 . 1 1 51 51 SER HA H 51 4.557 4.557 4.677 -0.120 25294 4053 1 10 . 1 1 51 51 SER CA C 51 55.564 55.564 58.121 -2.557 25294 4054 1 10 . 1 1 51 51 SER CB C 51 62.821 62.821 66.103 -3.282 25294 4055 1 10 . 1 1 52 52 VAL N N 52 121.147 121.147 123.280 -2.133 25294 4056 1 10 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.637 0.094 25294 4057 1 10 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.739 -1.613 25294 4058 1 10 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.465 -2.965 25294 4059 1 10 . 1 1 53 53 LYS N N 53 126.128 126.128 123.411 2.717 25294 4060 1 10 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.821 0.186 25294 4061 1 10 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.239 -2.516 25294 4062 1 10 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.225 -1.453 25294 4063 1 10 . 1 1 54 54 GLU N N 54 124.160 124.160 123.039 1.121 25294 4064 1 10 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.167 1.591 25294 4065 1 10 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.755 -2.496 25294 4066 1 10 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.418 -0.359 25294 4067 1 10 . 1 1 55 55 GLU N N 55 127.218 127.218 118.924 8.294 25294 4068 1 10 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.408 -0.500 25294 4069 1 10 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.056 -1.510 25294 4070 1 10 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.630 -5.336 25294 4071 1 10 . 1 1 56 56 GLY N N 56 104.894 104.894 108.871 -3.977 25294 4072 1 10 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.339 -3.458 25294 4073 1 10 . 1 1 57 57 LYS N N 57 120.444 120.444 116.664 3.780 25294 4074 1 10 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.717 -0.153 25294 4075 1 10 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.203 -2.244 25294 4076 1 10 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.508 -2.320 25294 4077 1 10 . 1 1 58 58 PHE N N 58 121.824 121.824 119.685 2.139 25294 4078 1 10 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.132 -0.361 25294 4079 1 10 . 1 1 58 58 PHE CA C 58 56.165 56.165 57.551 -1.386 25294 4080 1 10 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.137 -3.235 25294 4081 1 10 . 1 1 59 59 LYS N N 59 123.205 123.205 119.491 3.714 25294 4082 1 10 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.757 -0.306 25294 4083 1 10 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.013 -4.028 25294 4084 1 10 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.881 -5.090 25294 4085 1 10 . 1 1 60 60 GLU N N 60 122.647 122.647 120.058 2.589 25294 4086 1 10 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.376 -0.116 25294 4087 1 10 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.348 -2.442 25294 4088 1 10 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.747 -3.083 25294 4089 1 10 . 1 1 61 61 ASN N N 61 119.907 119.907 118.066 1.841 25294 4090 1 10 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.905 -0.060 25294 4091 1 10 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.333 -2.581 25294 4092 1 10 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.476 -3.453 25294 4093 1 10 . 1 1 62 62 THR N N 62 113.271 113.271 116.313 -3.042 25294 4094 1 10 . 1 1 62 62 THR HA H 62 4.308 4.308 4.427 -0.119 25294 4095 1 10 . 1 1 62 62 THR CA C 62 59.310 59.310 61.888 -2.578 25294 4096 1 10 . 1 1 62 62 THR CB C 62 66.813 66.813 69.422 -2.609 25294 4097 1 10 . 1 1 63 63 SER N N 63 116.521 116.521 115.180 1.341 25294 4098 1 10 . 1 1 63 63 SER HA H 63 4.650 4.650 4.564 0.086 25294 4099 1 10 . 1 1 63 63 SER CA C 63 54.094 54.094 57.679 -3.585 25294 4100 1 10 . 1 1 63 63 SER CB C 63 61.617 61.617 65.235 -3.618 25294 4101 1 10 . 1 1 64 64 TYR N N 64 120.183 120.183 119.990 0.193 25294 4102 1 10 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.961 -0.123 25294 4103 1 10 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.417 -2.014 25294 4104 1 10 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.633 -3.064 25294 4105 1 10 . 1 1 65 65 LYS N N 65 115.195 115.195 117.377 -2.182 25294 4106 1 10 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.550 0.171 25294 4107 1 10 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.245 -3.539 25294 4108 1 10 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.250 -2.430 25294 4109 1 10 . 1 1 66 66 GLU N N 66 117.231 117.231 119.033 -1.802 25294 4110 1 10 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.074 0.139 25294 4111 1 10 . 1 1 66 66 GLU CA C 66 52.613 52.613 54.908 -2.295 25294 4112 1 10 . 1 1 66 66 GLU CB C 66 30.793 30.793 32.805 -2.012 25294 4113 1 10 . 1 1 67 67 PHE N N 67 121.532 121.532 126.630 -5.098 25294 4114 1 10 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.862 -0.432 25294 4115 1 10 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.073 -0.804 25294 4116 1 10 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.436 -2.161 25294 4117 1 10 . 1 1 68 68 ASP N N 68 128.157 128.157 126.452 1.705 25294 4118 1 10 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.677 -0.249 25294 4119 1 10 . 1 1 68 68 ASP CA C 68 49.556 49.556 51.713 -2.157 25294 4120 1 10 . 1 1 68 68 ASP CB C 68 38.424 38.424 41.893 -3.469 25294 4121 1 10 . 1 1 69 69 GLY N N 69 114.151 114.151 107.765 6.386 25294 4122 1 10 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.299 -3.400 25294 4123 1 10 . 1 1 70 70 GLY N N 70 113.714 113.714 110.437 3.277 25294 4124 1 10 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.548 -1.554 25294 4125 1 10 . 1 1 71 71 TRP N N 71 117.823 117.823 121.190 -3.367 25294 4126 1 10 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.580 0.228 25294 4127 1 10 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.108 -3.331 25294 4128 1 10 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.859 -4.214 25294 4129 1 10 . 1 1 72 72 TYR N N 72 114.204 114.204 120.583 -6.379 25294 4130 1 10 . 1 1 72 72 TYR HA H 72 5.125 5.125 5.083 0.042 25294 4131 1 10 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.582 -5.147 25294 4132 1 10 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.438 -1.818 25294 4133 1 10 . 1 1 73 73 LEU N N 73 121.469 121.469 126.558 -5.089 25294 4134 1 10 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.037 -0.270 25294 4135 1 10 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.039 -1.708 25294 4136 1 10 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.892 -3.489 25294 4137 1 10 . 1 1 74 74 VAL N N 74 124.558 124.558 122.497 2.061 25294 4138 1 10 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.854 -0.071 25294 4139 1 10 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.788 -2.976 25294 4140 1 10 . 1 1 74 74 VAL CB C 74 31.820 31.820 35.096 -3.276 25294 4141 1 10 . 1 1 75 75 LYS N N 75 125.824 125.824 126.444 -0.620 25294 4142 1 10 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.141 -0.031 25294 4143 1 10 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.617 -2.813 25294 4144 1 10 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.808 -2.233 25294 4145 1 10 . 1 1 76 76 ILE N N 76 124.647 124.647 125.089 -0.442 25294 4146 1 10 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.279 0.799 25294 4147 1 10 . 1 1 76 76 ILE CA C 76 57.367 57.367 61.120 -3.752 25294 4148 1 10 . 1 1 76 76 ILE CB C 76 37.593 37.593 38.369 -0.776 25294 4149 1 10 . 1 1 77 77 GLU N N 77 128.081 128.081 128.994 -0.913 25294 4150 1 10 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.607 -0.163 25294 4151 1 10 . 1 1 77 77 GLU CA C 77 52.471 52.471 54.547 -2.076 25294 4152 1 10 . 1 1 77 77 GLU CB C 77 29.914 29.914 33.004 -3.090 25294 4153 1 10 . 1 1 78 78 ASP N N 78 126.158 126.158 122.635 3.523 25294 4154 1 10 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.273 -0.173 25294 4155 1 10 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.544 -3.481 25294 4156 1 10 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.731 -3.993 25294 4157 1 10 . 1 1 79 79 ASN N N 79 118.653 118.653 115.827 2.826 25294 4158 1 10 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.009 -0.363 25294 4159 1 10 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.210 -2.001 25294 4160 1 10 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.813 -5.463 25294 4161 1 10 . 1 1 80 80 GLU N N 80 120.378 120.378 122.121 -1.743 25294 4162 1 10 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.241 0.268 25294 4163 1 10 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.221 -2.361 25294 4164 1 10 . 1 1 80 80 GLU CB C 80 29.673 29.673 31.223 -1.550 25294 4165 1 10 . 1 1 81 81 LEU N N 81 125.771 125.771 127.877 -2.106 25294 4166 1 10 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.051 -0.085 25294 4167 1 10 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.965 -3.951 25294 4168 1 10 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.435 -0.885 25294 4169 1 10 . 1 1 82 82 LYS N N 82 128.076 128.076 125.802 2.274 25294 4170 1 10 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.021 0.224 25294 4171 1 10 . 1 1 82 82 LYS CA C 82 52.332 52.332 55.090 -2.758 25294 4172 1 10 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.587 -4.408 25294 4173 1 10 . 1 1 83 83 VAL N N 83 124.216 124.216 122.461 1.755 25294 4174 1 10 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.929 -0.021 25294 4175 1 10 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.227 -1.847 25294 4176 1 10 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.382 -2.213 25294 4177 1 10 . 1 1 84 84 ILE N N 84 129.084 129.084 126.991 2.093 25294 4178 1 10 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.335 0.195 25294 4179 1 10 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.518 -2.112 25294 4180 1 10 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.196 -3.030 25294 4181 1 10 . 1 1 85 85 ILE N N 85 127.360 127.360 125.561 1.799 25294 4182 1 10 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.727 -0.142 25294 4183 1 10 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.849 -1.389 25294 4184 1 10 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.820 -2.322 25294 4185 1 10 . 1 1 86 86 ASN N N 86 128.337 128.337 125.166 3.171 25294 4186 1 10 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.853 -0.087 25294 4187 1 10 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.412 -3.230 25294 4188 1 10 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.284 -3.393 25294 4189 1 10 . 1 1 87 87 ARG N N 87 119.368 119.368 119.844 -0.476 25294 4190 1 10 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.211 -0.220 25294 4191 1 10 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.735 -2.537 25294 4192 1 10 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.776 -2.373 25294 4193 1 10 . 1 1 88 88 ASN N N 88 125.082 125.082 123.489 1.593 25294 4194 1 10 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.593 0.132 25294 4195 1 10 . 1 1 88 88 ASN CA C 88 49.103 49.103 52.052 -2.949 25294 4196 1 10 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.818 -4.061 25294 4197 1 10 . 1 1 89 89 GLU N N 89 125.309 125.309 123.710 1.599 25294 4198 1 10 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.428 -0.070 25294 4199 1 10 . 1 1 89 89 GLU CA C 89 53.013 53.013 55.742 -2.729 25294 4200 1 10 . 1 1 89 89 GLU CB C 89 27.084 27.084 27.703 -0.620 25294 4201 1 10 . 1 1 90 90 THR N N 90 112.516 112.516 110.824 1.692 25294 4202 1 10 . 1 1 90 90 THR HA H 90 4.534 4.534 4.677 -0.143 25294 4203 1 10 . 1 1 90 90 THR CA C 90 58.161 58.161 58.886 -0.725 25294 4204 1 10 . 1 1 90 90 THR CB C 90 68.409 68.409 71.887 -3.478 25294 4205 1 10 . 1 1 91 91 ASN N N 91 116.717 116.717 118.769 -2.052 25294 4206 1 10 . 1 1 91 91 ASN HA H 91 4.707 4.707 5.001 -0.294 25294 4207 1 10 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.022 -3.226 25294 4208 1 10 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.197 -2.723 25294 4209 1 10 . 1 1 92 92 ALA N N 92 122.025 122.025 123.154 -1.129 25294 4210 1 10 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.617 0.019 25294 4211 1 10 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.333 -2.284 25294 4212 1 10 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.650 -0.934 25294 4213 1 10 . 1 1 93 93 SER N N 93 115.895 115.895 120.220 -4.325 25294 4214 1 10 . 1 1 93 93 SER HA H 93 4.536 4.536 4.630 -0.094 25294 4215 1 10 . 1 1 93 93 SER CA C 93 54.865 54.865 58.870 -4.005 25294 4216 1 10 . 1 1 93 93 SER CB C 93 61.292 61.292 64.151 -2.859 25294 4217 1 10 . 1 1 94 94 ARG N N 94 119.529 119.529 119.095 0.434 25294 4218 1 10 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.696 0.218 25294 4219 1 10 . 1 1 94 94 ARG CA C 94 52.096 52.096 55.592 -3.496 25294 4220 1 10 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.085 -3.573 25294 4221 1 10 . 1 1 95 95 SER N N 95 114.542 114.542 114.310 0.232 25294 4222 1 10 . 1 1 95 95 SER HA H 95 5.926 5.926 5.073 0.853 25294 4223 1 10 . 1 1 95 95 SER CA C 95 54.219 54.219 57.934 -3.715 25294 4224 1 10 . 1 1 95 95 SER CB C 95 65.271 65.271 66.412 -1.141 25294 4225 1 10 . 1 1 96 96 PHE N N 96 117.183 117.183 120.847 -3.664 25294 4226 1 10 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.015 0.323 25294 4227 1 10 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.679 -2.199 25294 4228 1 10 . 1 1 96 96 PHE CB C 96 38.868 38.868 42.712 -3.844 25294 4229 1 10 . 1 1 97 97 THR N N 97 115.263 115.263 115.387 -0.124 25294 4230 1 10 . 1 1 97 97 THR HA H 97 5.250 5.250 5.282 -0.032 25294 4231 1 10 . 1 1 97 97 THR CA C 97 58.178 58.178 61.523 -3.345 25294 4232 1 10 . 1 1 97 97 THR CB C 97 69.068 69.068 72.424 -3.356 25294 4233 1 10 . 1 1 98 98 VAL N N 98 125.442 125.442 117.716 7.726 25294 4234 1 10 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.904 -0.047 25294 4235 1 10 . 1 1 98 98 VAL CA C 98 57.409 57.409 59.843 -2.434 25294 4236 1 10 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.077 -1.148 25294 4237 1 10 . 1 1 99 99 CYS N N 99 127.111 127.111 126.240 0.871 25294 4238 1 10 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.271 0.075 25294 4239 1 10 . 1 1 99 99 CYS CA C 99 53.951 53.951 57.691 -3.740 25294 4240 1 10 . 1 1 99 99 CYS CB C 99 25.942 25.942 27.650 -1.708 25294 4241 1 10 . 1 1 100 100 VAL N N 100 120.146 120.146 121.123 -0.977 25294 4242 1 10 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.084 0.299 25294 4243 1 10 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.681 -3.969 25294 4244 1 10 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.428 -1.785 25294 4245 1 10 . 1 1 101 101 GLU N N 101 118.807 118.807 121.707 -2.900 25294 4246 1 10 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.971 -0.219 25294 4247 1 10 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.420 -2.985 25294 4248 1 10 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.172 -1.451 25294 4249 1 10 . 1 1 102 102 ALA N N 102 124.088 124.088 125.599 -1.511 25294 4250 1 10 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.479 -0.622 25294 4251 1 10 . 1 1 102 102 ALA CA C 102 47.878 47.878 51.624 -3.746 25294 4252 1 10 . 1 1 102 102 ALA CB C 102 18.025 18.025 20.234 -2.209 25294 4253 1 10 . 1 1 103 103 GLY N N 103 111.186 111.186 107.831 3.355 25294 4254 1 10 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.496 -0.853 25294 4255 1 10 . 1 1 104 104 ASN N N 104 123.092 123.092 122.045 1.047 25294 4256 1 10 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.733 -0.061 25294 4257 1 10 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.830 -3.134 25294 4258 1 10 . 1 1 104 104 ASN CB C 104 36.407 36.407 38.845 -2.438 25294 4259 1 10 . 1 1 105 105 ALA N N 105 122.653 122.653 119.325 3.328 25294 4260 1 10 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.520 -0.089 25294 4261 1 10 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.359 -2.692 25294 4262 1 10 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.523 -1.587 25294 4263 1 10 . 1 1 106 106 PHE N N 106 116.011 116.011 113.911 2.100 25294 4264 1 10 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.427 -0.010 25294 4265 1 10 . 1 1 106 106 PHE CA C 106 53.558 53.558 55.988 -2.430 25294 4266 1 10 . 1 1 106 106 PHE CB C 106 40.484 40.484 41.945 -1.461 25294 4267 1 10 . 1 1 107 107 ASP N N 107 121.992 121.992 119.910 2.082 25294 4268 1 10 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.745 -0.151 25294 4269 1 10 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.101 -1.577 25294 4270 1 10 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.844 -1.754 25294 4271 1 10 . 1 1 108 108 GLU N N 108 119.354 119.354 122.176 -2.822 25294 4272 1 10 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.864 0.145 25294 4273 1 10 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.208 -3.220 25294 4274 1 10 . 1 1 108 108 GLU CB C 108 31.317 31.317 31.881 -0.564 25294 4275 1 10 . 1 1 109 109 PHE N N 109 122.098 122.098 127.037 -4.939 25294 4276 1 10 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.891 0.067 25294 4277 1 10 . 1 1 109 109 PHE CA C 109 52.787 52.787 55.716 -2.929 25294 4278 1 10 . 1 1 109 109 PHE CB C 109 40.443 40.443 39.853 0.590 25294 4279 1 10 . 1 1 110 110 LYS N N 110 124.500 124.500 125.242 -0.742 25294 4280 1 10 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.711 -0.019 25294 4281 1 10 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.447 -3.556 25294 4282 1 10 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.000 1.012 25294 4283 1 10 . 1 1 111 111 PHE N N 111 125.010 125.010 124.234 0.776 25294 4284 1 10 . 1 1 111 111 PHE HA H 111 4.754 4.754 4.903 -0.149 25294 4285 1 10 . 1 1 111 111 PHE CA C 111 58.184 58.184 59.456 -1.272 25294 4286 1 10 . 1 1 111 111 PHE CB C 111 38.380 38.380 40.188 -1.808 25294 4287 1 10 . 1 1 112 112 VAL N N 112 122.957 122.957 121.422 1.535 25294 4288 1 10 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.509 -0.069 25294 4289 1 10 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.007 -2.751 25294 4290 1 10 . 1 1 112 112 VAL CB C 112 31.093 31.093 34.765 -3.672 25294 4291 1 10 . 1 1 113 113 GLN N N 113 130.864 130.864 125.179 5.685 25294 4292 1 10 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.049 0.270 25294 4293 1 10 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.074 -2.955 25294 4294 1 10 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.546 -4.382 25294 4295 1 10 . 1 1 114 114 ASP N N 114 126.272 126.272 127.631 -1.359 25294 4296 1 10 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.728 -0.401 25294 4297 1 10 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.109 -3.336 25294 4298 1 10 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.267 -3.412 25294 4299 1 10 . 1 1 115 115 ALA N N 115 120.134 120.134 122.609 -2.475 25294 4300 1 10 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.235 -0.536 25294 4301 1 10 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.960 -3.059 25294 4302 1 10 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.883 -2.132 25294 4303 1 10 . 1 1 116 116 ALA N N 116 121.377 121.377 123.666 -2.289 25294 4304 1 10 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.460 -0.507 25294 4305 1 10 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.043 -1.055 25294 4306 1 10 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.959 -3.759 25294 4307 1 10 . 1 1 117 117 LYS N N 117 121.536 121.536 123.384 -1.848 25294 4308 1 10 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.235 -0.096 25294 4309 1 10 . 1 1 117 117 LYS CA C 117 53.646 53.646 56.018 -2.372 25294 4310 1 10 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.333 -0.754 25294 4311 1 11 . 1 1 5 5 SER N N 5 116.267 116.267 116.464 -0.197 25294 4312 1 11 . 1 1 5 5 SER HA H 5 4.349 4.349 4.602 -0.253 25294 4313 1 11 . 1 1 5 5 SER CA C 5 55.478 55.478 57.727 -2.248 25294 4314 1 11 . 1 1 5 5 SER CB C 5 61.191 61.191 63.336 -2.145 25294 4315 1 11 . 1 1 6 6 ASP N N 6 123.039 123.039 129.064 -6.025 25294 4316 1 11 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.728 0.099 25294 4317 1 11 . 1 1 6 6 ASP CA C 6 49.671 49.671 53.514 -3.843 25294 4318 1 11 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.485 -2.829 25294 4319 1 11 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.372 -0.055 25294 4320 1 11 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.498 -3.351 25294 4321 1 11 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.170 -2.692 25294 4322 1 11 . 1 1 8 8 ASP N N 8 119.159 119.159 115.238 3.921 25294 4323 1 11 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.654 -0.089 25294 4324 1 11 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.622 -2.762 25294 4325 1 11 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.594 -2.869 25294 4326 1 11 . 1 1 9 9 GLY N N 9 108.837 108.837 108.303 0.534 25294 4327 1 11 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.056 -1.920 25294 4328 1 11 . 1 1 10 10 LEU N N 10 121.571 121.571 119.769 1.802 25294 4329 1 11 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.444 -0.177 25294 4330 1 11 . 1 1 10 10 LEU CA C 10 52.391 52.391 55.028 -2.637 25294 4331 1 11 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.644 -2.781 25294 4332 1 11 . 1 1 11 11 ALA N N 11 125.169 125.169 122.152 3.017 25294 4333 1 11 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.702 -0.366 25294 4334 1 11 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.343 -2.358 25294 4335 1 11 . 1 1 11 11 ALA CB C 11 17.182 17.182 20.350 -3.168 25294 4336 1 11 . 1 1 12 12 ASP N N 12 122.672 122.672 124.454 -1.782 25294 4337 1 11 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.783 -0.047 25294 4338 1 11 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.813 -2.111 25294 4339 1 11 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.975 -4.144 25294 4340 1 11 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.447 -0.143 25294 4341 1 11 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.599 -2.999 25294 4342 1 11 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.078 -2.562 25294 4343 1 11 . 1 1 14 14 MET N N 14 120.151 120.151 121.791 -1.640 25294 4344 1 11 . 1 1 14 14 MET HA H 14 3.780 3.780 4.722 -0.942 25294 4345 1 11 . 1 1 14 14 MET CA C 14 55.822 55.822 55.902 -0.080 25294 4346 1 11 . 1 1 14 14 MET CB C 14 30.909 30.909 33.214 -2.305 25294 4347 1 11 . 1 1 15 15 LYS N N 15 123.897 123.897 122.041 1.856 25294 4348 1 11 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.714 -0.257 25294 4349 1 11 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.443 -4.036 25294 4350 1 11 . 1 1 15 15 LYS CB C 15 32.453 32.453 36.932 -4.479 25294 4351 1 11 . 1 1 16 16 TRP N N 16 125.776 125.776 121.525 4.251 25294 4352 1 11 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.317 -0.242 25294 4353 1 11 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.615 -2.963 25294 4354 1 11 . 1 1 16 16 TRP CB C 16 28.000 28.000 31.889 -3.889 25294 4355 1 11 . 1 1 17 17 SER N N 17 120.772 120.772 119.550 1.222 25294 4356 1 11 . 1 1 17 17 SER HA H 17 4.403 4.403 4.633 -0.230 25294 4357 1 11 . 1 1 17 17 SER CA C 17 56.167 56.167 59.309 -3.142 25294 4358 1 11 . 1 1 17 17 SER CB C 17 60.833 60.833 63.823 -2.990 25294 4359 1 11 . 1 1 18 18 LYS N N 18 121.096 121.096 121.105 -0.009 25294 4360 1 11 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.629 0.089 25294 4361 1 11 . 1 1 18 18 LYS CA C 18 53.735 53.735 54.965 -1.230 25294 4362 1 11 . 1 1 18 18 LYS CB C 18 32.917 32.917 33.531 -0.614 25294 4363 1 11 . 1 1 19 19 VAL N N 19 116.358 116.358 118.807 -2.449 25294 4364 1 11 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.002 0.421 25294 4365 1 11 . 1 1 19 19 VAL CA C 19 55.230 55.230 59.858 -4.628 25294 4366 1 11 . 1 1 19 19 VAL CB C 19 31.026 31.026 31.582 -0.556 25294 4367 1 11 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.439 -0.136 25294 4368 1 11 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.212 -2.442 25294 4369 1 11 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.254 -2.701 25294 4370 1 11 . 1 1 21 21 SER N N 21 118.882 118.882 117.878 1.004 25294 4371 1 11 . 1 1 21 21 SER HA H 21 4.084 4.084 4.118 -0.034 25294 4372 1 11 . 1 1 21 21 SER CA C 21 57.657 57.657 61.390 -3.733 25294 4373 1 11 . 1 1 21 21 SER CB C 21 60.173 60.173 62.837 -2.664 25294 4374 1 11 . 1 1 22 22 GLY N N 22 109.523 109.523 110.009 -0.486 25294 4375 1 11 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.949 -2.545 25294 4376 1 11 . 1 1 23 23 LEU N N 23 123.003 123.003 122.943 0.060 25294 4377 1 11 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.227 -0.193 25294 4378 1 11 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.396 -1.793 25294 4379 1 11 . 1 1 23 23 LEU CB C 23 40.071 40.071 41.920 -1.849 25294 4380 1 11 . 1 1 24 24 LYS N N 24 129.004 129.004 128.925 0.079 25294 4381 1 11 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.582 -0.072 25294 4382 1 11 . 1 1 24 24 LYS CA C 24 53.237 53.237 54.697 -1.460 25294 4383 1 11 . 1 1 24 24 LYS CB C 24 32.161 32.161 32.736 -0.575 25294 4384 1 11 . 1 1 25 25 ASN N N 25 126.336 126.336 123.389 2.947 25294 4385 1 11 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.397 -0.073 25294 4386 1 11 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.837 -2.216 25294 4387 1 11 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.239 -3.254 25294 4388 1 11 . 1 1 26 26 GLY N N 26 103.076 103.076 103.495 -0.419 25294 4389 1 11 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.906 -1.357 25294 4390 1 11 . 1 1 27 27 GLU N N 27 120.878 120.878 120.516 0.362 25294 4391 1 11 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.743 0.459 25294 4392 1 11 . 1 1 27 27 GLU CA C 27 51.233 51.233 54.893 -3.660 25294 4393 1 11 . 1 1 27 27 GLU CB C 27 30.761 30.761 32.758 -1.997 25294 4394 1 11 . 1 1 28 28 LEU N N 28 128.583 128.583 123.371 5.212 25294 4395 1 11 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.988 -0.433 25294 4396 1 11 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.816 -3.492 25294 4397 1 11 . 1 1 28 28 LEU CB C 28 43.517 43.517 45.590 -2.073 25294 4398 1 11 . 1 1 29 29 LYS N N 29 127.554 127.554 121.331 6.223 25294 4399 1 11 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.817 0.084 25294 4400 1 11 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.455 -2.616 25294 4401 1 11 . 1 1 29 29 LYS CB C 29 29.523 29.523 36.064 -6.541 25294 4402 1 11 . 1 1 30 30 VAL N N 30 127.915 127.915 121.101 6.814 25294 4403 1 11 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.543 -0.359 25294 4404 1 11 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.385 -2.077 25294 4405 1 11 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.066 -3.796 25294 4406 1 11 . 1 1 31 31 GLU N N 31 125.151 125.151 122.275 2.876 25294 4407 1 11 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.522 -0.161 25294 4408 1 11 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.743 -1.643 25294 4409 1 11 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.398 -2.695 25294 4410 1 11 . 1 1 32 32 ALA N N 32 126.271 126.271 119.388 6.883 25294 4411 1 11 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.369 -0.353 25294 4412 1 11 . 1 1 32 32 ALA CA C 32 53.127 53.127 53.793 -0.666 25294 4413 1 11 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.454 -3.188 25294 4414 1 11 . 1 1 33 33 GLU N N 33 113.076 113.076 116.316 -3.240 25294 4415 1 11 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.437 -0.472 25294 4416 1 11 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.118 -0.133 25294 4417 1 11 . 1 1 33 33 GLU CB C 33 26.929 26.929 31.447 -4.518 25294 4418 1 11 . 1 1 34 34 GLY N N 34 104.905 104.905 108.351 -3.446 25294 4419 1 11 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.087 -4.380 25294 4420 1 11 . 1 1 35 35 GLY N N 35 105.946 105.946 108.274 -2.328 25294 4421 1 11 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.003 -1.015 25294 4422 1 11 . 1 1 36 36 SER N N 36 116.044 116.044 113.863 2.181 25294 4423 1 11 . 1 1 36 36 SER HA H 36 5.539 5.539 5.569 -0.030 25294 4424 1 11 . 1 1 36 36 SER CA C 36 54.323 54.323 56.714 -2.390 25294 4425 1 11 . 1 1 36 36 SER CB C 36 62.808 62.808 66.695 -3.887 25294 4426 1 11 . 1 1 37 37 SER N N 37 119.501 119.501 115.637 3.864 25294 4427 1 11 . 1 1 37 37 SER HA H 37 4.712 4.712 4.624 0.088 25294 4428 1 11 . 1 1 37 37 SER CA C 37 55.548 55.548 57.639 -2.091 25294 4429 1 11 . 1 1 37 37 SER CB C 37 63.943 63.943 65.346 -1.403 25294 4430 1 11 . 1 1 38 38 LEU N N 38 125.962 125.962 126.511 -0.549 25294 4431 1 11 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.178 0.075 25294 4432 1 11 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.588 -2.806 25294 4433 1 11 . 1 1 38 38 LEU CB C 38 42.834 42.834 44.117 -1.283 25294 4434 1 11 . 1 1 39 39 PHE N N 39 124.707 124.707 124.370 0.337 25294 4435 1 11 . 1 1 39 39 PHE HA H 39 5.139 5.139 4.914 0.225 25294 4436 1 11 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.929 -3.798 25294 4437 1 11 . 1 1 39 39 PHE CB C 39 38.952 38.952 42.663 -3.711 25294 4438 1 11 . 1 1 40 40 ALA N N 40 124.994 124.994 124.398 0.596 25294 4439 1 11 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.520 0.115 25294 4440 1 11 . 1 1 40 40 ALA CA C 40 48.301 48.301 51.078 -2.777 25294 4441 1 11 . 1 1 40 40 ALA CB C 40 19.446 19.446 21.422 -1.976 25294 4442 1 11 . 1 1 41 41 CYS N N 41 125.757 125.757 125.596 0.161 25294 4443 1 11 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.262 -0.116 25294 4444 1 11 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.682 -3.217 25294 4445 1 11 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.428 -1.455 25294 4446 1 11 . 1 1 42 42 LYS N N 42 129.019 129.019 126.531 2.488 25294 4447 1 11 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.111 0.149 25294 4448 1 11 . 1 1 42 42 LYS CA C 42 54.851 54.851 59.005 -4.154 25294 4449 1 11 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.933 -0.826 25294 4450 1 11 . 1 1 43 43 ASN N N 43 113.240 113.240 114.185 -0.945 25294 4451 1 11 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.566 -0.041 25294 4452 1 11 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.513 -3.278 25294 4453 1 11 . 1 1 43 43 ASN CB C 43 34.861 34.861 38.596 -3.735 25294 4454 1 11 . 1 1 44 44 TYR N N 44 119.335 119.335 118.074 1.261 25294 4455 1 11 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.484 0.073 25294 4456 1 11 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.323 -2.605 25294 4457 1 11 . 1 1 44 44 TYR CB C 44 37.372 37.372 42.052 -4.680 25294 4458 1 11 . 1 1 45 45 LYS N N 45 120.676 120.676 121.168 -0.492 25294 4459 1 11 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.901 -0.865 25294 4460 1 11 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.684 -2.146 25294 4461 1 11 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.318 -3.085 25294 4462 1 11 . 1 1 46 46 SER N N 46 108.797 108.797 114.858 -6.061 25294 4463 1 11 . 1 1 46 46 SER HA H 46 4.388 4.388 4.857 -0.469 25294 4464 1 11 . 1 1 46 46 SER CA C 46 53.664 53.664 58.474 -4.810 25294 4465 1 11 . 1 1 46 46 SER CB C 46 61.810 61.810 63.612 -1.802 25294 4466 1 11 . 1 1 47 47 PHE N N 47 117.325 117.325 120.684 -3.359 25294 4467 1 11 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.473 -0.831 25294 4468 1 11 . 1 1 47 47 PHE CA C 47 53.617 53.617 55.760 -2.143 25294 4469 1 11 . 1 1 47 47 PHE CB C 47 37.101 37.101 41.974 -4.873 25294 4470 1 11 . 1 1 48 48 TRP N N 48 117.090 117.090 118.078 -0.988 25294 4471 1 11 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.031 0.204 25294 4472 1 11 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.706 -2.214 25294 4473 1 11 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.062 -1.167 25294 4474 1 11 . 1 1 49 49 ILE N N 49 119.682 119.682 120.796 -1.114 25294 4475 1 11 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.507 -0.476 25294 4476 1 11 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.419 -0.946 25294 4477 1 11 . 1 1 49 49 ILE CB C 49 36.436 36.436 38.152 -1.716 25294 4478 1 11 . 1 1 50 50 SER N N 50 124.071 124.071 121.265 2.806 25294 4479 1 11 . 1 1 50 50 SER HA H 50 4.708 4.708 4.802 -0.094 25294 4480 1 11 . 1 1 50 50 SER CA C 50 56.110 56.110 58.429 -2.319 25294 4481 1 11 . 1 1 50 50 SER CB C 50 63.816 63.816 64.559 -0.743 25294 4482 1 11 . 1 1 51 51 SER N N 51 111.253 111.253 114.881 -3.628 25294 4483 1 11 . 1 1 51 51 SER HA H 51 4.557 4.557 5.101 -0.544 25294 4484 1 11 . 1 1 51 51 SER CA C 51 55.564 55.564 57.300 -1.736 25294 4485 1 11 . 1 1 51 51 SER CB C 51 62.821 62.821 66.064 -3.244 25294 4486 1 11 . 1 1 52 52 VAL N N 52 121.147 121.147 121.640 -0.493 25294 4487 1 11 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.766 -0.035 25294 4488 1 11 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.841 -1.715 25294 4489 1 11 . 1 1 52 52 VAL CB C 52 32.500 32.500 36.399 -3.899 25294 4490 1 11 . 1 1 53 53 LYS N N 53 126.128 126.128 125.239 0.889 25294 4491 1 11 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.591 0.416 25294 4492 1 11 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.643 -2.920 25294 4493 1 11 . 1 1 53 53 LYS CB C 53 33.772 33.772 33.993 -0.221 25294 4494 1 11 . 1 1 54 54 GLU N N 54 124.160 124.160 124.802 -0.642 25294 4495 1 11 . 1 1 54 54 GLU HA H 54 4.758 4.758 4.721 0.037 25294 4496 1 11 . 1 1 54 54 GLU CA C 54 53.259 53.259 56.344 -3.085 25294 4497 1 11 . 1 1 54 54 GLU CB C 54 31.059 31.059 32.086 -1.027 25294 4498 1 11 . 1 1 55 55 GLU N N 55 127.218 127.218 119.860 7.358 25294 4499 1 11 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.644 -0.736 25294 4500 1 11 . 1 1 55 55 GLU CA C 55 54.546 54.546 55.969 -1.423 25294 4501 1 11 . 1 1 55 55 GLU CB C 55 25.294 25.294 31.213 -5.919 25294 4502 1 11 . 1 1 56 56 GLY N N 56 104.894 104.894 108.492 -3.598 25294 4503 1 11 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.257 -3.376 25294 4504 1 11 . 1 1 57 57 LYS N N 57 120.444 120.444 117.116 3.328 25294 4505 1 11 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.689 -0.125 25294 4506 1 11 . 1 1 57 57 LYS CA C 57 51.959 51.959 53.949 -1.990 25294 4507 1 11 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.079 -2.891 25294 4508 1 11 . 1 1 58 58 PHE N N 58 121.824 121.824 120.237 1.587 25294 4509 1 11 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.213 -0.442 25294 4510 1 11 . 1 1 58 58 PHE CA C 58 56.165 56.165 58.213 -2.048 25294 4511 1 11 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.900 -3.998 25294 4512 1 11 . 1 1 59 59 LYS N N 59 123.205 123.205 119.678 3.527 25294 4513 1 11 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.792 -0.341 25294 4514 1 11 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.972 -3.987 25294 4515 1 11 . 1 1 59 59 LYS CB C 59 29.791 29.791 35.339 -5.548 25294 4516 1 11 . 1 1 60 60 GLU N N 60 122.647 122.647 119.014 3.633 25294 4517 1 11 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.421 -0.161 25294 4518 1 11 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.179 -2.273 25294 4519 1 11 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.715 -3.052 25294 4520 1 11 . 1 1 61 61 ASN N N 61 119.907 119.907 117.057 2.850 25294 4521 1 11 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.960 -0.115 25294 4522 1 11 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.070 -2.318 25294 4523 1 11 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.992 -4.969 25294 4524 1 11 . 1 1 62 62 THR N N 62 113.271 113.271 116.173 -2.902 25294 4525 1 11 . 1 1 62 62 THR HA H 62 4.308 4.308 4.496 -0.188 25294 4526 1 11 . 1 1 62 62 THR CA C 62 59.310 59.310 61.941 -2.631 25294 4527 1 11 . 1 1 62 62 THR CB C 62 66.813 66.813 68.742 -1.929 25294 4528 1 11 . 1 1 63 63 SER N N 63 116.521 116.521 115.746 0.775 25294 4529 1 11 . 1 1 63 63 SER HA H 63 4.650 4.650 4.371 0.279 25294 4530 1 11 . 1 1 63 63 SER CA C 63 54.094 54.094 57.200 -3.106 25294 4531 1 11 . 1 1 63 63 SER CB C 63 61.617 61.617 64.762 -3.145 25294 4532 1 11 . 1 1 64 64 TYR N N 64 120.183 120.183 118.591 1.592 25294 4533 1 11 . 1 1 64 64 TYR HA H 64 4.838 4.838 5.054 -0.216 25294 4534 1 11 . 1 1 64 64 TYR CA C 64 56.403 56.403 56.865 -0.462 25294 4535 1 11 . 1 1 64 64 TYR CB C 64 36.569 36.569 38.720 -2.151 25294 4536 1 11 . 1 1 65 65 LYS N N 65 115.195 115.195 114.272 0.923 25294 4537 1 11 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.494 0.227 25294 4538 1 11 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.056 -3.350 25294 4539 1 11 . 1 1 65 65 LYS CB C 65 31.820 31.820 33.617 -1.797 25294 4540 1 11 . 1 1 66 66 GLU N N 66 117.231 117.231 119.609 -2.378 25294 4541 1 11 . 1 1 66 66 GLU HA H 66 5.213 5.213 4.840 0.373 25294 4542 1 11 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.738 -3.125 25294 4543 1 11 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.078 -2.285 25294 4544 1 11 . 1 1 67 67 PHE N N 67 121.532 121.532 121.918 -0.386 25294 4545 1 11 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.761 -0.331 25294 4546 1 11 . 1 1 67 67 PHE CA C 67 56.269 56.269 56.757 -0.488 25294 4547 1 11 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.530 -2.255 25294 4548 1 11 . 1 1 68 68 ASP N N 68 128.157 128.157 126.053 2.104 25294 4549 1 11 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.836 -0.408 25294 4550 1 11 . 1 1 68 68 ASP CA C 68 49.556 49.556 51.997 -2.441 25294 4551 1 11 . 1 1 68 68 ASP CB C 68 38.424 38.424 40.541 -2.117 25294 4552 1 11 . 1 1 69 69 GLY N N 69 114.151 114.151 108.394 5.757 25294 4553 1 11 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.267 -3.368 25294 4554 1 11 . 1 1 70 70 GLY N N 70 113.714 113.714 111.023 2.691 25294 4555 1 11 . 1 1 70 70 GLY CA C 70 43.994 43.994 46.104 -2.110 25294 4556 1 11 . 1 1 71 71 TRP N N 71 117.823 117.823 117.930 -0.107 25294 4557 1 11 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.961 -0.153 25294 4558 1 11 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.296 -2.519 25294 4559 1 11 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.623 -4.978 25294 4560 1 11 . 1 1 72 72 TYR N N 72 114.204 114.204 122.104 -7.900 25294 4561 1 11 . 1 1 72 72 TYR HA H 72 5.125 5.125 5.096 0.029 25294 4562 1 11 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.871 -5.436 25294 4563 1 11 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.660 -2.040 25294 4564 1 11 . 1 1 73 73 LEU N N 73 121.469 121.469 126.664 -5.195 25294 4565 1 11 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.920 -0.153 25294 4566 1 11 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.587 -2.255 25294 4567 1 11 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.517 -3.115 25294 4568 1 11 . 1 1 74 74 VAL N N 74 124.558 124.558 123.162 1.396 25294 4569 1 11 . 1 1 74 74 VAL HA H 74 4.783 4.783 5.183 -0.400 25294 4570 1 11 . 1 1 74 74 VAL CA C 74 57.812 57.812 59.689 -1.877 25294 4571 1 11 . 1 1 74 74 VAL CB C 74 31.820 31.820 34.853 -3.034 25294 4572 1 11 . 1 1 75 75 LYS N N 75 125.824 125.824 124.388 1.436 25294 4573 1 11 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.292 -0.182 25294 4574 1 11 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.312 -2.508 25294 4575 1 11 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.519 -2.944 25294 4576 1 11 . 1 1 76 76 ILE N N 76 124.647 124.647 122.421 2.226 25294 4577 1 11 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.842 0.236 25294 4578 1 11 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.575 -3.208 25294 4579 1 11 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.843 -2.251 25294 4580 1 11 . 1 1 77 77 GLU N N 77 128.081 128.081 127.695 0.386 25294 4581 1 11 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.680 -0.236 25294 4582 1 11 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.375 -2.904 25294 4583 1 11 . 1 1 77 77 GLU CB C 77 29.914 29.914 32.020 -2.106 25294 4584 1 11 . 1 1 78 78 ASP N N 78 126.158 126.158 125.196 0.962 25294 4585 1 11 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.290 -0.190 25294 4586 1 11 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.466 -3.403 25294 4587 1 11 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.388 -3.650 25294 4588 1 11 . 1 1 79 79 ASN N N 79 118.653 118.653 117.440 1.213 25294 4589 1 11 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.194 -0.548 25294 4590 1 11 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.336 -2.127 25294 4591 1 11 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.625 -5.275 25294 4592 1 11 . 1 1 80 80 GLU N N 80 120.378 120.378 122.880 -2.502 25294 4593 1 11 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.124 0.385 25294 4594 1 11 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.929 -3.069 25294 4595 1 11 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.110 -0.437 25294 4596 1 11 . 1 1 81 81 LEU N N 81 125.771 125.771 129.186 -3.415 25294 4597 1 11 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.051 -0.085 25294 4598 1 11 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.817 -3.803 25294 4599 1 11 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.574 -1.024 25294 4600 1 11 . 1 1 82 82 LYS N N 82 128.076 128.076 126.691 1.385 25294 4601 1 11 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.465 -0.220 25294 4602 1 11 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.728 -2.396 25294 4603 1 11 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.520 -4.341 25294 4604 1 11 . 1 1 83 83 VAL N N 83 124.216 124.216 122.365 1.851 25294 4605 1 11 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.845 0.063 25294 4606 1 11 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.899 -2.519 25294 4607 1 11 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.757 -3.589 25294 4608 1 11 . 1 1 84 84 ILE N N 84 129.084 129.084 127.046 2.038 25294 4609 1 11 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.661 -0.131 25294 4610 1 11 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.186 -1.780 25294 4611 1 11 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.449 -3.283 25294 4612 1 11 . 1 1 85 85 ILE N N 85 127.360 127.360 125.278 2.082 25294 4613 1 11 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.934 -0.349 25294 4614 1 11 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.702 -1.242 25294 4615 1 11 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.500 -2.002 25294 4616 1 11 . 1 1 86 86 ASN N N 86 128.337 128.337 124.660 3.677 25294 4617 1 11 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.888 -0.122 25294 4618 1 11 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.206 -3.024 25294 4619 1 11 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.670 -3.780 25294 4620 1 11 . 1 1 87 87 ARG N N 87 119.368 119.368 120.011 -0.643 25294 4621 1 11 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.164 -0.173 25294 4622 1 11 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.094 -1.896 25294 4623 1 11 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.792 -2.389 25294 4624 1 11 . 1 1 88 88 ASN N N 88 125.082 125.082 123.862 1.220 25294 4625 1 11 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.468 0.257 25294 4626 1 11 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.541 -4.438 25294 4627 1 11 . 1 1 88 88 ASN CB C 88 34.757 34.757 39.004 -4.247 25294 4628 1 11 . 1 1 89 89 GLU N N 89 125.309 125.309 121.699 3.610 25294 4629 1 11 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.423 -0.065 25294 4630 1 11 . 1 1 89 89 GLU CA C 89 53.013 53.013 55.539 -2.526 25294 4631 1 11 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.827 -2.743 25294 4632 1 11 . 1 1 90 90 THR N N 90 112.516 112.516 112.688 -0.172 25294 4633 1 11 . 1 1 90 90 THR HA H 90 4.534 4.534 4.632 -0.098 25294 4634 1 11 . 1 1 90 90 THR CA C 90 58.161 58.161 60.303 -2.142 25294 4635 1 11 . 1 1 90 90 THR CB C 90 68.409 68.409 71.926 -3.517 25294 4636 1 11 . 1 1 91 91 ASN N N 91 116.717 116.717 121.778 -5.061 25294 4637 1 11 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.707 -0.000 25294 4638 1 11 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.536 -3.740 25294 4639 1 11 . 1 1 91 91 ASN CB C 91 35.474 35.474 37.395 -1.921 25294 4640 1 11 . 1 1 92 92 ALA N N 92 122.025 122.025 121.526 0.499 25294 4641 1 11 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.501 0.135 25294 4642 1 11 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.938 -2.889 25294 4643 1 11 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.765 -1.049 25294 4644 1 11 . 1 1 93 93 SER N N 93 115.895 115.895 120.330 -4.435 25294 4645 1 11 . 1 1 93 93 SER HA H 93 4.536 4.536 4.737 -0.201 25294 4646 1 11 . 1 1 93 93 SER CA C 93 54.865 54.865 57.648 -2.783 25294 4647 1 11 . 1 1 93 93 SER CB C 93 61.292 61.292 64.136 -2.844 25294 4648 1 11 . 1 1 94 94 ARG N N 94 119.529 119.529 124.728 -5.199 25294 4649 1 11 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.778 0.136 25294 4650 1 11 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.385 -2.289 25294 4651 1 11 . 1 1 94 94 ARG CB C 94 29.512 29.512 32.548 -3.036 25294 4652 1 11 . 1 1 95 95 SER N N 95 114.542 114.542 114.473 0.069 25294 4653 1 11 . 1 1 95 95 SER HA H 95 5.926 5.926 5.437 0.489 25294 4654 1 11 . 1 1 95 95 SER CA C 95 54.219 54.219 57.190 -2.971 25294 4655 1 11 . 1 1 95 95 SER CB C 95 65.271 65.271 66.879 -1.608 25294 4656 1 11 . 1 1 96 96 PHE N N 96 117.183 117.183 115.408 1.775 25294 4657 1 11 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.058 0.280 25294 4658 1 11 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.400 -1.920 25294 4659 1 11 . 1 1 96 96 PHE CB C 96 38.868 38.868 41.260 -2.392 25294 4660 1 11 . 1 1 97 97 THR N N 97 115.263 115.263 114.890 0.373 25294 4661 1 11 . 1 1 97 97 THR HA H 97 5.250 5.250 4.867 0.383 25294 4662 1 11 . 1 1 97 97 THR CA C 97 58.178 58.178 62.305 -4.127 25294 4663 1 11 . 1 1 97 97 THR CB C 97 69.068 69.068 72.336 -3.268 25294 4664 1 11 . 1 1 98 98 VAL N N 98 125.442 125.442 125.498 -0.056 25294 4665 1 11 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.517 0.340 25294 4666 1 11 . 1 1 98 98 VAL CA C 98 57.409 57.409 61.336 -3.926 25294 4667 1 11 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.368 -1.439 25294 4668 1 11 . 1 1 99 99 CYS N N 99 127.111 127.111 125.171 1.940 25294 4669 1 11 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.544 -0.198 25294 4670 1 11 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.150 -2.199 25294 4671 1 11 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.683 -4.741 25294 4672 1 11 . 1 1 100 100 VAL N N 100 120.146 120.146 115.928 4.218 25294 4673 1 11 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.259 0.124 25294 4674 1 11 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.684 -3.971 25294 4675 1 11 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.988 -3.345 25294 4676 1 11 . 1 1 101 101 GLU N N 101 118.807 118.807 122.492 -3.685 25294 4677 1 11 . 1 1 101 101 GLU HA H 101 4.752 4.752 5.005 -0.253 25294 4678 1 11 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.753 -2.318 25294 4679 1 11 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.660 -1.939 25294 4680 1 11 . 1 1 102 102 ALA N N 102 124.088 124.088 125.094 -1.006 25294 4681 1 11 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.997 -1.140 25294 4682 1 11 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.957 -3.079 25294 4683 1 11 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.482 -1.457 25294 4684 1 11 . 1 1 103 103 GLY N N 103 111.186 111.186 109.566 1.620 25294 4685 1 11 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.373 -1.730 25294 4686 1 11 . 1 1 104 104 ASN N N 104 123.092 123.092 120.735 2.357 25294 4687 1 11 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.737 -0.065 25294 4688 1 11 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.202 -2.506 25294 4689 1 11 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.898 -3.491 25294 4690 1 11 . 1 1 105 105 ALA N N 105 122.653 122.653 120.099 2.554 25294 4691 1 11 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.367 0.064 25294 4692 1 11 . 1 1 105 105 ALA CA C 105 48.668 48.668 50.473 -1.805 25294 4693 1 11 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.380 -2.444 25294 4694 1 11 . 1 1 106 106 PHE N N 106 116.011 116.011 114.661 1.350 25294 4695 1 11 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.440 -0.023 25294 4696 1 11 . 1 1 106 106 PHE CA C 106 53.558 53.558 55.368 -1.810 25294 4697 1 11 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.739 -2.255 25294 4698 1 11 . 1 1 107 107 ASP N N 107 121.992 121.992 119.546 2.446 25294 4699 1 11 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.654 -0.060 25294 4700 1 11 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.016 -2.492 25294 4701 1 11 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.832 -1.741 25294 4702 1 11 . 1 1 108 108 GLU N N 108 119.354 119.354 122.459 -3.105 25294 4703 1 11 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.890 0.119 25294 4704 1 11 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.611 -2.623 25294 4705 1 11 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.811 -1.494 25294 4706 1 11 . 1 1 109 109 PHE N N 109 122.098 122.098 124.315 -2.217 25294 4707 1 11 . 1 1 109 109 PHE HA H 109 4.958 4.958 5.034 -0.076 25294 4708 1 11 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.183 -3.396 25294 4709 1 11 . 1 1 109 109 PHE CB C 109 40.443 40.443 41.861 -1.418 25294 4710 1 11 . 1 1 110 110 LYS N N 110 124.500 124.500 121.687 2.813 25294 4711 1 11 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.455 0.237 25294 4712 1 11 . 1 1 110 110 LYS CA C 110 51.891 51.891 56.426 -4.535 25294 4713 1 11 . 1 1 110 110 LYS CB C 110 33.012 33.012 34.031 -1.019 25294 4714 1 11 . 1 1 111 111 PHE N N 111 125.010 125.010 119.495 5.515 25294 4715 1 11 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.229 -0.475 25294 4716 1 11 . 1 1 111 111 PHE CA C 111 58.184 58.184 56.081 2.103 25294 4717 1 11 . 1 1 111 111 PHE CB C 111 38.380 38.380 42.378 -3.998 25294 4718 1 11 . 1 1 112 112 VAL N N 112 122.957 122.957 116.064 6.893 25294 4719 1 11 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.860 -0.420 25294 4720 1 11 . 1 1 112 112 VAL CA C 112 58.256 58.256 59.457 -1.201 25294 4721 1 11 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.860 -4.767 25294 4722 1 11 . 1 1 113 113 GLN N N 113 130.864 130.864 122.016 8.848 25294 4723 1 11 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.996 0.323 25294 4724 1 11 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.084 -2.966 25294 4725 1 11 . 1 1 113 113 GLN CB C 113 28.164 28.164 33.121 -4.957 25294 4726 1 11 . 1 1 114 114 ASP N N 114 126.272 126.272 126.291 -0.019 25294 4727 1 11 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.588 -0.261 25294 4728 1 11 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.665 -2.892 25294 4729 1 11 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.502 -2.647 25294 4730 1 11 . 1 1 115 115 ALA N N 115 120.134 120.134 121.172 -1.038 25294 4731 1 11 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.276 -0.577 25294 4732 1 11 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.848 -2.947 25294 4733 1 11 . 1 1 115 115 ALA CB C 115 17.751 17.751 20.099 -2.348 25294 4734 1 11 . 1 1 116 116 ALA N N 116 121.377 121.377 124.472 -3.095 25294 4735 1 11 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.362 -0.409 25294 4736 1 11 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.600 -1.612 25294 4737 1 11 . 1 1 116 116 ALA CB C 116 16.200 16.200 18.931 -2.731 25294 4738 1 11 . 1 1 117 117 LYS N N 117 121.536 121.536 126.807 -5.271 25294 4739 1 11 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.314 -0.175 25294 4740 1 11 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.955 -2.309 25294 4741 1 11 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.737 -1.158 25294 4742 1 12 . 1 1 5 5 SER N N 5 116.267 116.267 116.846 -0.579 25294 4743 1 12 . 1 1 5 5 SER HA H 5 4.349 4.349 4.795 -0.446 25294 4744 1 12 . 1 1 5 5 SER CA C 5 55.478 55.478 57.362 -1.884 25294 4745 1 12 . 1 1 5 5 SER CB C 5 61.191 61.191 65.391 -4.200 25294 4746 1 12 . 1 1 6 6 ASP N N 6 123.039 123.039 121.753 1.286 25294 4747 1 12 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.935 -0.108 25294 4748 1 12 . 1 1 6 6 ASP CA C 6 49.671 49.671 51.393 -1.722 25294 4749 1 12 . 1 1 6 6 ASP CB C 6 38.656 38.656 40.274 -1.618 25294 4750 1 12 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.349 -0.032 25294 4751 1 12 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.646 -3.499 25294 4752 1 12 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.191 -2.713 25294 4753 1 12 . 1 1 8 8 ASP N N 8 119.159 119.159 115.509 3.650 25294 4754 1 12 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.725 -0.160 25294 4755 1 12 . 1 1 8 8 ASP CA C 8 51.860 51.860 53.848 -1.988 25294 4756 1 12 . 1 1 8 8 ASP CB C 8 38.725 38.725 40.332 -1.607 25294 4757 1 12 . 1 1 9 9 GLY N N 9 108.837 108.837 108.607 0.230 25294 4758 1 12 . 1 1 9 9 GLY CA C 9 43.136 43.136 46.563 -3.427 25294 4759 1 12 . 1 1 10 10 LEU N N 10 121.571 121.571 115.516 6.055 25294 4760 1 12 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.622 -0.355 25294 4761 1 12 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.342 -1.951 25294 4762 1 12 . 1 1 10 10 LEU CB C 10 39.863 39.863 41.017 -1.154 25294 4763 1 12 . 1 1 11 11 ALA N N 11 125.169 125.169 118.926 6.243 25294 4764 1 12 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.487 -0.151 25294 4765 1 12 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.325 -2.341 25294 4766 1 12 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.717 -2.535 25294 4767 1 12 . 1 1 12 12 ASP N N 12 122.672 122.672 122.458 0.214 25294 4768 1 12 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.740 -0.004 25294 4769 1 12 . 1 1 12 12 ASP CA C 12 49.702 49.702 54.120 -4.418 25294 4770 1 12 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.938 -4.107 25294 4771 1 12 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.547 -0.243 25294 4772 1 12 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.772 -3.172 25294 4773 1 12 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.767 -3.252 25294 4774 1 12 . 1 1 14 14 MET N N 14 120.151 120.151 120.443 -0.292 25294 4775 1 12 . 1 1 14 14 MET HA H 14 3.780 3.780 4.485 -0.705 25294 4776 1 12 . 1 1 14 14 MET CA C 14 55.822 55.822 55.812 0.010 25294 4777 1 12 . 1 1 14 14 MET CB C 14 30.909 30.909 31.448 -0.539 25294 4778 1 12 . 1 1 15 15 LYS N N 15 123.897 123.897 122.773 1.124 25294 4779 1 12 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.510 -0.053 25294 4780 1 12 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.807 -4.400 25294 4781 1 12 . 1 1 15 15 LYS CB C 15 32.453 32.453 33.707 -1.254 25294 4782 1 12 . 1 1 16 16 TRP N N 16 125.776 125.776 123.984 1.792 25294 4783 1 12 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.294 -0.219 25294 4784 1 12 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.400 -2.748 25294 4785 1 12 . 1 1 16 16 TRP CB C 16 28.000 28.000 31.383 -3.383 25294 4786 1 12 . 1 1 17 17 SER N N 17 120.772 120.772 119.709 1.063 25294 4787 1 12 . 1 1 17 17 SER HA H 17 4.403 4.403 4.627 -0.224 25294 4788 1 12 . 1 1 17 17 SER CA C 17 56.167 56.167 58.266 -2.099 25294 4789 1 12 . 1 1 17 17 SER CB C 17 60.833 60.833 63.282 -2.449 25294 4790 1 12 . 1 1 18 18 LYS N N 18 121.096 121.096 121.203 -0.107 25294 4791 1 12 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.550 0.168 25294 4792 1 12 . 1 1 18 18 LYS CA C 18 53.735 53.735 56.264 -2.529 25294 4793 1 12 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.442 -2.525 25294 4794 1 12 . 1 1 19 19 VAL N N 19 116.358 116.358 119.248 -2.890 25294 4795 1 12 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.827 -0.404 25294 4796 1 12 . 1 1 19 19 VAL CA C 19 55.230 55.230 57.804 -2.574 25294 4797 1 12 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.319 -3.293 25294 4798 1 12 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.510 -0.207 25294 4799 1 12 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.363 -2.593 25294 4800 1 12 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.644 -3.091 25294 4801 1 12 . 1 1 21 21 SER N N 21 118.882 118.882 115.251 3.631 25294 4802 1 12 . 1 1 21 21 SER HA H 21 4.084 4.084 4.311 -0.227 25294 4803 1 12 . 1 1 21 21 SER CA C 21 57.657 57.657 59.394 -1.737 25294 4804 1 12 . 1 1 21 21 SER CB C 21 60.173 60.173 63.354 -3.181 25294 4805 1 12 . 1 1 22 22 GLY N N 22 109.523 109.523 109.403 0.120 25294 4806 1 12 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.965 -2.561 25294 4807 1 12 . 1 1 23 23 LEU N N 23 123.003 123.003 123.091 -0.088 25294 4808 1 12 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.215 -0.181 25294 4809 1 12 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.056 -1.453 25294 4810 1 12 . 1 1 23 23 LEU CB C 23 40.071 40.071 41.996 -1.925 25294 4811 1 12 . 1 1 24 24 LYS N N 24 129.004 129.004 127.105 1.899 25294 4812 1 12 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.287 0.223 25294 4813 1 12 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.904 -2.667 25294 4814 1 12 . 1 1 24 24 LYS CB C 24 32.161 32.161 32.957 -0.796 25294 4815 1 12 . 1 1 25 25 ASN N N 25 126.336 126.336 119.863 6.473 25294 4816 1 12 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.450 -0.126 25294 4817 1 12 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.121 -2.501 25294 4818 1 12 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.642 -2.657 25294 4819 1 12 . 1 1 26 26 GLY N N 26 103.076 103.076 106.734 -3.658 25294 4820 1 12 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.841 -1.292 25294 4821 1 12 . 1 1 27 27 GLU N N 27 120.878 120.878 119.849 1.029 25294 4822 1 12 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.332 -0.130 25294 4823 1 12 . 1 1 27 27 GLU CA C 27 51.233 51.233 54.288 -3.055 25294 4824 1 12 . 1 1 27 27 GLU CB C 27 30.761 30.761 32.975 -2.214 25294 4825 1 12 . 1 1 28 28 LEU N N 28 128.583 128.583 125.142 3.441 25294 4826 1 12 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.925 -0.370 25294 4827 1 12 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.816 -3.492 25294 4828 1 12 . 1 1 28 28 LEU CB C 28 43.517 43.517 43.571 -0.054 25294 4829 1 12 . 1 1 29 29 LYS N N 29 127.554 127.554 125.019 2.535 25294 4830 1 12 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.568 0.333 25294 4831 1 12 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.733 -2.894 25294 4832 1 12 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.287 -3.764 25294 4833 1 12 . 1 1 30 30 VAL N N 30 127.915 127.915 122.652 5.263 25294 4834 1 12 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.539 -0.355 25294 4835 1 12 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.118 -1.810 25294 4836 1 12 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.007 -3.737 25294 4837 1 12 . 1 1 31 31 GLU N N 31 125.151 125.151 124.425 0.726 25294 4838 1 12 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.469 -0.108 25294 4839 1 12 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.873 -1.772 25294 4840 1 12 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.449 -2.746 25294 4841 1 12 . 1 1 32 32 ALA N N 32 126.271 126.271 120.840 5.431 25294 4842 1 12 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.300 -0.284 25294 4843 1 12 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.398 -1.271 25294 4844 1 12 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.760 -3.494 25294 4845 1 12 . 1 1 33 33 GLU N N 33 113.076 113.076 115.774 -2.698 25294 4846 1 12 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.304 -0.339 25294 4847 1 12 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.025 -0.040 25294 4848 1 12 . 1 1 33 33 GLU CB C 33 26.929 26.929 29.734 -2.805 25294 4849 1 12 . 1 1 34 34 GLY N N 34 104.905 104.905 109.020 -4.115 25294 4850 1 12 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.121 -4.414 25294 4851 1 12 . 1 1 35 35 GLY N N 35 105.946 105.946 106.304 -0.358 25294 4852 1 12 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.280 -1.292 25294 4853 1 12 . 1 1 36 36 SER N N 36 116.044 116.044 116.043 0.001 25294 4854 1 12 . 1 1 36 36 SER HA H 36 5.539 5.539 4.786 0.753 25294 4855 1 12 . 1 1 36 36 SER CA C 36 54.323 54.323 57.979 -3.656 25294 4856 1 12 . 1 1 36 36 SER CB C 36 62.808 62.808 65.452 -2.644 25294 4857 1 12 . 1 1 37 37 SER N N 37 119.501 119.501 115.042 4.459 25294 4858 1 12 . 1 1 37 37 SER HA H 37 4.712 4.712 4.613 0.099 25294 4859 1 12 . 1 1 37 37 SER CA C 37 55.548 55.548 57.404 -1.856 25294 4860 1 12 . 1 1 37 37 SER CB C 37 63.943 63.943 66.145 -2.202 25294 4861 1 12 . 1 1 38 38 LEU N N 38 125.962 125.962 121.434 4.528 25294 4862 1 12 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.910 0.343 25294 4863 1 12 . 1 1 38 38 LEU CA C 38 51.782 51.782 55.079 -3.297 25294 4864 1 12 . 1 1 38 38 LEU CB C 38 42.834 42.834 46.165 -3.331 25294 4865 1 12 . 1 1 39 39 PHE N N 39 124.707 124.707 122.981 1.726 25294 4866 1 12 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.294 -0.155 25294 4867 1 12 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.076 -3.945 25294 4868 1 12 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.775 -1.823 25294 4869 1 12 . 1 1 40 40 ALA N N 40 124.994 124.994 126.802 -1.808 25294 4870 1 12 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.033 0.602 25294 4871 1 12 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.421 -2.120 25294 4872 1 12 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.173 0.273 25294 4873 1 12 . 1 1 41 41 CYS N N 41 125.757 125.757 125.559 0.198 25294 4874 1 12 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.221 -0.075 25294 4875 1 12 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.861 -3.396 25294 4876 1 12 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.608 -1.635 25294 4877 1 12 . 1 1 42 42 LYS N N 42 129.019 129.019 128.312 0.707 25294 4878 1 12 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.020 0.240 25294 4879 1 12 . 1 1 42 42 LYS CA C 42 54.851 54.851 58.569 -3.718 25294 4880 1 12 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.574 -0.467 25294 4881 1 12 . 1 1 43 43 ASN N N 43 113.240 113.240 115.008 -1.768 25294 4882 1 12 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.556 -0.031 25294 4883 1 12 . 1 1 43 43 ASN CA C 43 50.235 50.235 52.776 -2.541 25294 4884 1 12 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.578 -4.716 25294 4885 1 12 . 1 1 44 44 TYR N N 44 119.335 119.335 118.227 1.108 25294 4886 1 12 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.538 0.019 25294 4887 1 12 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.366 -2.648 25294 4888 1 12 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.758 -4.386 25294 4889 1 12 . 1 1 45 45 LYS N N 45 120.676 120.676 120.494 0.182 25294 4890 1 12 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.751 -0.715 25294 4891 1 12 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.352 -1.814 25294 4892 1 12 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.937 -2.704 25294 4893 1 12 . 1 1 46 46 SER N N 46 108.797 108.797 114.753 -5.956 25294 4894 1 12 . 1 1 46 46 SER HA H 46 4.388 4.388 4.637 -0.249 25294 4895 1 12 . 1 1 46 46 SER CA C 46 53.664 53.664 58.486 -4.822 25294 4896 1 12 . 1 1 46 46 SER CB C 46 61.810 61.810 63.756 -1.946 25294 4897 1 12 . 1 1 47 47 PHE N N 47 117.325 117.325 119.011 -1.686 25294 4898 1 12 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.395 -0.753 25294 4899 1 12 . 1 1 47 47 PHE CA C 47 53.617 53.617 57.023 -3.406 25294 4900 1 12 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.390 -5.289 25294 4901 1 12 . 1 1 48 48 TRP N N 48 117.090 117.090 118.699 -1.609 25294 4902 1 12 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.183 0.052 25294 4903 1 12 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.535 -2.043 25294 4904 1 12 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.281 -1.386 25294 4905 1 12 . 1 1 49 49 ILE N N 49 119.682 119.682 121.463 -1.781 25294 4906 1 12 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.579 -0.548 25294 4907 1 12 . 1 1 49 49 ILE CA C 49 60.473 60.473 62.137 -1.664 25294 4908 1 12 . 1 1 49 49 ILE CB C 49 36.436 36.436 37.474 -1.038 25294 4909 1 12 . 1 1 50 50 SER N N 50 124.071 124.071 121.407 2.664 25294 4910 1 12 . 1 1 50 50 SER HA H 50 4.708 4.708 4.901 -0.193 25294 4911 1 12 . 1 1 50 50 SER CA C 50 56.110 56.110 57.838 -1.728 25294 4912 1 12 . 1 1 50 50 SER CB C 50 63.816 63.816 64.593 -0.777 25294 4913 1 12 . 1 1 51 51 SER N N 51 111.253 111.253 116.804 -5.551 25294 4914 1 12 . 1 1 51 51 SER HA H 51 4.557 4.557 4.513 0.044 25294 4915 1 12 . 1 1 51 51 SER CA C 51 55.564 55.564 57.706 -2.142 25294 4916 1 12 . 1 1 51 51 SER CB C 51 62.821 62.821 64.452 -1.631 25294 4917 1 12 . 1 1 52 52 VAL N N 52 121.147 121.147 122.255 -1.108 25294 4918 1 12 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.600 0.131 25294 4919 1 12 . 1 1 52 52 VAL CA C 52 59.126 59.126 61.039 -1.913 25294 4920 1 12 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.491 -2.991 25294 4921 1 12 . 1 1 53 53 LYS N N 53 126.128 126.128 125.072 1.056 25294 4922 1 12 . 1 1 53 53 LYS HA H 53 5.007 5.007 5.173 -0.166 25294 4923 1 12 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.301 -2.578 25294 4924 1 12 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.657 -1.885 25294 4925 1 12 . 1 1 54 54 GLU N N 54 124.160 124.160 123.605 0.555 25294 4926 1 12 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.369 1.389 25294 4927 1 12 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.771 -2.512 25294 4928 1 12 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.170 -0.111 25294 4929 1 12 . 1 1 55 55 GLU N N 55 127.218 127.218 118.312 8.906 25294 4930 1 12 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.458 -0.550 25294 4931 1 12 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.280 -1.734 25294 4932 1 12 . 1 1 55 55 GLU CB C 55 25.294 25.294 31.523 -6.229 25294 4933 1 12 . 1 1 56 56 GLY N N 56 104.894 104.894 107.207 -2.313 25294 4934 1 12 . 1 1 56 56 GLY CA C 56 42.881 42.881 45.622 -2.741 25294 4935 1 12 . 1 1 57 57 LYS N N 57 120.444 120.444 118.038 2.406 25294 4936 1 12 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.660 -0.096 25294 4937 1 12 . 1 1 57 57 LYS CA C 57 51.959 51.959 53.380 -1.421 25294 4938 1 12 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.991 -2.803 25294 4939 1 12 . 1 1 58 58 PHE N N 58 121.824 121.824 120.751 1.073 25294 4940 1 12 . 1 1 58 58 PHE HA H 58 4.771 4.771 4.908 -0.137 25294 4941 1 12 . 1 1 58 58 PHE CA C 58 56.165 56.165 55.016 1.149 25294 4942 1 12 . 1 1 58 58 PHE CB C 58 36.902 36.902 38.335 -1.433 25294 4943 1 12 . 1 1 59 59 LYS N N 59 123.205 123.205 124.583 -1.378 25294 4944 1 12 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.442 0.009 25294 4945 1 12 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.879 -4.894 25294 4946 1 12 . 1 1 59 59 LYS CB C 59 29.791 29.791 33.408 -3.617 25294 4947 1 12 . 1 1 60 60 GLU N N 60 122.647 122.647 120.007 2.640 25294 4948 1 12 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.341 -0.081 25294 4949 1 12 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.355 -2.449 25294 4950 1 12 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.239 -2.576 25294 4951 1 12 . 1 1 61 61 ASN N N 61 119.907 119.907 118.108 1.799 25294 4952 1 12 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.197 -0.352 25294 4953 1 12 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.181 -2.429 25294 4954 1 12 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.716 -4.693 25294 4955 1 12 . 1 1 62 62 THR N N 62 113.271 113.271 114.637 -1.366 25294 4956 1 12 . 1 1 62 62 THR HA H 62 4.308 4.308 4.440 -0.132 25294 4957 1 12 . 1 1 62 62 THR CA C 62 59.310 59.310 62.006 -2.696 25294 4958 1 12 . 1 1 62 62 THR CB C 62 66.813 66.813 68.490 -1.677 25294 4959 1 12 . 1 1 63 63 SER N N 63 116.521 116.521 115.617 0.904 25294 4960 1 12 . 1 1 63 63 SER HA H 63 4.650 4.650 4.428 0.222 25294 4961 1 12 . 1 1 63 63 SER CA C 63 54.094 54.094 57.452 -3.358 25294 4962 1 12 . 1 1 63 63 SER CB C 63 61.617 61.617 64.116 -2.499 25294 4963 1 12 . 1 1 64 64 TYR N N 64 120.183 120.183 119.471 0.712 25294 4964 1 12 . 1 1 64 64 TYR HA H 64 4.838 4.838 5.037 -0.199 25294 4965 1 12 . 1 1 64 64 TYR CA C 64 56.403 56.403 57.104 -0.701 25294 4966 1 12 . 1 1 64 64 TYR CB C 64 36.569 36.569 38.694 -2.126 25294 4967 1 12 . 1 1 65 65 LYS N N 65 115.195 115.195 115.433 -0.238 25294 4968 1 12 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.677 0.044 25294 4969 1 12 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.852 -4.146 25294 4970 1 12 . 1 1 65 65 LYS CB C 65 31.820 31.820 35.179 -3.359 25294 4971 1 12 . 1 1 66 66 GLU N N 66 117.231 117.231 119.877 -2.646 25294 4972 1 12 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.177 0.036 25294 4973 1 12 . 1 1 66 66 GLU CA C 66 52.613 52.613 56.112 -3.499 25294 4974 1 12 . 1 1 66 66 GLU CB C 66 30.793 30.793 34.587 -3.794 25294 4975 1 12 . 1 1 67 67 PHE N N 67 121.532 121.532 122.766 -1.234 25294 4976 1 12 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.850 -0.420 25294 4977 1 12 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.817 -1.548 25294 4978 1 12 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.396 -2.121 25294 4979 1 12 . 1 1 68 68 ASP N N 68 128.157 128.157 127.259 0.898 25294 4980 1 12 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.920 -0.492 25294 4981 1 12 . 1 1 68 68 ASP CA C 68 49.556 49.556 53.530 -3.974 25294 4982 1 12 . 1 1 68 68 ASP CB C 68 38.424 38.424 40.341 -1.917 25294 4983 1 12 . 1 1 69 69 GLY N N 69 114.151 114.151 110.986 3.165 25294 4984 1 12 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.447 -3.547 25294 4985 1 12 . 1 1 70 70 GLY N N 70 113.714 113.714 110.880 2.834 25294 4986 1 12 . 1 1 70 70 GLY CA C 70 43.994 43.994 46.281 -2.287 25294 4987 1 12 . 1 1 71 71 TRP N N 71 117.823 117.823 121.475 -3.652 25294 4988 1 12 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.868 -0.060 25294 4989 1 12 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.069 -3.292 25294 4990 1 12 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.108 -3.462 25294 4991 1 12 . 1 1 72 72 TYR N N 72 114.204 114.204 118.606 -4.402 25294 4992 1 12 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.910 0.215 25294 4993 1 12 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.035 -5.600 25294 4994 1 12 . 1 1 72 72 TYR CB C 72 38.620 38.620 41.113 -2.493 25294 4995 1 12 . 1 1 73 73 LEU N N 73 121.469 121.469 126.342 -4.873 25294 4996 1 12 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.007 -0.240 25294 4997 1 12 . 1 1 73 73 LEU CA C 73 51.332 51.332 54.166 -2.834 25294 4998 1 12 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.041 -2.638 25294 4999 1 12 . 1 1 74 74 VAL N N 74 124.558 124.558 126.809 -2.251 25294 5000 1 12 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.818 -0.035 25294 5001 1 12 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.698 -2.886 25294 5002 1 12 . 1 1 74 74 VAL CB C 74 31.820 31.820 33.057 -1.237 25294 5003 1 12 . 1 1 75 75 LYS N N 75 125.824 125.824 126.729 -0.905 25294 5004 1 12 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.031 0.079 25294 5005 1 12 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.726 -2.922 25294 5006 1 12 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.868 -2.293 25294 5007 1 12 . 1 1 76 76 ILE N N 76 124.647 124.647 124.550 0.097 25294 5008 1 12 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.430 0.648 25294 5009 1 12 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.670 -3.303 25294 5010 1 12 . 1 1 76 76 ILE CB C 76 37.593 37.593 38.980 -1.387 25294 5011 1 12 . 1 1 77 77 GLU N N 77 128.081 128.081 128.649 -0.568 25294 5012 1 12 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.580 -0.136 25294 5013 1 12 . 1 1 77 77 GLU CA C 77 52.471 52.471 54.805 -2.334 25294 5014 1 12 . 1 1 77 77 GLU CB C 77 29.914 29.914 32.788 -2.874 25294 5015 1 12 . 1 1 78 78 ASP N N 78 126.158 126.158 123.882 2.276 25294 5016 1 12 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.171 -0.071 25294 5017 1 12 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.233 -3.170 25294 5018 1 12 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.782 -4.044 25294 5019 1 12 . 1 1 79 79 ASN N N 79 118.653 118.653 116.815 1.838 25294 5020 1 12 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.922 -0.276 25294 5021 1 12 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.505 -2.296 25294 5022 1 12 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.347 -4.997 25294 5023 1 12 . 1 1 80 80 GLU N N 80 120.378 120.378 123.375 -2.997 25294 5024 1 12 . 1 1 80 80 GLU HA H 80 5.509 5.509 4.988 0.521 25294 5025 1 12 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.949 -3.089 25294 5026 1 12 . 1 1 80 80 GLU CB C 80 29.673 29.673 29.724 -0.051 25294 5027 1 12 . 1 1 81 81 LEU N N 81 125.771 125.771 128.517 -2.746 25294 5028 1 12 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.166 -0.200 25294 5029 1 12 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.958 -3.943 25294 5030 1 12 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.830 -1.280 25294 5031 1 12 . 1 1 82 82 LYS N N 82 128.076 128.076 123.456 4.620 25294 5032 1 12 . 1 1 82 82 LYS HA H 82 5.245 5.245 4.997 0.248 25294 5033 1 12 . 1 1 82 82 LYS CA C 82 52.332 52.332 55.049 -2.717 25294 5034 1 12 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.670 -4.491 25294 5035 1 12 . 1 1 83 83 VAL N N 83 124.216 124.216 119.501 4.715 25294 5036 1 12 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.069 -0.161 25294 5037 1 12 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.371 -1.991 25294 5038 1 12 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.604 -3.436 25294 5039 1 12 . 1 1 84 84 ILE N N 84 129.084 129.084 128.105 0.979 25294 5040 1 12 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.546 -0.016 25294 5041 1 12 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.603 -1.197 25294 5042 1 12 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.941 -3.776 25294 5043 1 12 . 1 1 85 85 ILE N N 85 127.360 127.360 122.215 5.145 25294 5044 1 12 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.684 -0.099 25294 5045 1 12 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.836 -1.376 25294 5046 1 12 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.648 -2.151 25294 5047 1 12 . 1 1 86 86 ASN N N 86 128.337 128.337 125.586 2.751 25294 5048 1 12 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.908 -0.142 25294 5049 1 12 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.733 -2.551 25294 5050 1 12 . 1 1 86 86 ASN CB C 86 36.891 36.891 39.955 -3.064 25294 5051 1 12 . 1 1 87 87 ARG N N 87 119.368 119.368 120.567 -1.199 25294 5052 1 12 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.291 -0.300 25294 5053 1 12 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.319 -2.120 25294 5054 1 12 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.430 -2.027 25294 5055 1 12 . 1 1 88 88 ASN N N 88 125.082 125.082 125.117 -0.035 25294 5056 1 12 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.424 0.301 25294 5057 1 12 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.534 -4.431 25294 5058 1 12 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.923 -4.167 25294 5059 1 12 . 1 1 89 89 GLU N N 89 125.309 125.309 122.067 3.242 25294 5060 1 12 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.229 0.129 25294 5061 1 12 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.557 -3.544 25294 5062 1 12 . 1 1 89 89 GLU CB C 89 27.084 27.084 28.986 -1.902 25294 5063 1 12 . 1 1 90 90 THR N N 90 112.516 112.516 110.715 1.801 25294 5064 1 12 . 1 1 90 90 THR HA H 90 4.534 4.534 4.591 -0.057 25294 5065 1 12 . 1 1 90 90 THR CA C 90 58.161 58.161 59.526 -1.365 25294 5066 1 12 . 1 1 90 90 THR CB C 90 68.409 68.409 72.256 -3.847 25294 5067 1 12 . 1 1 91 91 ASN N N 91 116.717 116.717 119.561 -2.844 25294 5068 1 12 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.503 0.204 25294 5069 1 12 . 1 1 91 91 ASN CA C 91 49.796 49.796 54.020 -4.224 25294 5070 1 12 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.027 -2.553 25294 5071 1 12 . 1 1 92 92 ALA N N 92 122.025 122.025 123.386 -1.361 25294 5072 1 12 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.565 0.071 25294 5073 1 12 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.521 -2.472 25294 5074 1 12 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.110 -0.395 25294 5075 1 12 . 1 1 93 93 SER N N 93 115.895 115.895 120.095 -4.200 25294 5076 1 12 . 1 1 93 93 SER HA H 93 4.536 4.536 4.849 -0.313 25294 5077 1 12 . 1 1 93 93 SER CA C 93 54.865 54.865 58.629 -3.764 25294 5078 1 12 . 1 1 93 93 SER CB C 93 61.292 61.292 64.135 -2.843 25294 5079 1 12 . 1 1 94 94 ARG N N 94 119.529 119.529 119.458 0.071 25294 5080 1 12 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.809 0.105 25294 5081 1 12 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.930 -2.834 25294 5082 1 12 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.121 -3.609 25294 5083 1 12 . 1 1 95 95 SER N N 95 114.542 114.542 114.052 0.490 25294 5084 1 12 . 1 1 95 95 SER HA H 95 5.926 5.926 5.023 0.903 25294 5085 1 12 . 1 1 95 95 SER CA C 95 54.219 54.219 57.971 -3.752 25294 5086 1 12 . 1 1 95 95 SER CB C 95 65.271 65.271 65.197 0.074 25294 5087 1 12 . 1 1 96 96 PHE N N 96 117.183 117.183 119.098 -1.915 25294 5088 1 12 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.222 0.116 25294 5089 1 12 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.510 -2.030 25294 5090 1 12 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.810 -4.942 25294 5091 1 12 . 1 1 97 97 THR N N 97 115.263 115.263 116.755 -1.492 25294 5092 1 12 . 1 1 97 97 THR HA H 97 5.250 5.250 4.924 0.326 25294 5093 1 12 . 1 1 97 97 THR CA C 97 58.178 58.178 62.158 -3.980 25294 5094 1 12 . 1 1 97 97 THR CB C 97 69.068 69.068 71.266 -2.198 25294 5095 1 12 . 1 1 98 98 VAL N N 98 125.442 125.442 127.293 -1.851 25294 5096 1 12 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.345 0.512 25294 5097 1 12 . 1 1 98 98 VAL CA C 98 57.409 57.409 61.606 -4.197 25294 5098 1 12 . 1 1 98 98 VAL CB C 98 32.929 32.929 33.929 -1.000 25294 5099 1 12 . 1 1 99 99 CYS N N 99 127.111 127.111 127.198 -0.087 25294 5100 1 12 . 1 1 99 99 CYS HA H 99 5.346 5.346 4.750 0.596 25294 5101 1 12 . 1 1 99 99 CYS CA C 99 53.951 53.951 57.708 -3.757 25294 5102 1 12 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.133 -4.191 25294 5103 1 12 . 1 1 100 100 VAL N N 100 120.146 120.146 117.881 2.265 25294 5104 1 12 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.265 0.118 25294 5105 1 12 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.055 -3.342 25294 5106 1 12 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.716 -3.073 25294 5107 1 12 . 1 1 101 101 GLU N N 101 118.807 118.807 119.352 -0.545 25294 5108 1 12 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.392 0.360 25294 5109 1 12 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.230 -1.795 25294 5110 1 12 . 1 1 101 101 GLU CB C 101 31.721 31.721 32.679 -0.958 25294 5111 1 12 . 1 1 102 102 ALA N N 102 124.088 124.088 123.592 0.496 25294 5112 1 12 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.778 -0.921 25294 5113 1 12 . 1 1 102 102 ALA CA C 102 47.878 47.878 51.024 -3.146 25294 5114 1 12 . 1 1 102 102 ALA CB C 102 18.025 18.025 20.183 -2.158 25294 5115 1 12 . 1 1 103 103 GLY N N 103 111.186 111.186 112.959 -1.773 25294 5116 1 12 . 1 1 103 103 GLY CA C 103 44.643 44.643 47.115 -2.472 25294 5117 1 12 . 1 1 104 104 ASN N N 104 123.092 123.092 122.555 0.537 25294 5118 1 12 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.736 -0.064 25294 5119 1 12 . 1 1 104 104 ASN CA C 104 50.696 50.696 52.502 -1.806 25294 5120 1 12 . 1 1 104 104 ASN CB C 104 36.407 36.407 40.048 -3.641 25294 5121 1 12 . 1 1 105 105 ALA N N 105 122.653 122.653 122.370 0.283 25294 5122 1 12 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.484 -0.053 25294 5123 1 12 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.456 -2.788 25294 5124 1 12 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.406 -1.470 25294 5125 1 12 . 1 1 106 106 PHE N N 106 116.011 116.011 115.810 0.201 25294 5126 1 12 . 1 1 106 106 PHE HA H 106 5.417 5.417 4.988 0.429 25294 5127 1 12 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.908 -3.350 25294 5128 1 12 . 1 1 106 106 PHE CB C 106 40.484 40.484 43.778 -3.294 25294 5129 1 12 . 1 1 107 107 ASP N N 107 121.992 121.992 119.843 2.149 25294 5130 1 12 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.776 -0.182 25294 5131 1 12 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.906 -2.382 25294 5132 1 12 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.542 -1.451 25294 5133 1 12 . 1 1 108 108 GLU N N 108 119.354 119.354 119.415 -0.061 25294 5134 1 12 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.307 0.702 25294 5135 1 12 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.191 -3.203 25294 5136 1 12 . 1 1 108 108 GLU CB C 108 31.317 31.317 33.117 -1.800 25294 5137 1 12 . 1 1 109 109 PHE N N 109 122.098 122.098 117.929 4.169 25294 5138 1 12 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.938 0.020 25294 5139 1 12 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.021 -3.234 25294 5140 1 12 . 1 1 109 109 PHE CB C 109 40.443 40.443 40.327 0.116 25294 5141 1 12 . 1 1 110 110 LYS N N 110 124.500 124.500 122.858 1.642 25294 5142 1 12 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.703 -0.011 25294 5143 1 12 . 1 1 110 110 LYS CA C 110 51.891 51.891 56.922 -5.031 25294 5144 1 12 . 1 1 110 110 LYS CB C 110 33.012 33.012 34.135 -1.123 25294 5145 1 12 . 1 1 111 111 PHE N N 111 125.010 125.010 119.735 5.275 25294 5146 1 12 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.542 -0.788 25294 5147 1 12 . 1 1 111 111 PHE CA C 111 58.184 58.184 56.773 1.411 25294 5148 1 12 . 1 1 111 111 PHE CB C 111 38.380 38.380 43.803 -5.423 25294 5149 1 12 . 1 1 112 112 VAL N N 112 122.957 122.957 119.850 3.107 25294 5150 1 12 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.814 -0.374 25294 5151 1 12 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.598 -3.342 25294 5152 1 12 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.714 -4.621 25294 5153 1 12 . 1 1 113 113 GLN N N 113 130.864 130.864 125.674 5.190 25294 5154 1 12 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.122 0.197 25294 5155 1 12 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.929 -2.810 25294 5156 1 12 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.768 -4.604 25294 5157 1 12 . 1 1 114 114 ASP N N 114 126.272 126.272 125.814 0.458 25294 5158 1 12 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.587 -0.260 25294 5159 1 12 . 1 1 114 114 ASP CA C 114 51.773 51.773 53.377 -1.604 25294 5160 1 12 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.862 -3.007 25294 5161 1 12 . 1 1 115 115 ALA N N 115 120.134 120.134 120.612 -0.478 25294 5162 1 12 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.545 -0.846 25294 5163 1 12 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.192 -2.291 25294 5164 1 12 . 1 1 115 115 ALA CB C 115 17.751 17.751 20.833 -3.082 25294 5165 1 12 . 1 1 116 116 ALA N N 116 121.377 121.377 125.017 -3.640 25294 5166 1 12 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.384 -0.431 25294 5167 1 12 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.362 -1.374 25294 5168 1 12 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.263 -3.063 25294 5169 1 12 . 1 1 117 117 LYS N N 117 121.536 121.536 126.327 -4.791 25294 5170 1 12 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.278 -0.139 25294 5171 1 12 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.918 -2.272 25294 5172 1 12 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.420 -0.841 25294 5173 1 13 . 1 1 5 5 SER N N 5 116.267 116.267 118.166 -1.899 25294 5174 1 13 . 1 1 5 5 SER HA H 5 4.349 4.349 4.748 -0.399 25294 5175 1 13 . 1 1 5 5 SER CA C 5 55.478 55.478 57.252 -1.774 25294 5176 1 13 . 1 1 5 5 SER CB C 5 61.191 61.191 64.792 -3.601 25294 5177 1 13 . 1 1 6 6 ASP N N 6 123.039 123.039 122.535 0.504 25294 5178 1 13 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.784 0.043 25294 5179 1 13 . 1 1 6 6 ASP CA C 6 49.671 49.671 53.046 -3.375 25294 5180 1 13 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.140 -2.484 25294 5181 1 13 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.371 -0.054 25294 5182 1 13 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.794 -3.647 25294 5183 1 13 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.182 -2.704 25294 5184 1 13 . 1 1 8 8 ASP N N 8 119.159 119.159 114.077 5.082 25294 5185 1 13 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.618 -0.053 25294 5186 1 13 . 1 1 8 8 ASP CA C 8 51.860 51.860 53.799 -1.939 25294 5187 1 13 . 1 1 8 8 ASP CB C 8 38.725 38.725 40.821 -2.096 25294 5188 1 13 . 1 1 9 9 GLY N N 9 108.837 108.837 108.460 0.377 25294 5189 1 13 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.112 -1.976 25294 5190 1 13 . 1 1 10 10 LEU N N 10 121.571 121.571 118.239 3.332 25294 5191 1 13 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.472 -0.205 25294 5192 1 13 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.021 -1.630 25294 5193 1 13 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.882 -3.019 25294 5194 1 13 . 1 1 11 11 ALA N N 11 125.169 125.169 122.664 2.505 25294 5195 1 13 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.540 -0.204 25294 5196 1 13 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.372 -2.388 25294 5197 1 13 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.969 -2.787 25294 5198 1 13 . 1 1 12 12 ASP N N 12 122.672 122.672 125.113 -2.441 25294 5199 1 13 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.048 -0.312 25294 5200 1 13 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.299 -1.597 25294 5201 1 13 . 1 1 12 12 ASP CB C 12 37.831 37.831 42.352 -4.521 25294 5202 1 13 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.464 -0.160 25294 5203 1 13 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.587 -2.987 25294 5204 1 13 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.529 -3.013 25294 5205 1 13 . 1 1 14 14 MET N N 14 120.151 120.151 117.439 2.712 25294 5206 1 13 . 1 1 14 14 MET HA H 14 3.780 3.780 4.626 -0.846 25294 5207 1 13 . 1 1 14 14 MET CA C 14 55.822 55.822 56.579 -0.757 25294 5208 1 13 . 1 1 14 14 MET CB C 14 30.909 30.909 32.563 -1.654 25294 5209 1 13 . 1 1 15 15 LYS N N 15 123.897 123.897 120.950 2.947 25294 5210 1 13 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.587 -0.130 25294 5211 1 13 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.335 -3.928 25294 5212 1 13 . 1 1 15 15 LYS CB C 15 32.453 32.453 36.261 -3.808 25294 5213 1 13 . 1 1 16 16 TRP N N 16 125.776 125.776 122.978 2.798 25294 5214 1 13 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.334 -0.259 25294 5215 1 13 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.548 -2.896 25294 5216 1 13 . 1 1 16 16 TRP CB C 16 28.000 28.000 31.242 -3.243 25294 5217 1 13 . 1 1 17 17 SER N N 17 120.772 120.772 119.610 1.162 25294 5218 1 13 . 1 1 17 17 SER HA H 17 4.403 4.403 4.522 -0.119 25294 5219 1 13 . 1 1 17 17 SER CA C 17 56.167 56.167 59.427 -3.260 25294 5220 1 13 . 1 1 17 17 SER CB C 17 60.833 60.833 63.304 -2.471 25294 5221 1 13 . 1 1 18 18 LYS N N 18 121.096 121.096 121.314 -0.218 25294 5222 1 13 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.606 0.112 25294 5223 1 13 . 1 1 18 18 LYS CA C 18 53.735 53.735 56.224 -2.489 25294 5224 1 13 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.672 -2.755 25294 5225 1 13 . 1 1 19 19 VAL N N 19 116.358 116.358 119.658 -3.300 25294 5226 1 13 . 1 1 19 19 VAL HA H 19 4.423 4.423 5.016 -0.593 25294 5227 1 13 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.413 -3.183 25294 5228 1 13 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.774 -3.748 25294 5229 1 13 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.596 -0.293 25294 5230 1 13 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.330 -2.560 25294 5231 1 13 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.489 -2.936 25294 5232 1 13 . 1 1 21 21 SER N N 21 118.882 118.882 115.413 3.469 25294 5233 1 13 . 1 1 21 21 SER HA H 21 4.084 4.084 4.405 -0.321 25294 5234 1 13 . 1 1 21 21 SER CA C 21 57.657 57.657 59.602 -1.944 25294 5235 1 13 . 1 1 21 21 SER CB C 21 60.173 60.173 63.371 -3.198 25294 5236 1 13 . 1 1 22 22 GLY N N 22 109.523 109.523 108.050 1.473 25294 5237 1 13 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.909 -2.505 25294 5238 1 13 . 1 1 23 23 LEU N N 23 123.003 123.003 121.616 1.387 25294 5239 1 13 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.367 -0.333 25294 5240 1 13 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.164 -1.562 25294 5241 1 13 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.627 -2.556 25294 5242 1 13 . 1 1 24 24 LYS N N 24 129.004 129.004 127.954 1.050 25294 5243 1 13 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.560 -0.050 25294 5244 1 13 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.434 -2.197 25294 5245 1 13 . 1 1 24 24 LYS CB C 24 32.161 32.161 32.768 -0.607 25294 5246 1 13 . 1 1 25 25 ASN N N 25 126.336 126.336 122.539 3.797 25294 5247 1 13 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.358 -0.034 25294 5248 1 13 . 1 1 25 25 ASN CA C 25 51.620 51.620 55.283 -3.663 25294 5249 1 13 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.386 -3.401 25294 5250 1 13 . 1 1 26 26 GLY N N 26 103.076 103.076 105.227 -2.151 25294 5251 1 13 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.281 -1.732 25294 5252 1 13 . 1 1 27 27 GLU N N 27 120.878 120.878 123.306 -2.428 25294 5253 1 13 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.032 0.170 25294 5254 1 13 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.075 -3.842 25294 5255 1 13 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.282 -0.521 25294 5256 1 13 . 1 1 28 28 LEU N N 28 128.583 128.583 126.719 1.864 25294 5257 1 13 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.610 -0.055 25294 5258 1 13 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.601 -3.277 25294 5259 1 13 . 1 1 28 28 LEU CB C 28 43.517 43.517 42.895 0.622 25294 5260 1 13 . 1 1 29 29 LYS N N 29 127.554 127.554 119.065 8.489 25294 5261 1 13 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.595 0.306 25294 5262 1 13 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.209 -2.370 25294 5263 1 13 . 1 1 29 29 LYS CB C 29 29.523 29.523 35.613 -6.090 25294 5264 1 13 . 1 1 30 30 VAL N N 30 127.915 127.915 119.286 8.629 25294 5265 1 13 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.477 -0.293 25294 5266 1 13 . 1 1 30 30 VAL CA C 30 58.308 58.308 61.092 -2.784 25294 5267 1 13 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.635 -4.365 25294 5268 1 13 . 1 1 31 31 GLU N N 31 125.151 125.151 124.260 0.891 25294 5269 1 13 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.713 -0.352 25294 5270 1 13 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.617 -0.518 25294 5271 1 13 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.223 -3.520 25294 5272 1 13 . 1 1 32 32 ALA N N 32 126.271 126.271 121.728 4.543 25294 5273 1 13 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.148 -0.132 25294 5274 1 13 . 1 1 32 32 ALA CA C 32 53.127 53.127 53.077 0.050 25294 5275 1 13 . 1 1 32 32 ALA CB C 32 15.266 15.266 17.006 -1.740 25294 5276 1 13 . 1 1 33 33 GLU N N 33 113.076 113.076 114.825 -1.749 25294 5277 1 13 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.487 -0.522 25294 5278 1 13 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.050 -0.065 25294 5279 1 13 . 1 1 33 33 GLU CB C 33 26.929 26.929 31.672 -4.743 25294 5280 1 13 . 1 1 34 34 GLY N N 34 104.905 104.905 106.223 -1.318 25294 5281 1 13 . 1 1 34 34 GLY CA C 34 40.707 40.707 44.689 -3.982 25294 5282 1 13 . 1 1 35 35 GLY N N 35 105.946 105.946 105.760 0.186 25294 5283 1 13 . 1 1 35 35 GLY CA C 35 42.988 42.988 45.432 -2.444 25294 5284 1 13 . 1 1 36 36 SER N N 36 116.044 116.044 120.897 -4.853 25294 5285 1 13 . 1 1 36 36 SER HA H 36 5.539 5.539 5.269 0.270 25294 5286 1 13 . 1 1 36 36 SER CA C 36 54.323 54.323 57.548 -3.225 25294 5287 1 13 . 1 1 36 36 SER CB C 36 62.808 62.808 64.606 -1.798 25294 5288 1 13 . 1 1 37 37 SER N N 37 119.501 119.501 122.160 -2.659 25294 5289 1 13 . 1 1 37 37 SER HA H 37 4.712 4.712 4.646 0.066 25294 5290 1 13 . 1 1 37 37 SER CA C 37 55.548 55.548 57.518 -1.970 25294 5291 1 13 . 1 1 37 37 SER CB C 37 63.943 63.943 65.870 -1.927 25294 5292 1 13 . 1 1 38 38 LEU N N 38 125.962 125.962 124.934 1.028 25294 5293 1 13 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.662 0.591 25294 5294 1 13 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.398 -2.615 25294 5295 1 13 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.044 -2.210 25294 5296 1 13 . 1 1 39 39 PHE N N 39 124.707 124.707 123.911 0.796 25294 5297 1 13 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.298 -0.159 25294 5298 1 13 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.072 -3.941 25294 5299 1 13 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.830 -1.878 25294 5300 1 13 . 1 1 40 40 ALA N N 40 124.994 124.994 126.599 -1.605 25294 5301 1 13 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.294 0.341 25294 5302 1 13 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.178 -1.877 25294 5303 1 13 . 1 1 40 40 ALA CB C 40 19.446 19.446 20.793 -1.347 25294 5304 1 13 . 1 1 41 41 CYS N N 41 125.757 125.757 123.526 2.231 25294 5305 1 13 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.411 -0.265 25294 5306 1 13 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.001 -2.536 25294 5307 1 13 . 1 1 41 41 CYS CB C 41 25.973 25.973 28.115 -2.142 25294 5308 1 13 . 1 1 42 42 LYS N N 42 129.019 129.019 128.340 0.679 25294 5309 1 13 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.322 -0.062 25294 5310 1 13 . 1 1 42 42 LYS CA C 42 54.851 54.851 56.902 -2.051 25294 5311 1 13 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.473 -0.366 25294 5312 1 13 . 1 1 43 43 ASN N N 43 113.240 113.240 113.892 -0.652 25294 5313 1 13 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.641 -0.116 25294 5314 1 13 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.367 -3.132 25294 5315 1 13 . 1 1 43 43 ASN CB C 43 34.861 34.861 38.902 -4.041 25294 5316 1 13 . 1 1 44 44 TYR N N 44 119.335 119.335 119.517 -0.182 25294 5317 1 13 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.645 -0.088 25294 5318 1 13 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.914 -2.196 25294 5319 1 13 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.788 -4.416 25294 5320 1 13 . 1 1 45 45 LYS N N 45 120.676 120.676 120.290 0.386 25294 5321 1 13 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.767 -0.731 25294 5322 1 13 . 1 1 45 45 LYS CA C 45 54.538 54.538 55.977 -1.440 25294 5323 1 13 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.448 -3.215 25294 5324 1 13 . 1 1 46 46 SER N N 46 108.797 108.797 113.895 -5.098 25294 5325 1 13 . 1 1 46 46 SER HA H 46 4.388 4.388 4.704 -0.316 25294 5326 1 13 . 1 1 46 46 SER CA C 46 53.664 53.664 58.145 -4.481 25294 5327 1 13 . 1 1 46 46 SER CB C 46 61.810 61.810 63.221 -1.411 25294 5328 1 13 . 1 1 47 47 PHE N N 47 117.325 117.325 118.870 -1.545 25294 5329 1 13 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.448 -0.806 25294 5330 1 13 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.444 -2.827 25294 5331 1 13 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.422 -5.322 25294 5332 1 13 . 1 1 48 48 TRP N N 48 117.090 117.090 115.832 1.258 25294 5333 1 13 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.192 0.043 25294 5334 1 13 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.541 -2.049 25294 5335 1 13 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.239 -1.344 25294 5336 1 13 . 1 1 49 49 ILE N N 49 119.682 119.682 120.903 -1.221 25294 5337 1 13 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.267 -0.236 25294 5338 1 13 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.865 -1.392 25294 5339 1 13 . 1 1 49 49 ILE CB C 49 36.436 36.436 35.909 0.527 25294 5340 1 13 . 1 1 50 50 SER N N 50 124.071 124.071 122.182 1.889 25294 5341 1 13 . 1 1 50 50 SER HA H 50 4.708 4.708 4.921 -0.213 25294 5342 1 13 . 1 1 50 50 SER CA C 50 56.110 56.110 58.044 -1.934 25294 5343 1 13 . 1 1 50 50 SER CB C 50 63.816 63.816 64.530 -0.714 25294 5344 1 13 . 1 1 51 51 SER N N 51 111.253 111.253 114.285 -3.032 25294 5345 1 13 . 1 1 51 51 SER HA H 51 4.557 4.557 4.616 -0.059 25294 5346 1 13 . 1 1 51 51 SER CA C 51 55.564 55.564 57.266 -1.702 25294 5347 1 13 . 1 1 51 51 SER CB C 51 62.821 62.821 65.377 -2.556 25294 5348 1 13 . 1 1 52 52 VAL N N 52 121.147 121.147 118.796 2.351 25294 5349 1 13 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.583 0.147 25294 5350 1 13 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.902 -1.776 25294 5351 1 13 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.209 -2.709 25294 5352 1 13 . 1 1 53 53 LYS N N 53 126.128 126.128 125.410 0.718 25294 5353 1 13 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.875 0.132 25294 5354 1 13 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.182 -2.459 25294 5355 1 13 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.329 -1.557 25294 5356 1 13 . 1 1 54 54 GLU N N 54 124.160 124.160 123.214 0.946 25294 5357 1 13 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.143 1.615 25294 5358 1 13 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.788 -2.529 25294 5359 1 13 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.418 -0.359 25294 5360 1 13 . 1 1 55 55 GLU N N 55 127.218 127.218 117.853 9.365 25294 5361 1 13 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.548 -0.640 25294 5362 1 13 . 1 1 55 55 GLU CA C 55 54.546 54.546 55.673 -1.127 25294 5363 1 13 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.239 -4.945 25294 5364 1 13 . 1 1 56 56 GLY N N 56 104.894 104.894 108.127 -3.233 25294 5365 1 13 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.338 -3.457 25294 5366 1 13 . 1 1 57 57 LYS N N 57 120.444 120.444 118.136 2.308 25294 5367 1 13 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.818 -0.254 25294 5368 1 13 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.497 -2.538 25294 5369 1 13 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.266 -2.078 25294 5370 1 13 . 1 1 58 58 PHE N N 58 121.824 121.824 119.848 1.976 25294 5371 1 13 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.433 -0.662 25294 5372 1 13 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.457 -0.292 25294 5373 1 13 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.876 -3.974 25294 5374 1 13 . 1 1 59 59 LYS N N 59 123.205 123.205 120.227 2.978 25294 5375 1 13 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.768 -0.317 25294 5376 1 13 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.891 -3.906 25294 5377 1 13 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.925 -5.134 25294 5378 1 13 . 1 1 60 60 GLU N N 60 122.647 122.647 119.166 3.481 25294 5379 1 13 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.337 -0.077 25294 5380 1 13 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.945 -2.039 25294 5381 1 13 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.644 -2.981 25294 5382 1 13 . 1 1 61 61 ASN N N 61 119.907 119.907 118.369 1.538 25294 5383 1 13 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.883 -0.038 25294 5384 1 13 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.210 -2.458 25294 5385 1 13 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.939 -3.916 25294 5386 1 13 . 1 1 62 62 THR N N 62 113.271 113.271 115.235 -1.964 25294 5387 1 13 . 1 1 62 62 THR HA H 62 4.308 4.308 4.355 -0.047 25294 5388 1 13 . 1 1 62 62 THR CA C 62 59.310 59.310 61.842 -2.532 25294 5389 1 13 . 1 1 62 62 THR CB C 62 66.813 66.813 69.087 -2.273 25294 5390 1 13 . 1 1 63 63 SER N N 63 116.521 116.521 116.161 0.360 25294 5391 1 13 . 1 1 63 63 SER HA H 63 4.650 4.650 4.378 0.272 25294 5392 1 13 . 1 1 63 63 SER CA C 63 54.094 54.094 57.324 -3.230 25294 5393 1 13 . 1 1 63 63 SER CB C 63 61.617 61.617 64.757 -3.140 25294 5394 1 13 . 1 1 64 64 TYR N N 64 120.183 120.183 120.964 -0.781 25294 5395 1 13 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.759 0.079 25294 5396 1 13 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.068 -1.665 25294 5397 1 13 . 1 1 64 64 TYR CB C 64 36.569 36.569 37.901 -1.332 25294 5398 1 13 . 1 1 65 65 LYS N N 65 115.195 115.195 113.819 1.376 25294 5399 1 13 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.531 0.190 25294 5400 1 13 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.376 -3.670 25294 5401 1 13 . 1 1 65 65 LYS CB C 65 31.820 31.820 33.715 -1.895 25294 5402 1 13 . 1 1 66 66 GLU N N 66 117.231 117.231 118.680 -1.449 25294 5403 1 13 . 1 1 66 66 GLU HA H 66 5.213 5.213 4.896 0.317 25294 5404 1 13 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.318 -2.705 25294 5405 1 13 . 1 1 66 66 GLU CB C 66 30.793 30.793 34.226 -3.433 25294 5406 1 13 . 1 1 67 67 PHE N N 67 121.532 121.532 118.392 3.140 25294 5407 1 13 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.819 -0.389 25294 5408 1 13 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.873 -1.604 25294 5409 1 13 . 1 1 67 67 PHE CB C 67 40.275 40.275 43.040 -2.765 25294 5410 1 13 . 1 1 68 68 ASP N N 68 128.157 128.157 124.493 3.664 25294 5411 1 13 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.840 -0.412 25294 5412 1 13 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.118 -2.562 25294 5413 1 13 . 1 1 68 68 ASP CB C 68 38.424 38.424 42.788 -4.364 25294 5414 1 13 . 1 1 69 69 GLY N N 69 114.151 114.151 110.972 3.179 25294 5415 1 13 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.168 -3.269 25294 5416 1 13 . 1 1 70 70 GLY N N 70 113.714 113.714 109.603 4.111 25294 5417 1 13 . 1 1 70 70 GLY CA C 70 43.994 43.994 46.055 -2.061 25294 5418 1 13 . 1 1 71 71 TRP N N 71 117.823 117.823 117.719 0.104 25294 5419 1 13 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.827 -0.019 25294 5420 1 13 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.661 -2.884 25294 5421 1 13 . 1 1 71 71 TRP CB C 71 25.645 25.645 31.120 -5.475 25294 5422 1 13 . 1 1 72 72 TYR N N 72 114.204 114.204 120.402 -6.198 25294 5423 1 13 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.641 0.484 25294 5424 1 13 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.601 -6.166 25294 5425 1 13 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.328 -1.708 25294 5426 1 13 . 1 1 73 73 LEU N N 73 121.469 121.469 126.926 -5.457 25294 5427 1 13 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.874 -0.107 25294 5428 1 13 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.586 -2.254 25294 5429 1 13 . 1 1 73 73 LEU CB C 73 43.403 43.403 45.612 -2.209 25294 5430 1 13 . 1 1 74 74 VAL N N 74 124.558 124.558 124.554 0.004 25294 5431 1 13 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.384 0.399 25294 5432 1 13 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.219 -3.407 25294 5433 1 13 . 1 1 74 74 VAL CB C 74 31.820 31.820 34.110 -2.290 25294 5434 1 13 . 1 1 75 75 LYS N N 75 125.824 125.824 125.123 0.701 25294 5435 1 13 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.232 -0.122 25294 5436 1 13 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.244 -2.440 25294 5437 1 13 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.379 -2.804 25294 5438 1 13 . 1 1 76 76 ILE N N 76 124.647 124.647 121.427 3.220 25294 5439 1 13 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.451 0.627 25294 5440 1 13 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.377 -3.010 25294 5441 1 13 . 1 1 76 76 ILE CB C 76 37.593 37.593 40.334 -2.741 25294 5442 1 13 . 1 1 77 77 GLU N N 77 128.081 128.081 127.042 1.039 25294 5443 1 13 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.652 -0.208 25294 5444 1 13 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.617 -3.147 25294 5445 1 13 . 1 1 77 77 GLU CB C 77 29.914 29.914 32.450 -2.536 25294 5446 1 13 . 1 1 78 78 ASP N N 78 126.158 126.158 123.938 2.220 25294 5447 1 13 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.257 -0.157 25294 5448 1 13 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.606 -3.543 25294 5449 1 13 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.644 -3.906 25294 5450 1 13 . 1 1 79 79 ASN N N 79 118.653 118.653 115.501 3.152 25294 5451 1 13 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.862 -0.216 25294 5452 1 13 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.719 -2.510 25294 5453 1 13 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.793 -5.443 25294 5454 1 13 . 1 1 80 80 GLU N N 80 120.378 120.378 122.680 -2.302 25294 5455 1 13 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.225 0.284 25294 5456 1 13 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.502 -2.642 25294 5457 1 13 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.815 -1.142 25294 5458 1 13 . 1 1 81 81 LEU N N 81 125.771 125.771 128.382 -2.611 25294 5459 1 13 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.078 -0.112 25294 5460 1 13 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.482 -3.468 25294 5461 1 13 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.914 -1.364 25294 5462 1 13 . 1 1 82 82 LYS N N 82 128.076 128.076 124.457 3.619 25294 5463 1 13 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.256 -0.011 25294 5464 1 13 . 1 1 82 82 LYS CA C 82 52.332 52.332 55.221 -2.889 25294 5465 1 13 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.728 -4.549 25294 5466 1 13 . 1 1 83 83 VAL N N 83 124.216 124.216 121.543 2.673 25294 5467 1 13 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.188 0.720 25294 5468 1 13 . 1 1 83 83 VAL CA C 83 58.380 58.380 61.066 -2.686 25294 5469 1 13 . 1 1 83 83 VAL CB C 83 32.168 32.168 33.683 -1.515 25294 5470 1 13 . 1 1 84 84 ILE N N 84 129.084 129.084 128.419 0.665 25294 5471 1 13 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.357 0.173 25294 5472 1 13 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.108 -1.702 25294 5473 1 13 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.420 -2.254 25294 5474 1 13 . 1 1 85 85 ILE N N 85 127.360 127.360 124.755 2.605 25294 5475 1 13 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.375 0.210 25294 5476 1 13 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.819 -1.359 25294 5477 1 13 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.112 -1.614 25294 5478 1 13 . 1 1 86 86 ASN N N 86 128.337 128.337 120.738 7.599 25294 5479 1 13 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.955 -0.189 25294 5480 1 13 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.333 -2.151 25294 5481 1 13 . 1 1 86 86 ASN CB C 86 36.891 36.891 41.438 -4.547 25294 5482 1 13 . 1 1 87 87 ARG N N 87 119.368 119.368 120.682 -1.314 25294 5483 1 13 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.186 -0.195 25294 5484 1 13 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.527 -2.329 25294 5485 1 13 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.735 -2.332 25294 5486 1 13 . 1 1 88 88 ASN N N 88 125.082 125.082 123.731 1.351 25294 5487 1 13 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.410 0.315 25294 5488 1 13 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.546 -4.443 25294 5489 1 13 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.377 -3.620 25294 5490 1 13 . 1 1 89 89 GLU N N 89 125.309 125.309 122.791 2.518 25294 5491 1 13 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.363 -0.005 25294 5492 1 13 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.146 -3.133 25294 5493 1 13 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.801 -2.717 25294 5494 1 13 . 1 1 90 90 THR N N 90 112.516 112.516 112.753 -0.237 25294 5495 1 13 . 1 1 90 90 THR HA H 90 4.534 4.534 4.574 -0.040 25294 5496 1 13 . 1 1 90 90 THR CA C 90 58.161 58.161 60.081 -1.920 25294 5497 1 13 . 1 1 90 90 THR CB C 90 68.409 68.409 72.322 -3.913 25294 5498 1 13 . 1 1 91 91 ASN N N 91 116.717 116.717 119.656 -2.939 25294 5499 1 13 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.881 -0.174 25294 5500 1 13 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.417 -3.621 25294 5501 1 13 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.296 -2.822 25294 5502 1 13 . 1 1 92 92 ALA N N 92 122.025 122.025 123.063 -1.038 25294 5503 1 13 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.673 -0.037 25294 5504 1 13 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.444 -2.396 25294 5505 1 13 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.915 -1.199 25294 5506 1 13 . 1 1 93 93 SER N N 93 115.895 115.895 119.294 -3.399 25294 5507 1 13 . 1 1 93 93 SER HA H 93 4.536 4.536 4.683 -0.147 25294 5508 1 13 . 1 1 93 93 SER CA C 93 54.865 54.865 58.502 -3.637 25294 5509 1 13 . 1 1 93 93 SER CB C 93 61.292 61.292 64.183 -2.891 25294 5510 1 13 . 1 1 94 94 ARG N N 94 119.529 119.529 118.874 0.655 25294 5511 1 13 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.745 0.169 25294 5512 1 13 . 1 1 94 94 ARG CA C 94 52.096 52.096 55.729 -3.633 25294 5513 1 13 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.312 -3.800 25294 5514 1 13 . 1 1 95 95 SER N N 95 114.542 114.542 115.851 -1.309 25294 5515 1 13 . 1 1 95 95 SER HA H 95 5.926 5.926 4.963 0.963 25294 5516 1 13 . 1 1 95 95 SER CA C 95 54.219 54.219 57.749 -3.530 25294 5517 1 13 . 1 1 95 95 SER CB C 95 65.271 65.271 66.164 -0.893 25294 5518 1 13 . 1 1 96 96 PHE N N 96 117.183 117.183 124.720 -7.537 25294 5519 1 13 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.072 0.266 25294 5520 1 13 . 1 1 96 96 PHE CA C 96 54.480 54.480 57.181 -2.701 25294 5521 1 13 . 1 1 96 96 PHE CB C 96 38.868 38.868 42.307 -3.439 25294 5522 1 13 . 1 1 97 97 THR N N 97 115.263 115.263 116.067 -0.804 25294 5523 1 13 . 1 1 97 97 THR HA H 97 5.250 5.250 5.287 -0.037 25294 5524 1 13 . 1 1 97 97 THR CA C 97 58.178 58.178 61.529 -3.351 25294 5525 1 13 . 1 1 97 97 THR CB C 97 69.068 69.068 72.072 -3.003 25294 5526 1 13 . 1 1 98 98 VAL N N 98 125.442 125.442 118.419 7.023 25294 5527 1 13 . 1 1 98 98 VAL HA H 98 4.857 4.857 5.014 -0.157 25294 5528 1 13 . 1 1 98 98 VAL CA C 98 57.409 57.409 59.251 -1.842 25294 5529 1 13 . 1 1 98 98 VAL CB C 98 32.929 32.929 35.168 -2.239 25294 5530 1 13 . 1 1 99 99 CYS N N 99 127.111 127.111 124.580 2.531 25294 5531 1 13 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.392 -0.046 25294 5532 1 13 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.092 -2.141 25294 5533 1 13 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.748 -4.806 25294 5534 1 13 . 1 1 100 100 VAL N N 100 120.146 120.146 122.937 -2.791 25294 5535 1 13 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.264 0.119 25294 5536 1 13 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.668 -3.955 25294 5537 1 13 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.393 -1.750 25294 5538 1 13 . 1 1 101 101 GLU N N 101 118.807 118.807 126.161 -7.354 25294 5539 1 13 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.858 -0.106 25294 5540 1 13 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.015 -2.580 25294 5541 1 13 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.168 -1.447 25294 5542 1 13 . 1 1 102 102 ALA N N 102 124.088 124.088 127.593 -3.505 25294 5543 1 13 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.928 -1.071 25294 5544 1 13 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.019 -2.141 25294 5545 1 13 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.083 -1.058 25294 5546 1 13 . 1 1 103 103 GLY N N 103 111.186 111.186 109.371 1.815 25294 5547 1 13 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.664 -2.021 25294 5548 1 13 . 1 1 104 104 ASN N N 104 123.092 123.092 122.121 0.971 25294 5549 1 13 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.710 -0.038 25294 5550 1 13 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.809 -3.113 25294 5551 1 13 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.440 -3.033 25294 5552 1 13 . 1 1 105 105 ALA N N 105 122.653 122.653 118.423 4.230 25294 5553 1 13 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.342 0.089 25294 5554 1 13 . 1 1 105 105 ALA CA C 105 48.668 48.668 50.821 -2.153 25294 5555 1 13 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.892 -1.956 25294 5556 1 13 . 1 1 106 106 PHE N N 106 116.011 116.011 113.622 2.389 25294 5557 1 13 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.520 -0.103 25294 5558 1 13 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.338 -2.780 25294 5559 1 13 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.214 -1.730 25294 5560 1 13 . 1 1 107 107 ASP N N 107 121.992 121.992 119.314 2.678 25294 5561 1 13 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.683 -0.089 25294 5562 1 13 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.708 -2.184 25294 5563 1 13 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.841 -1.750 25294 5564 1 13 . 1 1 108 108 GLU N N 108 119.354 119.354 122.030 -2.676 25294 5565 1 13 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.835 0.174 25294 5566 1 13 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.653 -2.665 25294 5567 1 13 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.616 -1.299 25294 5568 1 13 . 1 1 109 109 PHE N N 109 122.098 122.098 125.260 -3.162 25294 5569 1 13 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.835 0.123 25294 5570 1 13 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.178 -3.391 25294 5571 1 13 . 1 1 109 109 PHE CB C 109 40.443 40.443 40.666 -0.223 25294 5572 1 13 . 1 1 110 110 LYS N N 110 124.500 124.500 124.181 0.319 25294 5573 1 13 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.594 0.098 25294 5574 1 13 . 1 1 110 110 LYS CA C 110 51.891 51.891 56.420 -4.529 25294 5575 1 13 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.788 0.225 25294 5576 1 13 . 1 1 111 111 PHE N N 111 125.010 125.010 123.739 1.271 25294 5577 1 13 . 1 1 111 111 PHE HA H 111 4.754 4.754 4.887 -0.133 25294 5578 1 13 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.254 0.930 25294 5579 1 13 . 1 1 111 111 PHE CB C 111 38.380 38.380 42.408 -4.028 25294 5580 1 13 . 1 1 112 112 VAL N N 112 122.957 122.957 122.251 0.706 25294 5581 1 13 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.735 -0.295 25294 5582 1 13 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.026 -2.770 25294 5583 1 13 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.696 -4.603 25294 5584 1 13 . 1 1 113 113 GLN N N 113 130.864 130.864 127.881 2.983 25294 5585 1 13 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.039 0.280 25294 5586 1 13 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.688 -2.569 25294 5587 1 13 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.504 -4.340 25294 5588 1 13 . 1 1 114 114 ASP N N 114 126.272 126.272 127.778 -1.506 25294 5589 1 13 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.698 -0.371 25294 5590 1 13 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.858 -3.085 25294 5591 1 13 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.036 -3.181 25294 5592 1 13 . 1 1 115 115 ALA N N 115 120.134 120.134 121.601 -1.467 25294 5593 1 13 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.248 -0.549 25294 5594 1 13 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.750 -2.849 25294 5595 1 13 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.856 -2.105 25294 5596 1 13 . 1 1 116 116 ALA N N 116 121.377 121.377 123.997 -2.620 25294 5597 1 13 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.330 -0.377 25294 5598 1 13 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.240 -2.252 25294 5599 1 13 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.826 -3.626 25294 5600 1 13 . 1 1 117 117 LYS N N 117 121.536 121.536 122.498 -0.962 25294 5601 1 13 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.504 -0.365 25294 5602 1 13 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.608 -1.962 25294 5603 1 13 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.513 -0.934 25294 5604 1 14 . 1 1 5 5 SER N N 5 116.267 116.267 113.793 2.474 25294 5605 1 14 . 1 1 5 5 SER HA H 5 4.349 4.349 4.572 -0.223 25294 5606 1 14 . 1 1 5 5 SER CA C 5 55.478 55.478 56.992 -1.514 25294 5607 1 14 . 1 1 5 5 SER CB C 5 61.191 61.191 65.494 -4.303 25294 5608 1 14 . 1 1 6 6 ASP N N 6 123.039 123.039 120.727 2.312 25294 5609 1 14 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.901 -0.074 25294 5610 1 14 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.547 -2.877 25294 5611 1 14 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.402 -2.746 25294 5612 1 14 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.433 -0.116 25294 5613 1 14 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.231 -3.084 25294 5614 1 14 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.277 -2.799 25294 5615 1 14 . 1 1 8 8 ASP N N 8 119.159 119.159 116.784 2.375 25294 5616 1 14 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.650 -0.085 25294 5617 1 14 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.173 -2.313 25294 5618 1 14 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.902 -3.177 25294 5619 1 14 . 1 1 9 9 GLY N N 9 108.837 108.837 109.465 -0.628 25294 5620 1 14 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.961 -2.825 25294 5621 1 14 . 1 1 10 10 LEU N N 10 121.571 121.571 117.315 4.256 25294 5622 1 14 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.885 -0.618 25294 5623 1 14 . 1 1 10 10 LEU CA C 10 52.391 52.391 51.987 0.404 25294 5624 1 14 . 1 1 10 10 LEU CB C 10 39.863 39.863 43.914 -4.051 25294 5625 1 14 . 1 1 11 11 ALA N N 11 125.169 125.169 124.109 1.060 25294 5626 1 14 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.547 -0.211 25294 5627 1 14 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.301 -2.317 25294 5628 1 14 . 1 1 11 11 ALA CB C 11 17.182 17.182 18.515 -1.333 25294 5629 1 14 . 1 1 12 12 ASP N N 12 122.672 122.672 125.067 -2.395 25294 5630 1 14 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.778 -0.042 25294 5631 1 14 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.647 -1.945 25294 5632 1 14 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.766 -3.935 25294 5633 1 14 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.566 -0.262 25294 5634 1 14 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.406 -2.805 25294 5635 1 14 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.981 -3.466 25294 5636 1 14 . 1 1 14 14 MET N N 14 120.151 120.151 120.097 0.054 25294 5637 1 14 . 1 1 14 14 MET HA H 14 3.780 3.780 4.517 -0.737 25294 5638 1 14 . 1 1 14 14 MET CA C 14 55.822 55.822 56.317 -0.495 25294 5639 1 14 . 1 1 14 14 MET CB C 14 30.909 30.909 32.564 -1.655 25294 5640 1 14 . 1 1 15 15 LYS N N 15 123.897 123.897 121.043 2.854 25294 5641 1 14 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.789 -0.332 25294 5642 1 14 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.012 -3.605 25294 5643 1 14 . 1 1 15 15 LYS CB C 15 32.453 32.453 35.201 -2.748 25294 5644 1 14 . 1 1 16 16 TRP N N 16 125.776 125.776 122.700 3.076 25294 5645 1 14 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.345 -0.270 25294 5646 1 14 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.553 -2.901 25294 5647 1 14 . 1 1 16 16 TRP CB C 16 28.000 28.000 31.461 -3.461 25294 5648 1 14 . 1 1 17 17 SER N N 17 120.772 120.772 120.316 0.456 25294 5649 1 14 . 1 1 17 17 SER HA H 17 4.403 4.403 4.546 -0.143 25294 5650 1 14 . 1 1 17 17 SER CA C 17 56.167 56.167 59.751 -3.584 25294 5651 1 14 . 1 1 17 17 SER CB C 17 60.833 60.833 63.340 -2.507 25294 5652 1 14 . 1 1 18 18 LYS N N 18 121.096 121.096 119.343 1.753 25294 5653 1 14 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.630 0.088 25294 5654 1 14 . 1 1 18 18 LYS CA C 18 53.735 53.735 54.702 -0.967 25294 5655 1 14 . 1 1 18 18 LYS CB C 18 32.917 32.917 33.412 -0.495 25294 5656 1 14 . 1 1 19 19 VAL N N 19 116.358 116.358 120.240 -3.882 25294 5657 1 14 . 1 1 19 19 VAL HA H 19 4.423 4.423 3.996 0.427 25294 5658 1 14 . 1 1 19 19 VAL CA C 19 55.230 55.230 60.310 -5.080 25294 5659 1 14 . 1 1 19 19 VAL CB C 19 31.026 31.026 30.620 0.406 25294 5660 1 14 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.550 -0.247 25294 5661 1 14 . 1 1 20 20 PRO CA C 20 59.770 59.770 61.985 -2.215 25294 5662 1 14 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.359 -2.806 25294 5663 1 14 . 1 1 21 21 SER N N 21 118.882 118.882 115.352 3.530 25294 5664 1 14 . 1 1 21 21 SER HA H 21 4.084 4.084 4.266 -0.182 25294 5665 1 14 . 1 1 21 21 SER CA C 21 57.657 57.657 60.584 -2.927 25294 5666 1 14 . 1 1 21 21 SER CB C 21 60.173 60.173 62.945 -2.772 25294 5667 1 14 . 1 1 22 22 GLY N N 22 109.523 109.523 109.596 -0.073 25294 5668 1 14 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.675 -2.271 25294 5669 1 14 . 1 1 23 23 LEU N N 23 123.003 123.003 121.782 1.221 25294 5670 1 14 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.340 -0.306 25294 5671 1 14 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.699 -2.096 25294 5672 1 14 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.491 -2.420 25294 5673 1 14 . 1 1 24 24 LYS N N 24 129.004 129.004 127.834 1.170 25294 5674 1 14 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.557 -0.047 25294 5675 1 14 . 1 1 24 24 LYS CA C 24 53.237 53.237 54.449 -1.212 25294 5676 1 14 . 1 1 24 24 LYS CB C 24 32.161 32.161 32.958 -0.797 25294 5677 1 14 . 1 1 25 25 ASN N N 25 126.336 126.336 121.996 4.340 25294 5678 1 14 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.368 -0.044 25294 5679 1 14 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.064 -2.444 25294 5680 1 14 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.416 -3.432 25294 5681 1 14 . 1 1 26 26 GLY N N 26 103.076 103.076 103.275 -0.199 25294 5682 1 14 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.726 -1.177 25294 5683 1 14 . 1 1 27 27 GLU N N 27 120.878 120.878 122.795 -1.917 25294 5684 1 14 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.815 0.387 25294 5685 1 14 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.592 -4.359 25294 5686 1 14 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.480 -0.719 25294 5687 1 14 . 1 1 28 28 LEU N N 28 128.583 128.583 126.907 1.676 25294 5688 1 14 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.788 -0.233 25294 5689 1 14 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.815 -3.491 25294 5690 1 14 . 1 1 28 28 LEU CB C 28 43.517 43.517 43.836 -0.319 25294 5691 1 14 . 1 1 29 29 LYS N N 29 127.554 127.554 125.531 2.023 25294 5692 1 14 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.434 0.467 25294 5693 1 14 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.048 -3.209 25294 5694 1 14 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.296 -2.773 25294 5695 1 14 . 1 1 30 30 VAL N N 30 127.915 127.915 128.275 -0.360 25294 5696 1 14 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.457 -0.273 25294 5697 1 14 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.452 -2.144 25294 5698 1 14 . 1 1 30 30 VAL CB C 30 32.270 32.270 34.268 -1.998 25294 5699 1 14 . 1 1 31 31 GLU N N 31 125.151 125.151 126.765 -1.614 25294 5700 1 14 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.490 -0.129 25294 5701 1 14 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.652 -1.552 25294 5702 1 14 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.247 -2.544 25294 5703 1 14 . 1 1 32 32 ALA N N 32 126.271 126.271 120.479 5.792 25294 5704 1 14 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.245 -0.229 25294 5705 1 14 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.608 -1.481 25294 5706 1 14 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.434 -3.168 25294 5707 1 14 . 1 1 33 33 GLU N N 33 113.076 113.076 114.795 -1.719 25294 5708 1 14 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.283 -0.318 25294 5709 1 14 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.151 -0.166 25294 5710 1 14 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.187 -3.258 25294 5711 1 14 . 1 1 34 34 GLY N N 34 104.905 104.905 107.499 -2.594 25294 5712 1 14 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.084 -4.377 25294 5713 1 14 . 1 1 35 35 GLY N N 35 105.946 105.946 105.809 0.137 25294 5714 1 14 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.746 -1.758 25294 5715 1 14 . 1 1 36 36 SER N N 36 116.044 116.044 113.954 2.090 25294 5716 1 14 . 1 1 36 36 SER HA H 36 5.539 5.539 4.819 0.720 25294 5717 1 14 . 1 1 36 36 SER CA C 36 54.323 54.323 57.965 -3.642 25294 5718 1 14 . 1 1 36 36 SER CB C 36 62.808 62.808 65.371 -2.563 25294 5719 1 14 . 1 1 37 37 SER N N 37 119.501 119.501 114.645 4.856 25294 5720 1 14 . 1 1 37 37 SER HA H 37 4.712 4.712 4.681 0.031 25294 5721 1 14 . 1 1 37 37 SER CA C 37 55.548 55.548 58.125 -2.577 25294 5722 1 14 . 1 1 37 37 SER CB C 37 63.943 63.943 66.416 -2.473 25294 5723 1 14 . 1 1 38 38 LEU N N 38 125.962 125.962 125.067 0.895 25294 5724 1 14 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.680 0.573 25294 5725 1 14 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.623 -2.841 25294 5726 1 14 . 1 1 38 38 LEU CB C 38 42.834 42.834 43.986 -1.152 25294 5727 1 14 . 1 1 39 39 PHE N N 39 124.707 124.707 122.517 2.190 25294 5728 1 14 . 1 1 39 39 PHE HA H 39 5.139 5.139 4.997 0.142 25294 5729 1 14 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.341 -4.210 25294 5730 1 14 . 1 1 39 39 PHE CB C 39 38.952 38.952 42.966 -4.014 25294 5731 1 14 . 1 1 40 40 ALA N N 40 124.994 124.994 124.975 0.019 25294 5732 1 14 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.595 0.040 25294 5733 1 14 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.874 -2.573 25294 5734 1 14 . 1 1 40 40 ALA CB C 40 19.446 19.446 21.768 -2.322 25294 5735 1 14 . 1 1 41 41 CYS N N 41 125.757 125.757 124.734 1.023 25294 5736 1 14 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.043 0.103 25294 5737 1 14 . 1 1 41 41 CYS CA C 41 56.465 56.465 58.888 -2.423 25294 5738 1 14 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.438 -1.465 25294 5739 1 14 . 1 1 42 42 LYS N N 42 129.019 129.019 127.344 1.675 25294 5740 1 14 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.335 -0.075 25294 5741 1 14 . 1 1 42 42 LYS CA C 42 54.851 54.851 56.428 -1.577 25294 5742 1 14 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.343 -0.236 25294 5743 1 14 . 1 1 43 43 ASN N N 43 113.240 113.240 115.916 -2.676 25294 5744 1 14 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.602 -0.077 25294 5745 1 14 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.234 -2.999 25294 5746 1 14 . 1 1 43 43 ASN CB C 43 34.861 34.861 40.795 -5.934 25294 5747 1 14 . 1 1 44 44 TYR N N 44 119.335 119.335 119.032 0.303 25294 5748 1 14 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.673 -0.116 25294 5749 1 14 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.995 -2.277 25294 5750 1 14 . 1 1 44 44 TYR CB C 44 37.372 37.372 40.982 -3.610 25294 5751 1 14 . 1 1 45 45 LYS N N 45 120.676 120.676 120.420 0.256 25294 5752 1 14 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.760 -0.724 25294 5753 1 14 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.443 -1.905 25294 5754 1 14 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.234 -3.001 25294 5755 1 14 . 1 1 46 46 SER N N 46 108.797 108.797 115.154 -6.357 25294 5756 1 14 . 1 1 46 46 SER HA H 46 4.388 4.388 4.787 -0.399 25294 5757 1 14 . 1 1 46 46 SER CA C 46 53.664 53.664 57.924 -4.260 25294 5758 1 14 . 1 1 46 46 SER CB C 46 61.810 61.810 63.625 -1.815 25294 5759 1 14 . 1 1 47 47 PHE N N 47 117.325 117.325 119.373 -2.048 25294 5760 1 14 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.282 -0.640 25294 5761 1 14 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.971 -3.354 25294 5762 1 14 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.362 -5.261 25294 5763 1 14 . 1 1 48 48 TRP N N 48 117.090 117.090 117.058 0.032 25294 5764 1 14 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.196 0.039 25294 5765 1 14 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.499 -2.007 25294 5766 1 14 . 1 1 48 48 TRP CB C 48 29.895 29.895 30.890 -0.994 25294 5767 1 14 . 1 1 49 49 ILE N N 49 119.682 119.682 121.838 -2.156 25294 5768 1 14 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.485 -0.454 25294 5769 1 14 . 1 1 49 49 ILE CA C 49 60.473 60.473 60.396 0.077 25294 5770 1 14 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.138 0.298 25294 5771 1 14 . 1 1 50 50 SER N N 50 124.071 124.071 122.950 1.121 25294 5772 1 14 . 1 1 50 50 SER HA H 50 4.708 4.708 4.311 0.397 25294 5773 1 14 . 1 1 50 50 SER CA C 50 56.110 56.110 60.488 -4.378 25294 5774 1 14 . 1 1 50 50 SER CB C 50 63.816 63.816 63.888 -0.072 25294 5775 1 14 . 1 1 51 51 SER N N 51 111.253 111.253 116.754 -5.501 25294 5776 1 14 . 1 1 51 51 SER HA H 51 4.557 4.557 4.555 0.002 25294 5777 1 14 . 1 1 51 51 SER CA C 51 55.564 55.564 57.818 -2.254 25294 5778 1 14 . 1 1 51 51 SER CB C 51 62.821 62.821 64.428 -1.607 25294 5779 1 14 . 1 1 52 52 VAL N N 52 121.147 121.147 121.857 -0.710 25294 5780 1 14 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.718 0.013 25294 5781 1 14 . 1 1 52 52 VAL CA C 52 59.126 59.126 61.171 -2.045 25294 5782 1 14 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.694 -3.194 25294 5783 1 14 . 1 1 53 53 LYS N N 53 126.128 126.128 125.423 0.705 25294 5784 1 14 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.539 0.468 25294 5785 1 14 . 1 1 53 53 LYS CA C 53 51.723 51.723 53.921 -2.198 25294 5786 1 14 . 1 1 53 53 LYS CB C 53 33.772 33.772 34.203 -0.431 25294 5787 1 14 . 1 1 54 54 GLU N N 54 124.160 124.160 123.553 0.607 25294 5788 1 14 . 1 1 54 54 GLU HA H 54 4.758 4.758 2.988 1.770 25294 5789 1 14 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.594 -2.335 25294 5790 1 14 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.436 -0.377 25294 5791 1 14 . 1 1 55 55 GLU N N 55 127.218 127.218 118.780 8.438 25294 5792 1 14 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.466 -0.558 25294 5793 1 14 . 1 1 55 55 GLU CA C 55 54.546 54.546 55.880 -1.334 25294 5794 1 14 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.287 -4.992 25294 5795 1 14 . 1 1 56 56 GLY N N 56 104.894 104.894 108.407 -3.513 25294 5796 1 14 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.093 -3.212 25294 5797 1 14 . 1 1 57 57 LYS N N 57 120.444 120.444 117.544 2.900 25294 5798 1 14 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.603 -0.039 25294 5799 1 14 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.066 -2.107 25294 5800 1 14 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.777 -2.589 25294 5801 1 14 . 1 1 58 58 PHE N N 58 121.824 121.824 120.182 1.642 25294 5802 1 14 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.165 -0.394 25294 5803 1 14 . 1 1 58 58 PHE CA C 58 56.165 56.165 58.021 -1.856 25294 5804 1 14 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.705 -3.803 25294 5805 1 14 . 1 1 59 59 LYS N N 59 123.205 123.205 120.112 3.093 25294 5806 1 14 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.673 -0.222 25294 5807 1 14 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.805 -3.820 25294 5808 1 14 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.307 -4.516 25294 5809 1 14 . 1 1 60 60 GLU N N 60 122.647 122.647 119.088 3.559 25294 5810 1 14 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.539 -0.279 25294 5811 1 14 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.849 -1.943 25294 5812 1 14 . 1 1 60 60 GLU CB C 60 27.663 27.663 32.063 -4.400 25294 5813 1 14 . 1 1 61 61 ASN N N 61 119.907 119.907 119.871 0.036 25294 5814 1 14 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.017 -0.172 25294 5815 1 14 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.537 -2.785 25294 5816 1 14 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.429 -3.406 25294 5817 1 14 . 1 1 62 62 THR N N 62 113.271 113.271 118.138 -4.867 25294 5818 1 14 . 1 1 62 62 THR HA H 62 4.308 4.308 4.478 -0.170 25294 5819 1 14 . 1 1 62 62 THR CA C 62 59.310 59.310 63.112 -3.802 25294 5820 1 14 . 1 1 62 62 THR CB C 62 66.813 66.813 68.982 -2.169 25294 5821 1 14 . 1 1 63 63 SER N N 63 116.521 116.521 115.699 0.822 25294 5822 1 14 . 1 1 63 63 SER HA H 63 4.650 4.650 4.776 -0.126 25294 5823 1 14 . 1 1 63 63 SER CA C 63 54.094 54.094 57.999 -3.905 25294 5824 1 14 . 1 1 63 63 SER CB C 63 61.617 61.617 65.130 -3.513 25294 5825 1 14 . 1 1 64 64 TYR N N 64 120.183 120.183 120.012 0.171 25294 5826 1 14 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.877 -0.039 25294 5827 1 14 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.033 -1.630 25294 5828 1 14 . 1 1 64 64 TYR CB C 64 36.569 36.569 38.834 -2.264 25294 5829 1 14 . 1 1 65 65 LYS N N 65 115.195 115.195 114.110 1.085 25294 5830 1 14 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.470 0.251 25294 5831 1 14 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.560 -3.854 25294 5832 1 14 . 1 1 65 65 LYS CB C 65 31.820 31.820 33.276 -1.456 25294 5833 1 14 . 1 1 66 66 GLU N N 66 117.231 117.231 119.966 -2.735 25294 5834 1 14 . 1 1 66 66 GLU HA H 66 5.213 5.213 4.895 0.318 25294 5835 1 14 . 1 1 66 66 GLU CA C 66 52.613 52.613 54.919 -2.306 25294 5836 1 14 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.253 -2.460 25294 5837 1 14 . 1 1 67 67 PHE N N 67 121.532 121.532 122.692 -1.160 25294 5838 1 14 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.725 -0.295 25294 5839 1 14 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.390 -1.121 25294 5840 1 14 . 1 1 67 67 PHE CB C 67 40.275 40.275 43.207 -2.932 25294 5841 1 14 . 1 1 68 68 ASP N N 68 128.157 128.157 125.276 2.881 25294 5842 1 14 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.826 -0.398 25294 5843 1 14 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.307 -2.751 25294 5844 1 14 . 1 1 68 68 ASP CB C 68 38.424 38.424 42.127 -3.703 25294 5845 1 14 . 1 1 69 69 GLY N N 69 114.151 114.151 111.717 2.434 25294 5846 1 14 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.374 -3.475 25294 5847 1 14 . 1 1 70 70 GLY N N 70 113.714 113.714 110.580 3.134 25294 5848 1 14 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.477 -1.483 25294 5849 1 14 . 1 1 71 71 TRP N N 71 117.823 117.823 121.476 -3.653 25294 5850 1 14 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.877 -0.069 25294 5851 1 14 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.379 -2.602 25294 5852 1 14 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.639 -3.994 25294 5853 1 14 . 1 1 72 72 TYR N N 72 114.204 114.204 121.129 -6.925 25294 5854 1 14 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.970 0.155 25294 5855 1 14 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.716 -6.281 25294 5856 1 14 . 1 1 72 72 TYR CB C 72 38.620 38.620 39.883 -1.264 25294 5857 1 14 . 1 1 73 73 LEU N N 73 121.469 121.469 127.130 -5.661 25294 5858 1 14 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.141 -0.374 25294 5859 1 14 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.732 -2.400 25294 5860 1 14 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.693 -3.290 25294 5861 1 14 . 1 1 74 74 VAL N N 74 124.558 124.558 124.427 0.131 25294 5862 1 14 . 1 1 74 74 VAL HA H 74 4.783 4.783 5.135 -0.352 25294 5863 1 14 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.306 -2.494 25294 5864 1 14 . 1 1 74 74 VAL CB C 74 31.820 31.820 35.177 -3.357 25294 5865 1 14 . 1 1 75 75 LYS N N 75 125.824 125.824 124.584 1.240 25294 5866 1 14 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.031 0.079 25294 5867 1 14 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.355 -2.551 25294 5868 1 14 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.389 -2.814 25294 5869 1 14 . 1 1 76 76 ILE N N 76 124.647 124.647 122.729 1.918 25294 5870 1 14 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.714 0.364 25294 5871 1 14 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.588 -3.221 25294 5872 1 14 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.741 -2.148 25294 5873 1 14 . 1 1 77 77 GLU N N 77 128.081 128.081 129.850 -1.769 25294 5874 1 14 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.596 -0.152 25294 5875 1 14 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.533 -3.062 25294 5876 1 14 . 1 1 77 77 GLU CB C 77 29.914 29.914 29.925 -0.011 25294 5877 1 14 . 1 1 78 78 ASP N N 78 126.158 126.158 124.320 1.838 25294 5878 1 14 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.171 -0.071 25294 5879 1 14 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.703 -3.640 25294 5880 1 14 . 1 1 78 78 ASP CB C 78 36.738 36.738 39.573 -2.835 25294 5881 1 14 . 1 1 79 79 ASN N N 79 118.653 118.653 117.268 1.385 25294 5882 1 14 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.843 -0.197 25294 5883 1 14 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.144 -1.935 25294 5884 1 14 . 1 1 79 79 ASN CB C 79 35.350 35.350 41.510 -6.160 25294 5885 1 14 . 1 1 80 80 GLU N N 80 120.378 120.378 122.258 -1.880 25294 5886 1 14 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.251 0.258 25294 5887 1 14 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.614 -2.754 25294 5888 1 14 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.659 -0.986 25294 5889 1 14 . 1 1 81 81 LEU N N 81 125.771 125.771 129.658 -3.887 25294 5890 1 14 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.038 -0.072 25294 5891 1 14 . 1 1 81 81 LEU CA C 81 51.014 51.014 55.033 -4.019 25294 5892 1 14 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.439 -0.889 25294 5893 1 14 . 1 1 82 82 LYS N N 82 128.076 128.076 127.079 0.997 25294 5894 1 14 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.316 -0.071 25294 5895 1 14 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.754 -2.422 25294 5896 1 14 . 1 1 82 82 LYS CB C 82 32.179 32.179 35.356 -3.177 25294 5897 1 14 . 1 1 83 83 VAL N N 83 124.216 124.216 119.903 4.313 25294 5898 1 14 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.249 -0.341 25294 5899 1 14 . 1 1 83 83 VAL CA C 83 58.380 58.380 58.944 -0.564 25294 5900 1 14 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.725 -2.557 25294 5901 1 14 . 1 1 84 84 ILE N N 84 129.084 129.084 122.614 6.470 25294 5902 1 14 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.647 -0.117 25294 5903 1 14 . 1 1 84 84 ILE CA C 84 58.406 58.406 57.607 0.799 25294 5904 1 14 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.734 -2.568 25294 5905 1 14 . 1 1 85 85 ILE N N 85 127.360 127.360 123.563 3.797 25294 5906 1 14 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.429 0.156 25294 5907 1 14 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.852 -1.392 25294 5908 1 14 . 1 1 85 85 ILE CB C 85 38.498 38.498 39.964 -1.466 25294 5909 1 14 . 1 1 86 86 ASN N N 86 128.337 128.337 125.601 2.736 25294 5910 1 14 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.814 -0.048 25294 5911 1 14 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.915 -2.733 25294 5912 1 14 . 1 1 86 86 ASN CB C 86 36.891 36.891 39.719 -2.828 25294 5913 1 14 . 1 1 87 87 ARG N N 87 119.368 119.368 119.927 -0.559 25294 5914 1 14 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.241 -0.250 25294 5915 1 14 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.312 -2.114 25294 5916 1 14 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.670 -2.267 25294 5917 1 14 . 1 1 88 88 ASN N N 88 125.082 125.082 123.858 1.224 25294 5918 1 14 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.443 0.282 25294 5919 1 14 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.285 -4.182 25294 5920 1 14 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.821 -4.064 25294 5921 1 14 . 1 1 89 89 GLU N N 89 125.309 125.309 123.409 1.900 25294 5922 1 14 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.420 -0.062 25294 5923 1 14 . 1 1 89 89 GLU CA C 89 53.013 53.013 55.761 -2.748 25294 5924 1 14 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.422 -2.338 25294 5925 1 14 . 1 1 90 90 THR N N 90 112.516 112.516 111.591 0.925 25294 5926 1 14 . 1 1 90 90 THR HA H 90 4.534 4.534 4.602 -0.068 25294 5927 1 14 . 1 1 90 90 THR CA C 90 58.161 58.161 60.017 -1.857 25294 5928 1 14 . 1 1 90 90 THR CB C 90 68.409 68.409 72.296 -3.887 25294 5929 1 14 . 1 1 91 91 ASN N N 91 116.717 116.717 119.865 -3.148 25294 5930 1 14 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.821 -0.114 25294 5931 1 14 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.842 -4.045 25294 5932 1 14 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.222 -2.748 25294 5933 1 14 . 1 1 92 92 ALA N N 92 122.025 122.025 122.252 -0.227 25294 5934 1 14 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.586 0.050 25294 5935 1 14 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.443 -2.394 25294 5936 1 14 . 1 1 92 92 ALA CB C 92 19.716 19.716 21.105 -1.389 25294 5937 1 14 . 1 1 93 93 SER N N 93 115.895 115.895 118.311 -2.416 25294 5938 1 14 . 1 1 93 93 SER HA H 93 4.536 4.536 4.428 0.108 25294 5939 1 14 . 1 1 93 93 SER CA C 93 54.865 54.865 58.687 -3.822 25294 5940 1 14 . 1 1 93 93 SER CB C 93 61.292 61.292 64.301 -3.009 25294 5941 1 14 . 1 1 94 94 ARG N N 94 119.529 119.529 120.309 -0.780 25294 5942 1 14 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.767 0.147 25294 5943 1 14 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.781 -2.685 25294 5944 1 14 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.672 -4.160 25294 5945 1 14 . 1 1 95 95 SER N N 95 114.542 114.542 113.891 0.651 25294 5946 1 14 . 1 1 95 95 SER HA H 95 5.926 5.926 5.114 0.812 25294 5947 1 14 . 1 1 95 95 SER CA C 95 54.219 54.219 58.112 -3.893 25294 5948 1 14 . 1 1 95 95 SER CB C 95 65.271 65.271 66.467 -1.196 25294 5949 1 14 . 1 1 96 96 PHE N N 96 117.183 117.183 120.092 -2.909 25294 5950 1 14 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.101 0.237 25294 5951 1 14 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.509 -2.029 25294 5952 1 14 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.939 -5.071 25294 5953 1 14 . 1 1 97 97 THR N N 97 115.263 115.263 116.350 -1.087 25294 5954 1 14 . 1 1 97 97 THR HA H 97 5.250 5.250 5.344 -0.094 25294 5955 1 14 . 1 1 97 97 THR CA C 97 58.178 58.178 61.686 -3.508 25294 5956 1 14 . 1 1 97 97 THR CB C 97 69.068 69.068 71.868 -2.800 25294 5957 1 14 . 1 1 98 98 VAL N N 98 125.442 125.442 120.667 4.775 25294 5958 1 14 . 1 1 98 98 VAL HA H 98 4.857 4.857 5.109 -0.252 25294 5959 1 14 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.608 -3.199 25294 5960 1 14 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.369 -1.440 25294 5961 1 14 . 1 1 99 99 CYS N N 99 127.111 127.111 123.394 3.717 25294 5962 1 14 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.701 -0.355 25294 5963 1 14 . 1 1 99 99 CYS CA C 99 53.951 53.951 55.775 -1.824 25294 5964 1 14 . 1 1 99 99 CYS CB C 99 25.942 25.942 31.943 -6.001 25294 5965 1 14 . 1 1 100 100 VAL N N 100 120.146 120.146 117.773 2.373 25294 5966 1 14 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.162 0.221 25294 5967 1 14 . 1 1 100 100 VAL CA C 100 55.713 55.713 60.131 -4.418 25294 5968 1 14 . 1 1 100 100 VAL CB C 100 32.643 32.643 33.209 -0.566 25294 5969 1 14 . 1 1 101 101 GLU N N 101 118.807 118.807 126.302 -7.495 25294 5970 1 14 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.642 0.110 25294 5971 1 14 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.886 -3.451 25294 5972 1 14 . 1 1 101 101 GLU CB C 101 31.721 31.721 30.953 0.768 25294 5973 1 14 . 1 1 102 102 ALA N N 102 124.088 124.088 122.174 1.914 25294 5974 1 14 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.779 -0.922 25294 5975 1 14 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.838 -2.960 25294 5976 1 14 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.622 -1.597 25294 5977 1 14 . 1 1 103 103 GLY N N 103 111.186 111.186 109.898 1.288 25294 5978 1 14 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.559 -0.916 25294 5979 1 14 . 1 1 104 104 ASN N N 104 123.092 123.092 121.465 1.627 25294 5980 1 14 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.788 -0.116 25294 5981 1 14 . 1 1 104 104 ASN CA C 104 50.696 50.696 52.528 -1.832 25294 5982 1 14 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.013 -2.606 25294 5983 1 14 . 1 1 105 105 ALA N N 105 122.653 122.653 119.502 3.151 25294 5984 1 14 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.472 -0.041 25294 5985 1 14 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.421 -2.753 25294 5986 1 14 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.090 -2.154 25294 5987 1 14 . 1 1 106 106 PHE N N 106 116.011 116.011 114.471 1.540 25294 5988 1 14 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.503 -0.086 25294 5989 1 14 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.141 -2.583 25294 5990 1 14 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.386 -1.902 25294 5991 1 14 . 1 1 107 107 ASP N N 107 121.992 121.992 120.275 1.717 25294 5992 1 14 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.698 -0.104 25294 5993 1 14 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.437 -2.913 25294 5994 1 14 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.751 -1.660 25294 5995 1 14 . 1 1 108 108 GLU N N 108 119.354 119.354 124.521 -5.167 25294 5996 1 14 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.918 0.091 25294 5997 1 14 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.942 -2.954 25294 5998 1 14 . 1 1 108 108 GLU CB C 108 31.317 31.317 31.824 -0.507 25294 5999 1 14 . 1 1 109 109 PHE N N 109 122.098 122.098 126.217 -4.119 25294 6000 1 14 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.574 0.384 25294 6001 1 14 . 1 1 109 109 PHE CA C 109 52.787 52.787 57.354 -4.567 25294 6002 1 14 . 1 1 109 109 PHE CB C 109 40.443 40.443 40.666 -0.223 25294 6003 1 14 . 1 1 110 110 LYS N N 110 124.500 124.500 124.997 -0.497 25294 6004 1 14 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.755 -0.063 25294 6005 1 14 . 1 1 110 110 LYS CA C 110 51.891 51.891 54.359 -2.468 25294 6006 1 14 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.756 0.256 25294 6007 1 14 . 1 1 111 111 PHE N N 111 125.010 125.010 126.037 -1.027 25294 6008 1 14 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.115 -0.361 25294 6009 1 14 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.912 0.272 25294 6010 1 14 . 1 1 111 111 PHE CB C 111 38.380 38.380 41.607 -3.227 25294 6011 1 14 . 1 1 112 112 VAL N N 112 122.957 122.957 122.104 0.853 25294 6012 1 14 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.736 -0.296 25294 6013 1 14 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.252 -2.996 25294 6014 1 14 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.470 -4.377 25294 6015 1 14 . 1 1 113 113 GLN N N 113 130.864 130.864 128.669 2.195 25294 6016 1 14 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.169 0.150 25294 6017 1 14 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.589 -2.470 25294 6018 1 14 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.171 -4.007 25294 6019 1 14 . 1 1 114 114 ASP N N 114 126.272 126.272 126.049 0.223 25294 6020 1 14 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.639 -0.312 25294 6021 1 14 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.736 -3.963 25294 6022 1 14 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.132 -3.277 25294 6023 1 14 . 1 1 115 115 ALA N N 115 120.134 120.134 121.509 -1.375 25294 6024 1 14 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.331 -0.632 25294 6025 1 14 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.576 -3.675 25294 6026 1 14 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.633 -1.882 25294 6027 1 14 . 1 1 116 116 ALA N N 116 121.377 121.377 124.598 -3.221 25294 6028 1 14 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.421 -0.468 25294 6029 1 14 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.136 -1.148 25294 6030 1 14 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.642 -3.442 25294 6031 1 14 . 1 1 117 117 LYS N N 117 121.536 121.536 125.834 -4.298 25294 6032 1 14 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.295 -0.156 25294 6033 1 14 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.661 -2.015 25294 6034 1 14 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.228 -0.649 25294 6035 1 15 . 1 1 5 5 SER N N 5 116.267 116.267 118.749 -2.482 25294 6036 1 15 . 1 1 5 5 SER HA H 5 4.349 4.349 4.552 -0.203 25294 6037 1 15 . 1 1 5 5 SER CA C 5 55.478 55.478 58.952 -3.474 25294 6038 1 15 . 1 1 5 5 SER CB C 5 61.191 61.191 62.815 -1.624 25294 6039 1 15 . 1 1 6 6 ASP N N 6 123.039 123.039 120.921 2.118 25294 6040 1 15 . 1 1 6 6 ASP HA H 6 4.827 4.827 5.026 -0.199 25294 6041 1 15 . 1 1 6 6 ASP CA C 6 49.671 49.671 51.614 -1.942 25294 6042 1 15 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.032 -2.376 25294 6043 1 15 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.375 -0.058 25294 6044 1 15 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.159 -3.012 25294 6045 1 15 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.104 -2.626 25294 6046 1 15 . 1 1 8 8 ASP N N 8 119.159 119.159 119.518 -0.359 25294 6047 1 15 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.837 -0.272 25294 6048 1 15 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.249 -2.389 25294 6049 1 15 . 1 1 8 8 ASP CB C 8 38.725 38.725 40.923 -2.198 25294 6050 1 15 . 1 1 9 9 GLY N N 9 108.837 108.837 108.211 0.626 25294 6051 1 15 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.548 -2.412 25294 6052 1 15 . 1 1 10 10 LEU N N 10 121.571 121.571 118.511 3.060 25294 6053 1 15 . 1 1 10 10 LEU HA H 10 4.267 4.267 5.005 -0.738 25294 6054 1 15 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.051 -0.660 25294 6055 1 15 . 1 1 10 10 LEU CB C 10 39.863 39.863 43.617 -3.754 25294 6056 1 15 . 1 1 11 11 ALA N N 11 125.169 125.169 122.762 2.407 25294 6057 1 15 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.589 -0.253 25294 6058 1 15 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.616 -2.632 25294 6059 1 15 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.581 -2.399 25294 6060 1 15 . 1 1 12 12 ASP N N 12 122.672 122.672 124.994 -2.322 25294 6061 1 15 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.881 -0.145 25294 6062 1 15 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.004 -2.302 25294 6063 1 15 . 1 1 12 12 ASP CB C 12 37.831 37.831 42.173 -4.342 25294 6064 1 15 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.402 -0.098 25294 6065 1 15 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.810 -3.210 25294 6066 1 15 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.616 -3.100 25294 6067 1 15 . 1 1 14 14 MET N N 14 120.151 120.151 117.981 2.170 25294 6068 1 15 . 1 1 14 14 MET HA H 14 3.780 3.780 4.616 -0.836 25294 6069 1 15 . 1 1 14 14 MET CA C 14 55.822 55.822 55.958 -0.136 25294 6070 1 15 . 1 1 14 14 MET CB C 14 30.909 30.909 33.369 -2.460 25294 6071 1 15 . 1 1 15 15 LYS N N 15 123.897 123.897 121.594 2.303 25294 6072 1 15 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.811 -0.354 25294 6073 1 15 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.382 -3.974 25294 6074 1 15 . 1 1 15 15 LYS CB C 15 32.453 32.453 35.878 -3.425 25294 6075 1 15 . 1 1 16 16 TRP N N 16 125.776 125.776 125.647 0.129 25294 6076 1 15 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.382 -0.307 25294 6077 1 15 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.398 -2.746 25294 6078 1 15 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.487 -2.487 25294 6079 1 15 . 1 1 17 17 SER N N 17 120.772 120.772 119.577 1.195 25294 6080 1 15 . 1 1 17 17 SER HA H 17 4.403 4.403 4.500 -0.098 25294 6081 1 15 . 1 1 17 17 SER CA C 17 56.167 56.167 58.894 -2.727 25294 6082 1 15 . 1 1 17 17 SER CB C 17 60.833 60.833 63.123 -2.290 25294 6083 1 15 . 1 1 18 18 LYS N N 18 121.096 121.096 120.865 0.231 25294 6084 1 15 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.533 0.185 25294 6085 1 15 . 1 1 18 18 LYS CA C 18 53.735 53.735 56.366 -2.631 25294 6086 1 15 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.402 -2.485 25294 6087 1 15 . 1 1 19 19 VAL N N 19 116.358 116.358 119.747 -3.389 25294 6088 1 15 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.682 -0.259 25294 6089 1 15 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.156 -2.926 25294 6090 1 15 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.360 -3.334 25294 6091 1 15 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.637 -0.334 25294 6092 1 15 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.338 -2.568 25294 6093 1 15 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.875 -3.322 25294 6094 1 15 . 1 1 21 21 SER N N 21 118.882 118.882 119.109 -0.227 25294 6095 1 15 . 1 1 21 21 SER HA H 21 4.084 4.084 4.122 -0.038 25294 6096 1 15 . 1 1 21 21 SER CA C 21 57.657 57.657 60.681 -3.024 25294 6097 1 15 . 1 1 21 21 SER CB C 21 60.173 60.173 62.737 -2.564 25294 6098 1 15 . 1 1 22 22 GLY N N 22 109.523 109.523 109.631 -0.108 25294 6099 1 15 . 1 1 22 22 GLY CA C 22 42.404 42.404 45.258 -2.854 25294 6100 1 15 . 1 1 23 23 LEU N N 23 123.003 123.003 122.812 0.191 25294 6101 1 15 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.489 -0.455 25294 6102 1 15 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.172 -1.569 25294 6103 1 15 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.311 -2.240 25294 6104 1 15 . 1 1 24 24 LYS N N 24 129.004 129.004 126.037 2.967 25294 6105 1 15 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.442 0.068 25294 6106 1 15 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.735 -2.498 25294 6107 1 15 . 1 1 24 24 LYS CB C 24 32.161 32.161 34.183 -2.022 25294 6108 1 15 . 1 1 25 25 ASN N N 25 126.336 126.336 123.327 3.009 25294 6109 1 15 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.457 -0.133 25294 6110 1 15 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.330 -2.710 25294 6111 1 15 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.780 -2.795 25294 6112 1 15 . 1 1 26 26 GLY N N 26 103.076 103.076 101.898 1.178 25294 6113 1 15 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.030 -1.481 25294 6114 1 15 . 1 1 27 27 GLU N N 27 120.878 120.878 121.095 -0.217 25294 6115 1 15 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.051 0.151 25294 6116 1 15 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.263 -4.030 25294 6117 1 15 . 1 1 27 27 GLU CB C 27 30.761 30.761 32.214 -1.453 25294 6118 1 15 . 1 1 28 28 LEU N N 28 128.583 128.583 124.326 4.257 25294 6119 1 15 . 1 1 28 28 LEU HA H 28 4.555 4.555 5.000 -0.445 25294 6120 1 15 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.957 -3.633 25294 6121 1 15 . 1 1 28 28 LEU CB C 28 43.517 43.517 44.443 -0.926 25294 6122 1 15 . 1 1 29 29 LYS N N 29 127.554 127.554 125.783 1.771 25294 6123 1 15 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.599 0.302 25294 6124 1 15 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.452 -2.613 25294 6125 1 15 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.903 -3.380 25294 6126 1 15 . 1 1 30 30 VAL N N 30 127.915 127.915 123.998 3.917 25294 6127 1 15 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.512 -0.328 25294 6128 1 15 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.112 -1.804 25294 6129 1 15 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.700 -3.430 25294 6130 1 15 . 1 1 31 31 GLU N N 31 125.151 125.151 124.743 0.408 25294 6131 1 15 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.457 -0.096 25294 6132 1 15 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.940 -1.840 25294 6133 1 15 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.779 -3.076 25294 6134 1 15 . 1 1 32 32 ALA N N 32 126.271 126.271 120.457 5.814 25294 6135 1 15 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.228 -0.212 25294 6136 1 15 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.297 -1.170 25294 6137 1 15 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.324 -3.058 25294 6138 1 15 . 1 1 33 33 GLU N N 33 113.076 113.076 116.938 -3.862 25294 6139 1 15 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.257 -0.292 25294 6140 1 15 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.719 -0.734 25294 6141 1 15 . 1 1 33 33 GLU CB C 33 26.929 26.929 29.531 -2.602 25294 6142 1 15 . 1 1 34 34 GLY N N 34 104.905 104.905 108.993 -4.088 25294 6143 1 15 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.372 -4.665 25294 6144 1 15 . 1 1 35 35 GLY N N 35 105.946 105.946 108.000 -2.054 25294 6145 1 15 . 1 1 35 35 GLY CA C 35 42.988 42.988 43.726 -0.738 25294 6146 1 15 . 1 1 36 36 SER N N 36 116.044 116.044 114.736 1.308 25294 6147 1 15 . 1 1 36 36 SER HA H 36 5.539 5.539 5.526 0.013 25294 6148 1 15 . 1 1 36 36 SER CA C 36 54.323 54.323 56.916 -2.593 25294 6149 1 15 . 1 1 36 36 SER CB C 36 62.808 62.808 65.631 -2.823 25294 6150 1 15 . 1 1 37 37 SER N N 37 119.501 119.501 115.215 4.286 25294 6151 1 15 . 1 1 37 37 SER HA H 37 4.712 4.712 4.747 -0.035 25294 6152 1 15 . 1 1 37 37 SER CA C 37 55.548 55.548 57.834 -2.286 25294 6153 1 15 . 1 1 37 37 SER CB C 37 63.943 63.943 65.924 -1.981 25294 6154 1 15 . 1 1 38 38 LEU N N 38 125.962 125.962 122.438 3.524 25294 6155 1 15 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.040 0.213 25294 6156 1 15 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.374 -2.592 25294 6157 1 15 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.618 -2.784 25294 6158 1 15 . 1 1 39 39 PHE N N 39 124.707 124.707 124.644 0.063 25294 6159 1 15 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.320 -0.181 25294 6160 1 15 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.825 -3.694 25294 6161 1 15 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.148 -1.196 25294 6162 1 15 . 1 1 40 40 ALA N N 40 124.994 124.994 127.466 -2.472 25294 6163 1 15 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.173 0.462 25294 6164 1 15 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.190 -1.889 25294 6165 1 15 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.227 0.219 25294 6166 1 15 . 1 1 41 41 CYS N N 41 125.757 125.757 124.563 1.194 25294 6167 1 15 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.235 -0.089 25294 6168 1 15 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.984 -3.519 25294 6169 1 15 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.732 -1.759 25294 6170 1 15 . 1 1 42 42 LYS N N 42 129.019 129.019 127.171 1.848 25294 6171 1 15 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.274 -0.013 25294 6172 1 15 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.909 -3.058 25294 6173 1 15 . 1 1 42 42 LYS CB C 42 32.107 32.107 33.040 -0.933 25294 6174 1 15 . 1 1 43 43 ASN N N 43 113.240 113.240 114.558 -1.318 25294 6175 1 15 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.632 -0.107 25294 6176 1 15 . 1 1 43 43 ASN CA C 43 50.235 50.235 52.663 -2.428 25294 6177 1 15 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.081 -4.220 25294 6178 1 15 . 1 1 44 44 TYR N N 44 119.335 119.335 118.266 1.069 25294 6179 1 15 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.499 0.058 25294 6180 1 15 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.960 -2.242 25294 6181 1 15 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.866 -4.494 25294 6182 1 15 . 1 1 45 45 LYS N N 45 120.676 120.676 120.957 -0.281 25294 6183 1 15 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.627 -0.591 25294 6184 1 15 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.111 -1.573 25294 6185 1 15 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.898 -3.666 25294 6186 1 15 . 1 1 46 46 SER N N 46 108.797 108.797 114.758 -5.961 25294 6187 1 15 . 1 1 46 46 SER HA H 46 4.388 4.388 4.850 -0.462 25294 6188 1 15 . 1 1 46 46 SER CA C 46 53.664 53.664 57.269 -3.605 25294 6189 1 15 . 1 1 46 46 SER CB C 46 61.810 61.810 63.394 -1.584 25294 6190 1 15 . 1 1 47 47 PHE N N 47 117.325 117.325 120.516 -3.191 25294 6191 1 15 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.298 -0.656 25294 6192 1 15 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.999 -3.382 25294 6193 1 15 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.123 -5.022 25294 6194 1 15 . 1 1 48 48 TRP N N 48 117.090 117.090 117.069 0.021 25294 6195 1 15 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.296 -0.061 25294 6196 1 15 . 1 1 48 48 TRP CA C 48 53.492 53.492 54.928 -1.436 25294 6197 1 15 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.404 -1.508 25294 6198 1 15 . 1 1 49 49 ILE N N 49 119.682 119.682 120.640 -0.958 25294 6199 1 15 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.146 -0.115 25294 6200 1 15 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.932 -1.459 25294 6201 1 15 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.280 0.156 25294 6202 1 15 . 1 1 50 50 SER N N 50 124.071 124.071 122.979 1.092 25294 6203 1 15 . 1 1 50 50 SER HA H 50 4.708 4.708 4.837 -0.129 25294 6204 1 15 . 1 1 50 50 SER CA C 50 56.110 56.110 58.211 -2.101 25294 6205 1 15 . 1 1 50 50 SER CB C 50 63.816 63.816 64.417 -0.601 25294 6206 1 15 . 1 1 51 51 SER N N 51 111.253 111.253 114.985 -3.732 25294 6207 1 15 . 1 1 51 51 SER HA H 51 4.557 4.557 4.664 -0.107 25294 6208 1 15 . 1 1 51 51 SER CA C 51 55.564 55.564 57.344 -1.780 25294 6209 1 15 . 1 1 51 51 SER CB C 51 62.821 62.821 66.394 -3.573 25294 6210 1 15 . 1 1 52 52 VAL N N 52 121.147 121.147 120.817 0.330 25294 6211 1 15 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.868 -0.137 25294 6212 1 15 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.617 -0.491 25294 6213 1 15 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.331 -2.831 25294 6214 1 15 . 1 1 53 53 LYS N N 53 126.128 126.128 123.042 3.086 25294 6215 1 15 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.762 0.245 25294 6216 1 15 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.596 -2.873 25294 6217 1 15 . 1 1 53 53 LYS CB C 53 33.772 33.772 36.020 -2.248 25294 6218 1 15 . 1 1 54 54 GLU N N 54 124.160 124.160 118.896 5.264 25294 6219 1 15 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.579 1.179 25294 6220 1 15 . 1 1 54 54 GLU CA C 54 53.259 53.259 56.219 -2.960 25294 6221 1 15 . 1 1 54 54 GLU CB C 54 31.059 31.059 30.859 0.200 25294 6222 1 15 . 1 1 55 55 GLU N N 55 127.218 127.218 118.634 8.584 25294 6223 1 15 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.479 -0.571 25294 6224 1 15 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.527 -1.981 25294 6225 1 15 . 1 1 55 55 GLU CB C 55 25.294 25.294 32.030 -6.736 25294 6226 1 15 . 1 1 56 56 GLY N N 56 104.894 104.894 107.951 -3.057 25294 6227 1 15 . 1 1 56 56 GLY CA C 56 42.881 42.881 45.429 -2.548 25294 6228 1 15 . 1 1 57 57 LYS N N 57 120.444 120.444 118.328 2.116 25294 6229 1 15 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.788 -0.224 25294 6230 1 15 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.321 -2.361 25294 6231 1 15 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.111 -1.923 25294 6232 1 15 . 1 1 58 58 PHE N N 58 121.824 121.824 119.851 1.973 25294 6233 1 15 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.046 -0.275 25294 6234 1 15 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.807 -0.642 25294 6235 1 15 . 1 1 58 58 PHE CB C 58 36.902 36.902 39.983 -3.081 25294 6236 1 15 . 1 1 59 59 LYS N N 59 123.205 123.205 121.795 1.410 25294 6237 1 15 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.719 -0.268 25294 6238 1 15 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.772 -3.787 25294 6239 1 15 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.028 -4.237 25294 6240 1 15 . 1 1 60 60 GLU N N 60 122.647 122.647 120.129 2.518 25294 6241 1 15 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.386 -0.126 25294 6242 1 15 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.370 -2.465 25294 6243 1 15 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.692 -3.029 25294 6244 1 15 . 1 1 61 61 ASN N N 61 119.907 119.907 118.395 1.512 25294 6245 1 15 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.830 0.015 25294 6246 1 15 . 1 1 61 61 ASN CA C 61 50.752 50.752 52.928 -2.176 25294 6247 1 15 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.853 -3.830 25294 6248 1 15 . 1 1 62 62 THR N N 62 113.271 113.271 114.635 -1.364 25294 6249 1 15 . 1 1 62 62 THR HA H 62 4.308 4.308 4.466 -0.158 25294 6250 1 15 . 1 1 62 62 THR CA C 62 59.310 59.310 62.376 -3.066 25294 6251 1 15 . 1 1 62 62 THR CB C 62 66.813 66.813 69.802 -2.989 25294 6252 1 15 . 1 1 63 63 SER N N 63 116.521 116.521 114.942 1.579 25294 6253 1 15 . 1 1 63 63 SER HA H 63 4.650 4.650 4.471 0.179 25294 6254 1 15 . 1 1 63 63 SER CA C 63 54.094 54.094 57.938 -3.844 25294 6255 1 15 . 1 1 63 63 SER CB C 63 61.617 61.617 64.106 -2.489 25294 6256 1 15 . 1 1 64 64 TYR N N 64 120.183 120.183 121.159 -0.976 25294 6257 1 15 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.739 0.099 25294 6258 1 15 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.596 -2.193 25294 6259 1 15 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.216 -2.647 25294 6260 1 15 . 1 1 65 65 LYS N N 65 115.195 115.195 113.345 1.850 25294 6261 1 15 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.709 0.012 25294 6262 1 15 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.421 -3.715 25294 6263 1 15 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.673 -2.853 25294 6264 1 15 . 1 1 66 66 GLU N N 66 117.231 117.231 120.156 -2.925 25294 6265 1 15 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.018 0.195 25294 6266 1 15 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.368 -2.756 25294 6267 1 15 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.658 -2.865 25294 6268 1 15 . 1 1 67 67 PHE N N 67 121.532 121.532 123.465 -1.933 25294 6269 1 15 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.826 -0.396 25294 6270 1 15 . 1 1 67 67 PHE CA C 67 56.269 56.269 56.905 -0.636 25294 6271 1 15 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.152 -1.877 25294 6272 1 15 . 1 1 68 68 ASP N N 68 128.157 128.157 127.376 0.781 25294 6273 1 15 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.532 -0.104 25294 6274 1 15 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.879 -3.323 25294 6275 1 15 . 1 1 68 68 ASP CB C 68 38.424 38.424 39.572 -1.148 25294 6276 1 15 . 1 1 69 69 GLY N N 69 114.151 114.151 109.398 4.753 25294 6277 1 15 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.143 -3.244 25294 6278 1 15 . 1 1 70 70 GLY N N 70 113.714 113.714 109.892 3.822 25294 6279 1 15 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.247 -1.253 25294 6280 1 15 . 1 1 71 71 TRP N N 71 117.823 117.823 120.041 -2.218 25294 6281 1 15 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.888 -0.080 25294 6282 1 15 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.065 -3.288 25294 6283 1 15 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.187 -4.542 25294 6284 1 15 . 1 1 72 72 TYR N N 72 114.204 114.204 119.963 -5.759 25294 6285 1 15 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.916 0.209 25294 6286 1 15 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.921 -5.486 25294 6287 1 15 . 1 1 72 72 TYR CB C 72 38.620 38.620 41.035 -2.414 25294 6288 1 15 . 1 1 73 73 LEU N N 73 121.469 121.469 124.727 -3.258 25294 6289 1 15 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.063 -0.296 25294 6290 1 15 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.287 -1.955 25294 6291 1 15 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.959 -3.556 25294 6292 1 15 . 1 1 74 74 VAL N N 74 124.558 124.558 125.236 -0.678 25294 6293 1 15 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.747 0.036 25294 6294 1 15 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.826 -3.014 25294 6295 1 15 . 1 1 74 74 VAL CB C 74 31.820 31.820 35.140 -3.320 25294 6296 1 15 . 1 1 75 75 LYS N N 75 125.824 125.824 125.336 0.488 25294 6297 1 15 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.179 -0.069 25294 6298 1 15 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.535 -2.732 25294 6299 1 15 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.172 -2.597 25294 6300 1 15 . 1 1 76 76 ILE N N 76 124.647 124.647 124.938 -0.291 25294 6301 1 15 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.510 0.568 25294 6302 1 15 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.629 -3.261 25294 6303 1 15 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.311 -1.718 25294 6304 1 15 . 1 1 77 77 GLU N N 77 128.081 128.081 128.680 -0.599 25294 6305 1 15 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.571 -0.127 25294 6306 1 15 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.269 -2.798 25294 6307 1 15 . 1 1 77 77 GLU CB C 77 29.914 29.914 30.516 -0.602 25294 6308 1 15 . 1 1 78 78 ASP N N 78 126.158 126.158 124.080 2.078 25294 6309 1 15 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.107 -0.007 25294 6310 1 15 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.787 -3.724 25294 6311 1 15 . 1 1 78 78 ASP CB C 78 36.738 36.738 39.839 -3.101 25294 6312 1 15 . 1 1 79 79 ASN N N 79 118.653 118.653 117.554 1.099 25294 6313 1 15 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.845 -0.199 25294 6314 1 15 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.430 -2.221 25294 6315 1 15 . 1 1 79 79 ASN CB C 79 35.350 35.350 41.045 -5.695 25294 6316 1 15 . 1 1 80 80 GLU N N 80 120.378 120.378 122.754 -2.376 25294 6317 1 15 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.086 0.423 25294 6318 1 15 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.418 -2.558 25294 6319 1 15 . 1 1 80 80 GLU CB C 80 29.673 29.673 29.784 -0.111 25294 6320 1 15 . 1 1 81 81 LEU N N 81 125.771 125.771 128.408 -2.637 25294 6321 1 15 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.071 -0.105 25294 6322 1 15 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.782 -3.768 25294 6323 1 15 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.387 -0.837 25294 6324 1 15 . 1 1 82 82 LYS N N 82 128.076 128.076 126.618 1.458 25294 6325 1 15 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.484 -0.239 25294 6326 1 15 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.907 -2.575 25294 6327 1 15 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.241 -4.062 25294 6328 1 15 . 1 1 83 83 VAL N N 83 124.216 124.216 116.725 7.491 25294 6329 1 15 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.082 -0.174 25294 6330 1 15 . 1 1 83 83 VAL CA C 83 58.380 58.380 58.644 -0.264 25294 6331 1 15 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.202 -3.034 25294 6332 1 15 . 1 1 84 84 ILE N N 84 129.084 129.084 121.920 7.164 25294 6333 1 15 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.644 -0.114 25294 6334 1 15 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.976 -1.570 25294 6335 1 15 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.036 -2.870 25294 6336 1 15 . 1 1 85 85 ILE N N 85 127.360 127.360 126.735 0.625 25294 6337 1 15 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.527 0.058 25294 6338 1 15 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.692 -1.232 25294 6339 1 15 . 1 1 85 85 ILE CB C 85 38.498 38.498 39.747 -1.249 25294 6340 1 15 . 1 1 86 86 ASN N N 86 128.337 128.337 122.082 6.255 25294 6341 1 15 . 1 1 86 86 ASN HA H 86 4.766 4.766 5.115 -0.349 25294 6342 1 15 . 1 1 86 86 ASN CA C 86 50.182 50.182 51.639 -1.456 25294 6343 1 15 . 1 1 86 86 ASN CB C 86 36.891 36.891 41.244 -4.353 25294 6344 1 15 . 1 1 87 87 ARG N N 87 119.368 119.368 120.255 -0.887 25294 6345 1 15 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.340 -0.349 25294 6346 1 15 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.292 -2.094 25294 6347 1 15 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.380 -1.977 25294 6348 1 15 . 1 1 88 88 ASN N N 88 125.082 125.082 125.446 -0.364 25294 6349 1 15 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.483 0.242 25294 6350 1 15 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.335 -4.232 25294 6351 1 15 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.502 -3.744 25294 6352 1 15 . 1 1 89 89 GLU N N 89 125.309 125.309 122.782 2.527 25294 6353 1 15 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.206 0.152 25294 6354 1 15 . 1 1 89 89 GLU CA C 89 53.013 53.013 57.264 -4.251 25294 6355 1 15 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.568 -2.484 25294 6356 1 15 . 1 1 90 90 THR N N 90 112.516 112.516 111.197 1.319 25294 6357 1 15 . 1 1 90 90 THR HA H 90 4.534 4.534 4.562 -0.028 25294 6358 1 15 . 1 1 90 90 THR CA C 90 58.161 58.161 59.430 -1.269 25294 6359 1 15 . 1 1 90 90 THR CB C 90 68.409 68.409 71.829 -3.420 25294 6360 1 15 . 1 1 91 91 ASN N N 91 116.717 116.717 119.144 -2.427 25294 6361 1 15 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.999 -0.292 25294 6362 1 15 . 1 1 91 91 ASN CA C 91 49.796 49.796 52.998 -3.202 25294 6363 1 15 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.194 -2.720 25294 6364 1 15 . 1 1 92 92 ALA N N 92 122.025 122.025 123.062 -1.037 25294 6365 1 15 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.682 -0.046 25294 6366 1 15 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.749 -2.700 25294 6367 1 15 . 1 1 92 92 ALA CB C 92 19.716 19.716 21.424 -1.708 25294 6368 1 15 . 1 1 93 93 SER N N 93 115.895 115.895 118.524 -2.629 25294 6369 1 15 . 1 1 93 93 SER HA H 93 4.536 4.536 4.413 0.123 25294 6370 1 15 . 1 1 93 93 SER CA C 93 54.865 54.865 58.756 -3.891 25294 6371 1 15 . 1 1 93 93 SER CB C 93 61.292 61.292 64.048 -2.756 25294 6372 1 15 . 1 1 94 94 ARG N N 94 119.529 119.529 118.439 1.090 25294 6373 1 15 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.772 0.142 25294 6374 1 15 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.468 -2.372 25294 6375 1 15 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.302 -3.790 25294 6376 1 15 . 1 1 95 95 SER N N 95 114.542 114.542 114.120 0.422 25294 6377 1 15 . 1 1 95 95 SER HA H 95 5.926 5.926 5.148 0.778 25294 6378 1 15 . 1 1 95 95 SER CA C 95 54.219 54.219 56.973 -2.754 25294 6379 1 15 . 1 1 95 95 SER CB C 95 65.271 65.271 66.077 -0.806 25294 6380 1 15 . 1 1 96 96 PHE N N 96 117.183 117.183 120.497 -3.314 25294 6381 1 15 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.042 0.296 25294 6382 1 15 . 1 1 96 96 PHE CA C 96 54.480 54.480 57.383 -2.903 25294 6383 1 15 . 1 1 96 96 PHE CB C 96 38.868 38.868 41.705 -2.837 25294 6384 1 15 . 1 1 97 97 THR N N 97 115.263 115.263 116.027 -0.764 25294 6385 1 15 . 1 1 97 97 THR HA H 97 5.250 5.250 5.290 -0.040 25294 6386 1 15 . 1 1 97 97 THR CA C 97 58.178 58.178 61.484 -3.306 25294 6387 1 15 . 1 1 97 97 THR CB C 97 69.068 69.068 72.251 -3.183 25294 6388 1 15 . 1 1 98 98 VAL N N 98 125.442 125.442 123.254 2.188 25294 6389 1 15 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.616 0.241 25294 6390 1 15 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.782 -3.373 25294 6391 1 15 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.821 -1.892 25294 6392 1 15 . 1 1 99 99 CYS N N 99 127.111 127.111 125.469 1.642 25294 6393 1 15 . 1 1 99 99 CYS HA H 99 5.346 5.346 4.607 0.739 25294 6394 1 15 . 1 1 99 99 CYS CA C 99 53.951 53.951 57.630 -3.679 25294 6395 1 15 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.116 -4.174 25294 6396 1 15 . 1 1 100 100 VAL N N 100 120.146 120.146 118.950 1.196 25294 6397 1 15 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.236 0.147 25294 6398 1 15 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.123 -3.410 25294 6399 1 15 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.966 -3.323 25294 6400 1 15 . 1 1 101 101 GLU N N 101 118.807 118.807 118.821 -0.014 25294 6401 1 15 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.767 -0.015 25294 6402 1 15 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.786 -2.352 25294 6403 1 15 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.183 -1.462 25294 6404 1 15 . 1 1 102 102 ALA N N 102 124.088 124.088 123.807 0.281 25294 6405 1 15 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.746 -0.889 25294 6406 1 15 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.617 -2.739 25294 6407 1 15 . 1 1 102 102 ALA CB C 102 18.025 18.025 18.840 -0.815 25294 6408 1 15 . 1 1 103 103 GLY N N 103 111.186 111.186 111.836 -0.650 25294 6409 1 15 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.681 -2.038 25294 6410 1 15 . 1 1 104 104 ASN N N 104 123.092 123.092 120.592 2.500 25294 6411 1 15 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.738 -0.066 25294 6412 1 15 . 1 1 104 104 ASN CA C 104 50.696 50.696 52.697 -2.001 25294 6413 1 15 . 1 1 104 104 ASN CB C 104 36.407 36.407 40.542 -4.136 25294 6414 1 15 . 1 1 105 105 ALA N N 105 122.653 122.653 119.997 2.656 25294 6415 1 15 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.366 0.065 25294 6416 1 15 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.512 -2.844 25294 6417 1 15 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.994 -2.058 25294 6418 1 15 . 1 1 106 106 PHE N N 106 116.011 116.011 116.885 -0.874 25294 6419 1 15 . 1 1 106 106 PHE HA H 106 5.417 5.417 4.911 0.506 25294 6420 1 15 . 1 1 106 106 PHE CA C 106 53.558 53.558 57.298 -3.740 25294 6421 1 15 . 1 1 106 106 PHE CB C 106 40.484 40.484 43.595 -3.111 25294 6422 1 15 . 1 1 107 107 ASP N N 107 121.992 121.992 121.455 0.537 25294 6423 1 15 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.772 -0.178 25294 6424 1 15 . 1 1 107 107 ASP CA C 107 50.524 50.524 54.255 -3.731 25294 6425 1 15 . 1 1 107 107 ASP CB C 107 43.091 43.091 43.835 -0.744 25294 6426 1 15 . 1 1 108 108 GLU N N 108 119.354 119.354 120.418 -1.064 25294 6427 1 15 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.173 0.836 25294 6428 1 15 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.486 -2.498 25294 6429 1 15 . 1 1 108 108 GLU CB C 108 31.317 31.317 31.861 -0.544 25294 6430 1 15 . 1 1 109 109 PHE N N 109 122.098 122.098 120.126 1.972 25294 6431 1 15 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.735 0.223 25294 6432 1 15 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.176 -3.389 25294 6433 1 15 . 1 1 109 109 PHE CB C 109 40.443 40.443 42.181 -1.738 25294 6434 1 15 . 1 1 110 110 LYS N N 110 124.500 124.500 123.680 0.820 25294 6435 1 15 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.889 -0.197 25294 6436 1 15 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.115 -3.224 25294 6437 1 15 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.748 0.264 25294 6438 1 15 . 1 1 111 111 PHE N N 111 125.010 125.010 124.261 0.749 25294 6439 1 15 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.013 -0.259 25294 6440 1 15 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.430 0.754 25294 6441 1 15 . 1 1 111 111 PHE CB C 111 38.380 38.380 39.967 -1.587 25294 6442 1 15 . 1 1 112 112 VAL N N 112 122.957 122.957 118.451 4.506 25294 6443 1 15 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.859 -0.419 25294 6444 1 15 . 1 1 112 112 VAL CA C 112 58.256 58.256 59.671 -1.415 25294 6445 1 15 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.351 -4.258 25294 6446 1 15 . 1 1 113 113 GLN N N 113 130.864 130.864 124.115 6.749 25294 6447 1 15 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.192 0.127 25294 6448 1 15 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.697 -2.579 25294 6449 1 15 . 1 1 113 113 GLN CB C 113 28.164 28.164 33.357 -5.193 25294 6450 1 15 . 1 1 114 114 ASP N N 114 126.272 126.272 124.158 2.114 25294 6451 1 15 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.735 -0.408 25294 6452 1 15 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.043 -2.270 25294 6453 1 15 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.599 -3.744 25294 6454 1 15 . 1 1 115 115 ALA N N 115 120.134 120.134 121.146 -1.012 25294 6455 1 15 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.343 -0.644 25294 6456 1 15 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.048 -3.147 25294 6457 1 15 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.952 -2.201 25294 6458 1 15 . 1 1 116 116 ALA N N 116 121.377 121.377 123.729 -2.352 25294 6459 1 15 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.353 -0.400 25294 6460 1 15 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.869 -1.881 25294 6461 1 15 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.479 -3.279 25294 6462 1 15 . 1 1 117 117 LYS N N 117 121.536 121.536 125.395 -3.859 25294 6463 1 15 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.373 -0.234 25294 6464 1 15 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.418 -1.772 25294 6465 1 15 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.202 -0.623 25294 6466 1 16 . 1 1 5 5 SER N N 5 116.267 116.267 119.030 -2.763 25294 6467 1 16 . 1 1 5 5 SER HA H 5 4.349 4.349 4.622 -0.273 25294 6468 1 16 . 1 1 5 5 SER CA C 5 55.478 55.478 57.666 -2.188 25294 6469 1 16 . 1 1 5 5 SER CB C 5 61.191 61.191 64.565 -3.374 25294 6470 1 16 . 1 1 6 6 ASP N N 6 123.039 123.039 122.007 1.032 25294 6471 1 16 . 1 1 6 6 ASP HA H 6 4.827 4.827 5.026 -0.199 25294 6472 1 16 . 1 1 6 6 ASP CA C 6 49.671 49.671 51.624 -1.953 25294 6473 1 16 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.265 -2.609 25294 6474 1 16 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.477 -0.160 25294 6475 1 16 . 1 1 7 7 PRO CA C 7 61.147 61.147 63.811 -2.664 25294 6476 1 16 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.018 -2.540 25294 6477 1 16 . 1 1 8 8 ASP N N 8 119.159 119.159 118.727 0.432 25294 6478 1 16 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.701 -0.136 25294 6479 1 16 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.350 -2.490 25294 6480 1 16 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.309 -2.584 25294 6481 1 16 . 1 1 9 9 GLY N N 9 108.837 108.837 110.136 -1.299 25294 6482 1 16 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.034 -1.898 25294 6483 1 16 . 1 1 10 10 LEU N N 10 121.571 121.571 118.723 2.848 25294 6484 1 16 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.942 -0.675 25294 6485 1 16 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.712 -1.321 25294 6486 1 16 . 1 1 10 10 LEU CB C 10 39.863 39.863 43.986 -4.123 25294 6487 1 16 . 1 1 11 11 ALA N N 11 125.169 125.169 122.111 3.058 25294 6488 1 16 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.601 -0.266 25294 6489 1 16 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.364 -2.381 25294 6490 1 16 . 1 1 11 11 ALA CB C 11 17.182 17.182 20.230 -3.048 25294 6491 1 16 . 1 1 12 12 ASP N N 12 122.672 122.672 120.430 2.242 25294 6492 1 16 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.012 -0.276 25294 6493 1 16 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.829 -2.127 25294 6494 1 16 . 1 1 12 12 ASP CB C 12 37.831 37.831 43.205 -5.374 25294 6495 1 16 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.413 -0.109 25294 6496 1 16 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.693 -3.093 25294 6497 1 16 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.660 -3.144 25294 6498 1 16 . 1 1 14 14 MET N N 14 120.151 120.151 120.231 -0.080 25294 6499 1 16 . 1 1 14 14 MET HA H 14 3.780 3.780 4.449 -0.669 25294 6500 1 16 . 1 1 14 14 MET CA C 14 55.822 55.822 56.121 -0.299 25294 6501 1 16 . 1 1 14 14 MET CB C 14 30.909 30.909 32.682 -1.774 25294 6502 1 16 . 1 1 15 15 LYS N N 15 123.897 123.897 124.575 -0.678 25294 6503 1 16 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.537 -0.080 25294 6504 1 16 . 1 1 15 15 LYS CA C 15 51.407 51.407 54.976 -3.569 25294 6505 1 16 . 1 1 15 15 LYS CB C 15 32.453 32.453 33.178 -0.725 25294 6506 1 16 . 1 1 16 16 TRP N N 16 125.776 125.776 126.229 -0.453 25294 6507 1 16 . 1 1 16 16 TRP HA H 16 5.075 5.075 4.838 0.237 25294 6508 1 16 . 1 1 16 16 TRP CA C 16 53.652 53.652 57.538 -3.886 25294 6509 1 16 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.333 -2.333 25294 6510 1 16 . 1 1 17 17 SER N N 17 120.772 120.772 115.564 5.208 25294 6511 1 16 . 1 1 17 17 SER HA H 17 4.403 4.403 4.702 -0.299 25294 6512 1 16 . 1 1 17 17 SER CA C 17 56.167 56.167 58.010 -1.843 25294 6513 1 16 . 1 1 17 17 SER CB C 17 60.833 60.833 63.637 -2.804 25294 6514 1 16 . 1 1 18 18 LYS N N 18 121.096 121.096 120.808 0.288 25294 6515 1 16 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.523 0.195 25294 6516 1 16 . 1 1 18 18 LYS CA C 18 53.735 53.735 56.932 -3.197 25294 6517 1 16 . 1 1 18 18 LYS CB C 18 32.917 32.917 34.450 -1.532 25294 6518 1 16 . 1 1 19 19 VAL N N 19 116.358 116.358 119.248 -2.890 25294 6519 1 16 . 1 1 19 19 VAL HA H 19 4.423 4.423 5.100 -0.677 25294 6520 1 16 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.370 -3.140 25294 6521 1 16 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.599 -3.573 25294 6522 1 16 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.461 -0.158 25294 6523 1 16 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.631 -2.861 25294 6524 1 16 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.477 -2.924 25294 6525 1 16 . 1 1 21 21 SER N N 21 118.882 118.882 114.139 4.743 25294 6526 1 16 . 1 1 21 21 SER HA H 21 4.084 4.084 4.554 -0.470 25294 6527 1 16 . 1 1 21 21 SER CA C 21 57.657 57.657 58.974 -1.317 25294 6528 1 16 . 1 1 21 21 SER CB C 21 60.173 60.173 63.732 -3.559 25294 6529 1 16 . 1 1 22 22 GLY N N 22 109.523 109.523 111.564 -2.041 25294 6530 1 16 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.839 -2.435 25294 6531 1 16 . 1 1 23 23 LEU N N 23 123.003 123.003 121.786 1.217 25294 6532 1 16 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.280 -0.246 25294 6533 1 16 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.617 -2.014 25294 6534 1 16 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.552 -2.481 25294 6535 1 16 . 1 1 24 24 LYS N N 24 129.004 129.004 127.747 1.257 25294 6536 1 16 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.485 0.025 25294 6537 1 16 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.201 -1.964 25294 6538 1 16 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.431 -1.270 25294 6539 1 16 . 1 1 25 25 ASN N N 25 126.336 126.336 122.968 3.368 25294 6540 1 16 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.441 -0.117 25294 6541 1 16 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.016 -2.396 25294 6542 1 16 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.118 -3.133 25294 6543 1 16 . 1 1 26 26 GLY N N 26 103.076 103.076 101.954 1.122 25294 6544 1 16 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.846 -1.297 25294 6545 1 16 . 1 1 27 27 GLU N N 27 120.878 120.878 123.051 -2.173 25294 6546 1 16 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.618 0.584 25294 6547 1 16 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.814 -4.581 25294 6548 1 16 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.221 -0.460 25294 6549 1 16 . 1 1 28 28 LEU N N 28 128.583 128.583 126.168 2.415 25294 6550 1 16 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.706 -0.151 25294 6551 1 16 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.658 -3.334 25294 6552 1 16 . 1 1 28 28 LEU CB C 28 43.517 43.517 45.562 -2.045 25294 6553 1 16 . 1 1 29 29 LYS N N 29 127.554 127.554 121.032 6.522 25294 6554 1 16 . 1 1 29 29 LYS HA H 29 4.901 4.901 5.405 -0.504 25294 6555 1 16 . 1 1 29 29 LYS CA C 29 52.839 52.839 54.718 -1.879 25294 6556 1 16 . 1 1 29 29 LYS CB C 29 29.523 29.523 36.129 -6.606 25294 6557 1 16 . 1 1 30 30 VAL N N 30 127.915 127.915 116.949 10.966 25294 6558 1 16 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.693 -0.509 25294 6559 1 16 . 1 1 30 30 VAL CA C 30 58.308 58.308 59.697 -1.389 25294 6560 1 16 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.653 -3.383 25294 6561 1 16 . 1 1 31 31 GLU N N 31 125.151 125.151 121.470 3.681 25294 6562 1 16 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.674 -0.313 25294 6563 1 16 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.040 -0.940 25294 6564 1 16 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.884 -3.181 25294 6565 1 16 . 1 1 32 32 ALA N N 32 126.271 126.271 119.866 6.405 25294 6566 1 16 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.346 -0.330 25294 6567 1 16 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.026 -0.899 25294 6568 1 16 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.309 -3.043 25294 6569 1 16 . 1 1 33 33 GLU N N 33 113.076 113.076 116.383 -3.307 25294 6570 1 16 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.330 -0.365 25294 6571 1 16 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.672 -0.688 25294 6572 1 16 . 1 1 33 33 GLU CB C 33 26.929 26.929 29.863 -2.934 25294 6573 1 16 . 1 1 34 34 GLY N N 34 104.905 104.905 108.051 -3.146 25294 6574 1 16 . 1 1 34 34 GLY CA C 34 40.707 40.707 44.942 -4.235 25294 6575 1 16 . 1 1 35 35 GLY N N 35 105.946 105.946 105.650 0.296 25294 6576 1 16 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.380 -1.391 25294 6577 1 16 . 1 1 36 36 SER N N 36 116.044 116.044 114.680 1.364 25294 6578 1 16 . 1 1 36 36 SER HA H 36 5.539 5.539 5.479 0.060 25294 6579 1 16 . 1 1 36 36 SER CA C 36 54.323 54.323 57.158 -2.835 25294 6580 1 16 . 1 1 36 36 SER CB C 36 62.808 62.808 65.911 -3.103 25294 6581 1 16 . 1 1 37 37 SER N N 37 119.501 119.501 114.835 4.666 25294 6582 1 16 . 1 1 37 37 SER HA H 37 4.712 4.712 4.620 0.092 25294 6583 1 16 . 1 1 37 37 SER CA C 37 55.548 55.548 57.307 -1.759 25294 6584 1 16 . 1 1 37 37 SER CB C 37 63.943 63.943 66.186 -2.243 25294 6585 1 16 . 1 1 38 38 LEU N N 38 125.962 125.962 121.013 4.949 25294 6586 1 16 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.895 0.358 25294 6587 1 16 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.778 -2.996 25294 6588 1 16 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.834 -3.000 25294 6589 1 16 . 1 1 39 39 PHE N N 39 124.707 124.707 124.006 0.701 25294 6590 1 16 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.315 -0.176 25294 6591 1 16 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.624 -3.493 25294 6592 1 16 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.228 -1.276 25294 6593 1 16 . 1 1 40 40 ALA N N 40 124.994 124.994 126.519 -1.525 25294 6594 1 16 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.057 0.578 25294 6595 1 16 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.434 -2.133 25294 6596 1 16 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.050 0.396 25294 6597 1 16 . 1 1 41 41 CYS N N 41 125.757 125.757 125.066 0.691 25294 6598 1 16 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.241 -0.095 25294 6599 1 16 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.502 -3.037 25294 6600 1 16 . 1 1 41 41 CYS CB C 41 25.973 25.973 28.115 -2.142 25294 6601 1 16 . 1 1 42 42 LYS N N 42 129.019 129.019 127.355 1.664 25294 6602 1 16 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.109 0.151 25294 6603 1 16 . 1 1 42 42 LYS CA C 42 54.851 54.851 58.397 -3.546 25294 6604 1 16 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.550 -0.443 25294 6605 1 16 . 1 1 43 43 ASN N N 43 113.240 113.240 114.977 -1.737 25294 6606 1 16 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.628 -0.103 25294 6607 1 16 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.114 -2.879 25294 6608 1 16 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.241 -4.380 25294 6609 1 16 . 1 1 44 44 TYR N N 44 119.335 119.335 118.606 0.729 25294 6610 1 16 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.542 0.015 25294 6611 1 16 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.055 -2.337 25294 6612 1 16 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.988 -4.616 25294 6613 1 16 . 1 1 45 45 LYS N N 45 120.676 120.676 120.673 0.003 25294 6614 1 16 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.733 -0.697 25294 6615 1 16 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.216 -1.678 25294 6616 1 16 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.828 -3.595 25294 6617 1 16 . 1 1 46 46 SER N N 46 108.797 108.797 114.607 -5.810 25294 6618 1 16 . 1 1 46 46 SER HA H 46 4.388 4.388 4.738 -0.350 25294 6619 1 16 . 1 1 46 46 SER CA C 46 53.664 53.664 57.912 -4.248 25294 6620 1 16 . 1 1 46 46 SER CB C 46 61.810 61.810 63.220 -1.410 25294 6621 1 16 . 1 1 47 47 PHE N N 47 117.325 117.325 119.130 -1.805 25294 6622 1 16 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.432 -0.790 25294 6623 1 16 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.862 -3.245 25294 6624 1 16 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.175 -5.074 25294 6625 1 16 . 1 1 48 48 TRP N N 48 117.090 117.090 118.291 -1.201 25294 6626 1 16 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.287 -0.052 25294 6627 1 16 . 1 1 48 48 TRP CA C 48 53.492 53.492 54.559 -1.067 25294 6628 1 16 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.473 -1.578 25294 6629 1 16 . 1 1 49 49 ILE N N 49 119.682 119.682 122.167 -2.485 25294 6630 1 16 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.423 -0.392 25294 6631 1 16 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.234 -0.761 25294 6632 1 16 . 1 1 49 49 ILE CB C 49 36.436 36.436 35.801 0.635 25294 6633 1 16 . 1 1 50 50 SER N N 50 124.071 124.071 124.758 -0.687 25294 6634 1 16 . 1 1 50 50 SER HA H 50 4.708 4.708 4.697 0.011 25294 6635 1 16 . 1 1 50 50 SER CA C 50 56.110 56.110 61.102 -4.992 25294 6636 1 16 . 1 1 50 50 SER CB C 50 63.816 63.816 64.281 -0.466 25294 6637 1 16 . 1 1 51 51 SER N N 51 111.253 111.253 112.323 -1.070 25294 6638 1 16 . 1 1 51 51 SER HA H 51 4.557 4.557 4.751 -0.194 25294 6639 1 16 . 1 1 51 51 SER CA C 51 55.564 55.564 57.360 -1.796 25294 6640 1 16 . 1 1 51 51 SER CB C 51 62.821 62.821 66.978 -4.157 25294 6641 1 16 . 1 1 52 52 VAL N N 52 121.147 121.147 119.433 1.714 25294 6642 1 16 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.663 0.068 25294 6643 1 16 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.202 -0.076 25294 6644 1 16 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.397 -2.897 25294 6645 1 16 . 1 1 53 53 LYS N N 53 126.128 126.128 125.028 1.100 25294 6646 1 16 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.677 0.330 25294 6647 1 16 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.656 -2.933 25294 6648 1 16 . 1 1 53 53 LYS CB C 53 33.772 33.772 34.852 -1.080 25294 6649 1 16 . 1 1 54 54 GLU N N 54 124.160 124.160 123.107 1.053 25294 6650 1 16 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.917 0.841 25294 6651 1 16 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.502 -2.243 25294 6652 1 16 . 1 1 54 54 GLU CB C 54 31.059 31.059 30.433 0.626 25294 6653 1 16 . 1 1 55 55 GLU N N 55 127.218 127.218 119.146 8.072 25294 6654 1 16 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.433 -0.525 25294 6655 1 16 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.170 -1.625 25294 6656 1 16 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.129 -4.835 25294 6657 1 16 . 1 1 56 56 GLY N N 56 104.894 104.894 108.931 -4.037 25294 6658 1 16 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.504 -3.623 25294 6659 1 16 . 1 1 57 57 LYS N N 57 120.444 120.444 116.462 3.982 25294 6660 1 16 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.793 -0.229 25294 6661 1 16 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.168 -2.209 25294 6662 1 16 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.293 -3.105 25294 6663 1 16 . 1 1 58 58 PHE N N 58 121.824 121.824 119.729 2.095 25294 6664 1 16 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.524 -0.753 25294 6665 1 16 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.598 -0.433 25294 6666 1 16 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.546 -3.644 25294 6667 1 16 . 1 1 59 59 LYS N N 59 123.205 123.205 120.283 2.922 25294 6668 1 16 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.743 -0.292 25294 6669 1 16 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.856 -3.871 25294 6670 1 16 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.748 -4.957 25294 6671 1 16 . 1 1 60 60 GLU N N 60 122.647 122.647 119.644 3.003 25294 6672 1 16 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.335 -0.075 25294 6673 1 16 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.507 -2.601 25294 6674 1 16 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.487 -2.824 25294 6675 1 16 . 1 1 61 61 ASN N N 61 119.907 119.907 120.033 -0.126 25294 6676 1 16 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.919 -0.074 25294 6677 1 16 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.058 -2.306 25294 6678 1 16 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.322 -3.300 25294 6679 1 16 . 1 1 62 62 THR N N 62 113.271 113.271 117.444 -4.173 25294 6680 1 16 . 1 1 62 62 THR HA H 62 4.308 4.308 4.123 0.185 25294 6681 1 16 . 1 1 62 62 THR CA C 62 59.310 59.310 63.359 -4.049 25294 6682 1 16 . 1 1 62 62 THR CB C 62 66.813 66.813 69.265 -2.452 25294 6683 1 16 . 1 1 63 63 SER N N 63 116.521 116.521 112.370 4.151 25294 6684 1 16 . 1 1 63 63 SER HA H 63 4.650 4.650 4.398 0.252 25294 6685 1 16 . 1 1 63 63 SER CA C 63 54.094 54.094 56.986 -2.893 25294 6686 1 16 . 1 1 63 63 SER CB C 63 61.617 61.617 63.924 -2.307 25294 6687 1 16 . 1 1 64 64 TYR N N 64 120.183 120.183 120.230 -0.047 25294 6688 1 16 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.936 -0.098 25294 6689 1 16 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.766 -2.363 25294 6690 1 16 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.695 -3.126 25294 6691 1 16 . 1 1 65 65 LYS N N 65 115.195 115.195 117.338 -2.143 25294 6692 1 16 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.667 0.054 25294 6693 1 16 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.575 -3.869 25294 6694 1 16 . 1 1 65 65 LYS CB C 65 31.820 31.820 35.080 -3.260 25294 6695 1 16 . 1 1 66 66 GLU N N 66 117.231 117.231 117.658 -0.427 25294 6696 1 16 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.136 0.077 25294 6697 1 16 . 1 1 66 66 GLU CA C 66 52.613 52.613 54.883 -2.270 25294 6698 1 16 . 1 1 66 66 GLU CB C 66 30.793 30.793 34.082 -3.289 25294 6699 1 16 . 1 1 67 67 PHE N N 67 121.532 121.532 120.378 1.154 25294 6700 1 16 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.715 -0.285 25294 6701 1 16 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.431 -1.162 25294 6702 1 16 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.756 -2.481 25294 6703 1 16 . 1 1 68 68 ASP N N 68 128.157 128.157 124.914 3.243 25294 6704 1 16 . 1 1 68 68 ASP HA H 68 4.428 4.428 5.092 -0.664 25294 6705 1 16 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.205 -2.649 25294 6706 1 16 . 1 1 68 68 ASP CB C 68 38.424 38.424 43.382 -4.958 25294 6707 1 16 . 1 1 69 69 GLY N N 69 114.151 114.151 109.287 4.864 25294 6708 1 16 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.441 -3.542 25294 6709 1 16 . 1 1 70 70 GLY N N 70 113.714 113.714 111.050 2.664 25294 6710 1 16 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.714 -1.720 25294 6711 1 16 . 1 1 71 71 TRP N N 71 117.823 117.823 120.402 -2.579 25294 6712 1 16 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.796 0.012 25294 6713 1 16 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.804 -3.027 25294 6714 1 16 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.508 -3.863 25294 6715 1 16 . 1 1 72 72 TYR N N 72 114.204 114.204 119.200 -4.996 25294 6716 1 16 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.502 0.623 25294 6717 1 16 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.059 -5.624 25294 6718 1 16 . 1 1 72 72 TYR CB C 72 38.620 38.620 41.032 -2.412 25294 6719 1 16 . 1 1 73 73 LEU N N 73 121.469 121.469 126.982 -5.513 25294 6720 1 16 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.975 -0.208 25294 6721 1 16 . 1 1 73 73 LEU CA C 73 51.332 51.332 54.675 -3.342 25294 6722 1 16 . 1 1 73 73 LEU CB C 73 43.403 43.403 44.990 -1.587 25294 6723 1 16 . 1 1 74 74 VAL N N 74 124.558 124.558 126.695 -2.137 25294 6724 1 16 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.599 0.184 25294 6725 1 16 . 1 1 74 74 VAL CA C 74 57.812 57.812 61.281 -3.469 25294 6726 1 16 . 1 1 74 74 VAL CB C 74 31.820 31.820 33.316 -1.496 25294 6727 1 16 . 1 1 75 75 LYS N N 75 125.824 125.824 125.909 -0.085 25294 6728 1 16 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.135 -0.025 25294 6729 1 16 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.131 -2.327 25294 6730 1 16 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.268 -2.693 25294 6731 1 16 . 1 1 76 76 ILE N N 76 124.647 124.647 123.289 1.358 25294 6732 1 16 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.717 0.361 25294 6733 1 16 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.349 -2.982 25294 6734 1 16 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.998 -2.405 25294 6735 1 16 . 1 1 77 77 GLU N N 77 128.081 128.081 128.178 -0.097 25294 6736 1 16 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.639 -0.195 25294 6737 1 16 . 1 1 77 77 GLU CA C 77 52.471 52.471 54.911 -2.440 25294 6738 1 16 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.124 -1.210 25294 6739 1 16 . 1 1 78 78 ASP N N 78 126.158 126.158 125.465 0.693 25294 6740 1 16 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.195 -0.095 25294 6741 1 16 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.473 -3.410 25294 6742 1 16 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.178 -3.440 25294 6743 1 16 . 1 1 79 79 ASN N N 79 118.653 118.653 115.787 2.866 25294 6744 1 16 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.909 -0.263 25294 6745 1 16 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.266 -2.057 25294 6746 1 16 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.933 -5.583 25294 6747 1 16 . 1 1 80 80 GLU N N 80 120.378 120.378 122.258 -1.880 25294 6748 1 16 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.170 0.339 25294 6749 1 16 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.514 -2.654 25294 6750 1 16 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.497 -0.824 25294 6751 1 16 . 1 1 81 81 LEU N N 81 125.771 125.771 129.963 -4.192 25294 6752 1 16 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.045 -0.079 25294 6753 1 16 . 1 1 81 81 LEU CA C 81 51.014 51.014 55.323 -4.309 25294 6754 1 16 . 1 1 81 81 LEU CB C 81 42.550 42.550 43.595 -1.045 25294 6755 1 16 . 1 1 82 82 LYS N N 82 128.076 128.076 125.081 2.995 25294 6756 1 16 . 1 1 82 82 LYS HA H 82 5.245 5.245 4.922 0.323 25294 6757 1 16 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.729 -2.397 25294 6758 1 16 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.592 -4.413 25294 6759 1 16 . 1 1 83 83 VAL N N 83 124.216 124.216 119.937 4.279 25294 6760 1 16 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.032 -0.124 25294 6761 1 16 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.302 -1.922 25294 6762 1 16 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.958 -2.790 25294 6763 1 16 . 1 1 84 84 ILE N N 84 129.084 129.084 127.452 1.632 25294 6764 1 16 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.450 0.080 25294 6765 1 16 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.174 -1.768 25294 6766 1 16 . 1 1 84 84 ILE CB C 84 38.166 38.166 39.898 -1.732 25294 6767 1 16 . 1 1 85 85 ILE N N 85 127.360 127.360 128.744 -1.384 25294 6768 1 16 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.137 0.448 25294 6769 1 16 . 1 1 85 85 ILE CA C 85 58.460 58.460 61.381 -2.921 25294 6770 1 16 . 1 1 85 85 ILE CB C 85 38.498 38.498 38.519 -0.021 25294 6771 1 16 . 1 1 86 86 ASN N N 86 128.337 128.337 123.629 4.708 25294 6772 1 16 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.825 -0.059 25294 6773 1 16 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.628 -2.446 25294 6774 1 16 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.075 -3.184 25294 6775 1 16 . 1 1 87 87 ARG N N 87 119.368 119.368 121.394 -2.026 25294 6776 1 16 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.294 -0.303 25294 6777 1 16 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.594 -2.397 25294 6778 1 16 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.145 -1.742 25294 6779 1 16 . 1 1 88 88 ASN N N 88 125.082 125.082 123.811 1.271 25294 6780 1 16 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.495 0.230 25294 6781 1 16 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.512 -4.409 25294 6782 1 16 . 1 1 88 88 ASN CB C 88 34.757 34.757 39.418 -4.661 25294 6783 1 16 . 1 1 89 89 GLU N N 89 125.309 125.309 121.263 4.046 25294 6784 1 16 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.381 -0.023 25294 6785 1 16 . 1 1 89 89 GLU CA C 89 53.013 53.013 55.728 -2.715 25294 6786 1 16 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.925 -2.841 25294 6787 1 16 . 1 1 90 90 THR N N 90 112.516 112.516 112.646 -0.130 25294 6788 1 16 . 1 1 90 90 THR HA H 90 4.534 4.534 4.553 -0.019 25294 6789 1 16 . 1 1 90 90 THR CA C 90 58.161 58.161 59.839 -1.678 25294 6790 1 16 . 1 1 90 90 THR CB C 90 68.409 68.409 71.683 -3.274 25294 6791 1 16 . 1 1 91 91 ASN N N 91 116.717 116.717 118.218 -1.501 25294 6792 1 16 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.871 -0.164 25294 6793 1 16 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.155 -3.359 25294 6794 1 16 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.240 -2.766 25294 6795 1 16 . 1 1 92 92 ALA N N 92 122.025 122.025 122.267 -0.242 25294 6796 1 16 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.576 0.060 25294 6797 1 16 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.378 -2.329 25294 6798 1 16 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.998 -1.282 25294 6799 1 16 . 1 1 93 93 SER N N 93 115.895 115.895 117.852 -1.957 25294 6800 1 16 . 1 1 93 93 SER HA H 93 4.536 4.536 4.758 -0.222 25294 6801 1 16 . 1 1 93 93 SER CA C 93 54.865 54.865 58.703 -3.838 25294 6802 1 16 . 1 1 93 93 SER CB C 93 61.292 61.292 64.083 -2.791 25294 6803 1 16 . 1 1 94 94 ARG N N 94 119.529 119.529 124.090 -4.561 25294 6804 1 16 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.839 0.075 25294 6805 1 16 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.061 -1.965 25294 6806 1 16 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.557 -4.045 25294 6807 1 16 . 1 1 95 95 SER N N 95 114.542 114.542 114.092 0.450 25294 6808 1 16 . 1 1 95 95 SER HA H 95 5.926 5.926 5.691 0.235 25294 6809 1 16 . 1 1 95 95 SER CA C 95 54.219 54.219 57.264 -3.046 25294 6810 1 16 . 1 1 95 95 SER CB C 95 65.271 65.271 66.575 -1.304 25294 6811 1 16 . 1 1 96 96 PHE N N 96 117.183 117.183 118.271 -1.088 25294 6812 1 16 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.333 0.005 25294 6813 1 16 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.896 -2.416 25294 6814 1 16 . 1 1 96 96 PHE CB C 96 38.868 38.868 44.200 -5.332 25294 6815 1 16 . 1 1 97 97 THR N N 97 115.263 115.263 117.273 -2.010 25294 6816 1 16 . 1 1 97 97 THR HA H 97 5.250 5.250 5.342 -0.092 25294 6817 1 16 . 1 1 97 97 THR CA C 97 58.178 58.178 61.537 -3.359 25294 6818 1 16 . 1 1 97 97 THR CB C 97 69.068 69.068 72.109 -3.041 25294 6819 1 16 . 1 1 98 98 VAL N N 98 125.442 125.442 119.089 6.353 25294 6820 1 16 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.687 0.170 25294 6821 1 16 . 1 1 98 98 VAL CA C 98 57.409 57.409 59.750 -2.341 25294 6822 1 16 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.094 -1.165 25294 6823 1 16 . 1 1 99 99 CYS N N 99 127.111 127.111 124.301 2.810 25294 6824 1 16 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.218 0.128 25294 6825 1 16 . 1 1 99 99 CYS CA C 99 53.951 53.951 57.373 -3.422 25294 6826 1 16 . 1 1 99 99 CYS CB C 99 25.942 25.942 29.909 -3.967 25294 6827 1 16 . 1 1 100 100 VAL N N 100 120.146 120.146 117.401 2.745 25294 6828 1 16 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.351 0.032 25294 6829 1 16 . 1 1 100 100 VAL CA C 100 55.713 55.713 58.660 -2.947 25294 6830 1 16 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.916 -3.273 25294 6831 1 16 . 1 1 101 101 GLU N N 101 118.807 118.807 121.192 -2.385 25294 6832 1 16 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.730 0.022 25294 6833 1 16 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.526 -3.091 25294 6834 1 16 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.791 -2.070 25294 6835 1 16 . 1 1 102 102 ALA N N 102 124.088 124.088 127.307 -3.219 25294 6836 1 16 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.896 -1.039 25294 6837 1 16 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.534 -2.656 25294 6838 1 16 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.622 -1.597 25294 6839 1 16 . 1 1 103 103 GLY N N 103 111.186 111.186 112.353 -1.167 25294 6840 1 16 . 1 1 103 103 GLY CA C 103 44.643 44.643 47.207 -2.564 25294 6841 1 16 . 1 1 104 104 ASN N N 104 123.092 123.092 123.817 -0.725 25294 6842 1 16 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.695 -0.023 25294 6843 1 16 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.721 -3.025 25294 6844 1 16 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.258 -2.851 25294 6845 1 16 . 1 1 105 105 ALA N N 105 122.653 122.653 120.395 2.258 25294 6846 1 16 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.207 0.224 25294 6847 1 16 . 1 1 105 105 ALA CA C 105 48.668 48.668 50.666 -1.998 25294 6848 1 16 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.121 -2.185 25294 6849 1 16 . 1 1 106 106 PHE N N 106 116.011 116.011 111.619 4.392 25294 6850 1 16 . 1 1 106 106 PHE HA H 106 5.417 5.417 4.741 0.676 25294 6851 1 16 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.613 -3.055 25294 6852 1 16 . 1 1 106 106 PHE CB C 106 40.484 40.484 41.696 -1.212 25294 6853 1 16 . 1 1 107 107 ASP N N 107 121.992 121.992 119.024 2.968 25294 6854 1 16 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.833 -0.239 25294 6855 1 16 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.814 -2.290 25294 6856 1 16 . 1 1 107 107 ASP CB C 107 43.091 43.091 45.059 -1.968 25294 6857 1 16 . 1 1 108 108 GLU N N 108 119.354 119.354 120.744 -1.390 25294 6858 1 16 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.898 0.111 25294 6859 1 16 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.174 -3.186 25294 6860 1 16 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.908 -1.591 25294 6861 1 16 . 1 1 109 109 PHE N N 109 122.098 122.098 122.855 -0.757 25294 6862 1 16 . 1 1 109 109 PHE HA H 109 4.958 4.958 5.203 -0.245 25294 6863 1 16 . 1 1 109 109 PHE CA C 109 52.787 52.787 55.889 -3.102 25294 6864 1 16 . 1 1 109 109 PHE CB C 109 40.443 40.443 42.539 -2.096 25294 6865 1 16 . 1 1 110 110 LYS N N 110 124.500 124.500 119.854 4.646 25294 6866 1 16 . 1 1 110 110 LYS HA H 110 4.692 4.692 5.271 -0.579 25294 6867 1 16 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.031 -3.140 25294 6868 1 16 . 1 1 110 110 LYS CB C 110 33.012 33.012 36.098 -3.086 25294 6869 1 16 . 1 1 111 111 PHE N N 111 125.010 125.010 120.022 4.988 25294 6870 1 16 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.239 -0.485 25294 6871 1 16 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.233 0.951 25294 6872 1 16 . 1 1 111 111 PHE CB C 111 38.380 38.380 43.190 -4.810 25294 6873 1 16 . 1 1 112 112 VAL N N 112 122.957 122.957 120.618 2.339 25294 6874 1 16 . 1 1 112 112 VAL HA H 112 4.440 4.440 5.128 -0.688 25294 6875 1 16 . 1 1 112 112 VAL CA C 112 58.256 58.256 60.041 -1.785 25294 6876 1 16 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.231 -4.138 25294 6877 1 16 . 1 1 113 113 GLN N N 113 130.864 130.864 126.952 3.912 25294 6878 1 16 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.899 0.420 25294 6879 1 16 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.027 -2.908 25294 6880 1 16 . 1 1 113 113 GLN CB C 113 28.164 28.164 31.819 -3.655 25294 6881 1 16 . 1 1 114 114 ASP N N 114 126.272 126.272 126.426 -0.154 25294 6882 1 16 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.723 -0.396 25294 6883 1 16 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.329 -2.556 25294 6884 1 16 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.354 -2.499 25294 6885 1 16 . 1 1 115 115 ALA N N 115 120.134 120.134 121.590 -1.456 25294 6886 1 16 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.332 -0.633 25294 6887 1 16 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.535 -2.634 25294 6888 1 16 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.659 -1.907 25294 6889 1 16 . 1 1 116 116 ALA N N 116 121.377 121.377 125.826 -4.449 25294 6890 1 16 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.248 -0.295 25294 6891 1 16 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.722 -2.734 25294 6892 1 16 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.618 -3.418 25294 6893 1 16 . 1 1 117 117 LYS N N 117 121.536 121.536 124.096 -2.560 25294 6894 1 16 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.488 -0.349 25294 6895 1 16 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.416 -1.770 25294 6896 1 16 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.646 -1.067 25294 6897 1 17 . 1 1 5 5 SER N N 5 116.267 116.267 119.268 -3.001 25294 6898 1 17 . 1 1 5 5 SER HA H 5 4.349 4.349 4.664 -0.315 25294 6899 1 17 . 1 1 5 5 SER CA C 5 55.478 55.478 57.363 -1.885 25294 6900 1 17 . 1 1 5 5 SER CB C 5 61.191 61.191 65.759 -4.568 25294 6901 1 17 . 1 1 6 6 ASP N N 6 123.039 123.039 120.317 2.722 25294 6902 1 17 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.884 -0.057 25294 6903 1 17 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.099 -2.428 25294 6904 1 17 . 1 1 6 6 ASP CB C 6 38.656 38.656 40.806 -2.150 25294 6905 1 17 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.427 -0.110 25294 6906 1 17 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.091 -2.944 25294 6907 1 17 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.012 -2.534 25294 6908 1 17 . 1 1 8 8 ASP N N 8 119.159 119.159 117.122 2.037 25294 6909 1 17 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.731 -0.166 25294 6910 1 17 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.148 -2.288 25294 6911 1 17 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.304 -2.579 25294 6912 1 17 . 1 1 9 9 GLY N N 9 108.837 108.837 110.535 -1.698 25294 6913 1 17 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.231 -2.095 25294 6914 1 17 . 1 1 10 10 LEU N N 10 121.571 121.571 119.250 2.321 25294 6915 1 17 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.660 -0.393 25294 6916 1 17 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.458 -1.067 25294 6917 1 17 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.887 -3.024 25294 6918 1 17 . 1 1 11 11 ALA N N 11 125.169 125.169 122.366 2.803 25294 6919 1 17 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.548 -0.212 25294 6920 1 17 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.372 -2.388 25294 6921 1 17 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.825 -2.643 25294 6922 1 17 . 1 1 12 12 ASP N N 12 122.672 122.672 124.836 -2.164 25294 6923 1 17 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.035 -0.299 25294 6924 1 17 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.990 -2.288 25294 6925 1 17 . 1 1 12 12 ASP CB C 12 37.831 37.831 42.097 -4.266 25294 6926 1 17 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.462 -0.158 25294 6927 1 17 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.436 -2.836 25294 6928 1 17 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.749 -3.233 25294 6929 1 17 . 1 1 14 14 MET N N 14 120.151 120.151 118.375 1.776 25294 6930 1 17 . 1 1 14 14 MET HA H 14 3.780 3.780 4.630 -0.850 25294 6931 1 17 . 1 1 14 14 MET CA C 14 55.822 55.822 56.407 -0.585 25294 6932 1 17 . 1 1 14 14 MET CB C 14 30.909 30.909 32.426 -1.517 25294 6933 1 17 . 1 1 15 15 LYS N N 15 123.897 123.897 125.137 -1.240 25294 6934 1 17 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.651 -0.194 25294 6935 1 17 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.335 -3.928 25294 6936 1 17 . 1 1 15 15 LYS CB C 15 32.453 32.453 32.990 -0.537 25294 6937 1 17 . 1 1 16 16 TRP N N 16 125.776 125.776 127.953 -2.177 25294 6938 1 17 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.136 -0.061 25294 6939 1 17 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.686 -3.034 25294 6940 1 17 . 1 1 16 16 TRP CB C 16 28.000 28.000 29.397 -1.397 25294 6941 1 17 . 1 1 17 17 SER N N 17 120.772 120.772 120.783 -0.011 25294 6942 1 17 . 1 1 17 17 SER HA H 17 4.403 4.403 4.481 -0.078 25294 6943 1 17 . 1 1 17 17 SER CA C 17 56.167 56.167 59.825 -3.658 25294 6944 1 17 . 1 1 17 17 SER CB C 17 60.833 60.833 63.524 -2.691 25294 6945 1 17 . 1 1 18 18 LYS N N 18 121.096 121.096 121.506 -0.410 25294 6946 1 17 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.600 0.118 25294 6947 1 17 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.657 -1.922 25294 6948 1 17 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.625 -2.708 25294 6949 1 17 . 1 1 19 19 VAL N N 19 116.358 116.358 118.888 -2.530 25294 6950 1 17 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.405 0.018 25294 6951 1 17 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.212 -2.982 25294 6952 1 17 . 1 1 19 19 VAL CB C 19 31.026 31.026 34.141 -3.115 25294 6953 1 17 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.374 -0.071 25294 6954 1 17 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.397 -2.627 25294 6955 1 17 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.250 -2.697 25294 6956 1 17 . 1 1 21 21 SER N N 21 118.882 118.882 117.337 1.545 25294 6957 1 17 . 1 1 21 21 SER HA H 21 4.084 4.084 4.176 -0.092 25294 6958 1 17 . 1 1 21 21 SER CA C 21 57.657 57.657 60.651 -2.994 25294 6959 1 17 . 1 1 21 21 SER CB C 21 60.173 60.173 62.898 -2.725 25294 6960 1 17 . 1 1 22 22 GLY N N 22 109.523 109.523 109.179 0.344 25294 6961 1 17 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.589 -2.185 25294 6962 1 17 . 1 1 23 23 LEU N N 23 123.003 123.003 122.522 0.481 25294 6963 1 17 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.313 -0.279 25294 6964 1 17 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.511 -1.908 25294 6965 1 17 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.068 -1.997 25294 6966 1 17 . 1 1 24 24 LYS N N 24 129.004 129.004 127.363 1.641 25294 6967 1 17 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.497 0.013 25294 6968 1 17 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.382 -2.145 25294 6969 1 17 . 1 1 24 24 LYS CB C 24 32.161 32.161 34.340 -2.179 25294 6970 1 17 . 1 1 25 25 ASN N N 25 126.336 126.336 124.366 1.970 25294 6971 1 17 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.396 -0.072 25294 6972 1 17 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.864 -2.244 25294 6973 1 17 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.945 -2.960 25294 6974 1 17 . 1 1 26 26 GLY N N 26 103.076 103.076 101.462 1.614 25294 6975 1 17 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.384 -1.835 25294 6976 1 17 . 1 1 27 27 GLU N N 27 120.878 120.878 120.858 0.020 25294 6977 1 17 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.152 0.050 25294 6978 1 17 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.282 -4.048 25294 6979 1 17 . 1 1 27 27 GLU CB C 27 30.761 30.761 32.006 -1.245 25294 6980 1 17 . 1 1 28 28 LEU N N 28 128.583 128.583 125.903 2.680 25294 6981 1 17 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.594 -0.039 25294 6982 1 17 . 1 1 28 28 LEU CA C 28 50.324 50.324 52.881 -2.557 25294 6983 1 17 . 1 1 28 28 LEU CB C 28 43.517 43.517 43.190 0.327 25294 6984 1 17 . 1 1 29 29 LYS N N 29 127.554 127.554 125.286 2.268 25294 6985 1 17 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.402 0.499 25294 6986 1 17 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.727 -3.888 25294 6987 1 17 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.169 -3.647 25294 6988 1 17 . 1 1 30 30 VAL N N 30 127.915 127.915 124.168 3.747 25294 6989 1 17 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.553 -0.369 25294 6990 1 17 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.639 -2.331 25294 6991 1 17 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.028 -3.758 25294 6992 1 17 . 1 1 31 31 GLU N N 31 125.151 125.151 124.738 0.413 25294 6993 1 17 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.592 -0.231 25294 6994 1 17 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.287 -1.187 25294 6995 1 17 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.103 -3.400 25294 6996 1 17 . 1 1 32 32 ALA N N 32 126.271 126.271 120.863 5.408 25294 6997 1 17 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.298 -0.282 25294 6998 1 17 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.468 -1.341 25294 6999 1 17 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.543 -3.277 25294 7000 1 17 . 1 1 33 33 GLU N N 33 113.076 113.076 115.958 -2.882 25294 7001 1 17 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.264 -0.299 25294 7002 1 17 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.962 -0.977 25294 7003 1 17 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.317 -3.389 25294 7004 1 17 . 1 1 34 34 GLY N N 34 104.905 104.905 107.958 -3.053 25294 7005 1 17 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.044 -4.337 25294 7006 1 17 . 1 1 35 35 GLY N N 35 105.946 105.946 107.315 -1.369 25294 7007 1 17 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.437 -1.449 25294 7008 1 17 . 1 1 36 36 SER N N 36 116.044 116.044 114.236 1.808 25294 7009 1 17 . 1 1 36 36 SER HA H 36 5.539 5.539 5.480 0.059 25294 7010 1 17 . 1 1 36 36 SER CA C 36 54.323 54.323 57.399 -3.076 25294 7011 1 17 . 1 1 36 36 SER CB C 36 62.808 62.808 66.191 -3.383 25294 7012 1 17 . 1 1 37 37 SER N N 37 119.501 119.501 114.093 5.408 25294 7013 1 17 . 1 1 37 37 SER HA H 37 4.712 4.712 4.626 0.086 25294 7014 1 17 . 1 1 37 37 SER CA C 37 55.548 55.548 57.424 -1.876 25294 7015 1 17 . 1 1 37 37 SER CB C 37 63.943 63.943 66.334 -2.391 25294 7016 1 17 . 1 1 38 38 LEU N N 38 125.962 125.962 121.957 4.005 25294 7017 1 17 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.046 0.207 25294 7018 1 17 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.760 -2.978 25294 7019 1 17 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.978 -3.144 25294 7020 1 17 . 1 1 39 39 PHE N N 39 124.707 124.707 123.158 1.549 25294 7021 1 17 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.128 0.011 25294 7022 1 17 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.650 -4.519 25294 7023 1 17 . 1 1 39 39 PHE CB C 39 38.952 38.952 41.886 -2.934 25294 7024 1 17 . 1 1 40 40 ALA N N 40 124.994 124.994 127.984 -2.990 25294 7025 1 17 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.518 0.117 25294 7026 1 17 . 1 1 40 40 ALA CA C 40 48.301 48.301 49.960 -1.659 25294 7027 1 17 . 1 1 40 40 ALA CB C 40 19.446 19.446 20.529 -1.083 25294 7028 1 17 . 1 1 41 41 CYS N N 41 125.757 125.757 124.876 0.881 25294 7029 1 17 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.133 0.013 25294 7030 1 17 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.778 -3.313 25294 7031 1 17 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.597 -1.624 25294 7032 1 17 . 1 1 42 42 LYS N N 42 129.019 129.019 127.373 1.646 25294 7033 1 17 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.247 0.013 25294 7034 1 17 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.646 -2.795 25294 7035 1 17 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.795 -0.688 25294 7036 1 17 . 1 1 43 43 ASN N N 43 113.240 113.240 113.810 -0.570 25294 7037 1 17 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.558 -0.033 25294 7038 1 17 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.100 -2.865 25294 7039 1 17 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.268 -4.407 25294 7040 1 17 . 1 1 44 44 TYR N N 44 119.335 119.335 118.898 0.437 25294 7041 1 17 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.580 -0.023 25294 7042 1 17 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.803 -2.086 25294 7043 1 17 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.265 -3.893 25294 7044 1 17 . 1 1 45 45 LYS N N 45 120.676 120.676 121.757 -1.081 25294 7045 1 17 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.807 -0.771 25294 7046 1 17 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.156 -1.618 25294 7047 1 17 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.991 -2.758 25294 7048 1 17 . 1 1 46 46 SER N N 46 108.797 108.797 114.921 -6.124 25294 7049 1 17 . 1 1 46 46 SER HA H 46 4.388 4.388 4.769 -0.381 25294 7050 1 17 . 1 1 46 46 SER CA C 46 53.664 53.664 57.736 -4.072 25294 7051 1 17 . 1 1 46 46 SER CB C 46 61.810 61.810 63.344 -1.534 25294 7052 1 17 . 1 1 47 47 PHE N N 47 117.325 117.325 119.805 -2.480 25294 7053 1 17 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.223 -0.581 25294 7054 1 17 . 1 1 47 47 PHE CA C 47 53.617 53.617 55.779 -2.162 25294 7055 1 17 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.267 -5.166 25294 7056 1 17 . 1 1 48 48 TRP N N 48 117.090 117.090 118.262 -1.172 25294 7057 1 17 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.166 0.069 25294 7058 1 17 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.165 -1.673 25294 7059 1 17 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.203 -1.308 25294 7060 1 17 . 1 1 49 49 ILE N N 49 119.682 119.682 121.145 -1.463 25294 7061 1 17 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.539 -0.508 25294 7062 1 17 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.853 -1.380 25294 7063 1 17 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.670 -0.234 25294 7064 1 17 . 1 1 50 50 SER N N 50 124.071 124.071 121.483 2.588 25294 7065 1 17 . 1 1 50 50 SER HA H 50 4.708 4.708 4.838 -0.130 25294 7066 1 17 . 1 1 50 50 SER CA C 50 56.110 56.110 57.788 -1.678 25294 7067 1 17 . 1 1 50 50 SER CB C 50 63.816 63.816 64.826 -1.010 25294 7068 1 17 . 1 1 51 51 SER N N 51 111.253 111.253 114.080 -2.827 25294 7069 1 17 . 1 1 51 51 SER HA H 51 4.557 4.557 4.555 0.002 25294 7070 1 17 . 1 1 51 51 SER CA C 51 55.564 55.564 56.713 -1.149 25294 7071 1 17 . 1 1 51 51 SER CB C 51 62.821 62.821 65.249 -2.428 25294 7072 1 17 . 1 1 52 52 VAL N N 52 121.147 121.147 118.937 2.210 25294 7073 1 17 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.793 -0.062 25294 7074 1 17 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.373 -1.247 25294 7075 1 17 . 1 1 52 52 VAL CB C 52 32.500 32.500 34.356 -1.856 25294 7076 1 17 . 1 1 53 53 LYS N N 53 126.128 126.128 126.460 -0.332 25294 7077 1 17 . 1 1 53 53 LYS HA H 53 5.007 5.007 5.145 -0.138 25294 7078 1 17 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.374 -2.651 25294 7079 1 17 . 1 1 53 53 LYS CB C 53 33.772 33.772 36.330 -2.558 25294 7080 1 17 . 1 1 54 54 GLU N N 54 124.160 124.160 120.054 4.106 25294 7081 1 17 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.656 1.102 25294 7082 1 17 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.798 -2.539 25294 7083 1 17 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.141 -0.082 25294 7084 1 17 . 1 1 55 55 GLU N N 55 127.218 127.218 117.807 9.411 25294 7085 1 17 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.373 -0.465 25294 7086 1 17 . 1 1 55 55 GLU CA C 55 54.546 54.546 55.821 -1.275 25294 7087 1 17 . 1 1 55 55 GLU CB C 55 25.294 25.294 29.767 -4.473 25294 7088 1 17 . 1 1 56 56 GLY N N 56 104.894 104.894 108.649 -3.755 25294 7089 1 17 . 1 1 56 56 GLY CA C 56 42.881 42.881 45.879 -2.998 25294 7090 1 17 . 1 1 57 57 LYS N N 57 120.444 120.444 118.731 1.713 25294 7091 1 17 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.714 -0.150 25294 7092 1 17 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.761 -2.802 25294 7093 1 17 . 1 1 57 57 LYS CB C 57 32.188 32.188 33.964 -1.776 25294 7094 1 17 . 1 1 58 58 PHE N N 58 121.824 121.824 120.495 1.329 25294 7095 1 17 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.082 -0.311 25294 7096 1 17 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.476 -0.311 25294 7097 1 17 . 1 1 58 58 PHE CB C 58 36.902 36.902 39.470 -2.568 25294 7098 1 17 . 1 1 59 59 LYS N N 59 123.205 123.205 121.908 1.297 25294 7099 1 17 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.757 -0.306 25294 7100 1 17 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.981 -3.996 25294 7101 1 17 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.397 -4.606 25294 7102 1 17 . 1 1 60 60 GLU N N 60 122.647 122.647 119.103 3.544 25294 7103 1 17 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.464 -0.204 25294 7104 1 17 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.114 -1.208 25294 7105 1 17 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.232 -2.569 25294 7106 1 17 . 1 1 61 61 ASN N N 61 119.907 119.907 117.949 1.958 25294 7107 1 17 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.051 -0.206 25294 7108 1 17 . 1 1 61 61 ASN CA C 61 50.752 50.752 52.799 -2.047 25294 7109 1 17 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.629 -3.606 25294 7110 1 17 . 1 1 62 62 THR N N 62 113.271 113.271 112.182 1.089 25294 7111 1 17 . 1 1 62 62 THR HA H 62 4.308 4.308 4.467 -0.159 25294 7112 1 17 . 1 1 62 62 THR CA C 62 59.310 59.310 62.548 -3.238 25294 7113 1 17 . 1 1 62 62 THR CB C 62 66.813 66.813 69.462 -2.649 25294 7114 1 17 . 1 1 63 63 SER N N 63 116.521 116.521 114.683 1.838 25294 7115 1 17 . 1 1 63 63 SER HA H 63 4.650 4.650 4.565 0.085 25294 7116 1 17 . 1 1 63 63 SER CA C 63 54.094 54.094 57.191 -3.097 25294 7117 1 17 . 1 1 63 63 SER CB C 63 61.617 61.617 63.942 -2.325 25294 7118 1 17 . 1 1 64 64 TYR N N 64 120.183 120.183 116.518 3.665 25294 7119 1 17 . 1 1 64 64 TYR HA H 64 4.838 4.838 5.065 -0.227 25294 7120 1 17 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.145 -1.742 25294 7121 1 17 . 1 1 64 64 TYR CB C 64 36.569 36.569 40.698 -4.129 25294 7122 1 17 . 1 1 65 65 LYS N N 65 115.195 115.195 117.022 -1.827 25294 7123 1 17 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.655 0.066 25294 7124 1 17 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.365 -3.659 25294 7125 1 17 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.532 -2.712 25294 7126 1 17 . 1 1 66 66 GLU N N 66 117.231 117.231 119.668 -2.437 25294 7127 1 17 . 1 1 66 66 GLU HA H 66 5.213 5.213 4.902 0.311 25294 7128 1 17 . 1 1 66 66 GLU CA C 66 52.613 52.613 56.106 -3.493 25294 7129 1 17 . 1 1 66 66 GLU CB C 66 30.793 30.793 32.901 -2.108 25294 7130 1 17 . 1 1 67 67 PHE N N 67 121.532 121.532 126.636 -5.104 25294 7131 1 17 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.849 -0.419 25294 7132 1 17 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.468 -1.199 25294 7133 1 17 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.359 -2.084 25294 7134 1 17 . 1 1 68 68 ASP N N 68 128.157 128.157 126.974 1.183 25294 7135 1 17 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.926 -0.498 25294 7136 1 17 . 1 1 68 68 ASP CA C 68 49.556 49.556 51.422 -1.866 25294 7137 1 17 . 1 1 68 68 ASP CB C 68 38.424 38.424 41.512 -3.088 25294 7138 1 17 . 1 1 69 69 GLY N N 69 114.151 114.151 108.744 5.407 25294 7139 1 17 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.285 -3.386 25294 7140 1 17 . 1 1 70 70 GLY N N 70 113.714 113.714 110.814 2.900 25294 7141 1 17 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.763 -1.769 25294 7142 1 17 . 1 1 71 71 TRP N N 71 117.823 117.823 120.858 -3.035 25294 7143 1 17 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.574 0.234 25294 7144 1 17 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.242 -3.465 25294 7145 1 17 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.707 -4.062 25294 7146 1 17 . 1 1 72 72 TYR N N 72 114.204 114.204 119.814 -5.610 25294 7147 1 17 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.914 0.211 25294 7148 1 17 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.129 -5.694 25294 7149 1 17 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.747 -2.127 25294 7150 1 17 . 1 1 73 73 LEU N N 73 121.469 121.469 127.224 -5.755 25294 7151 1 17 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.041 -0.274 25294 7152 1 17 . 1 1 73 73 LEU CA C 73 51.332 51.332 52.980 -1.647 25294 7153 1 17 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.087 -2.683 25294 7154 1 17 . 1 1 74 74 VAL N N 74 124.558 124.558 125.353 -0.795 25294 7155 1 17 . 1 1 74 74 VAL HA H 74 4.783 4.783 5.026 -0.243 25294 7156 1 17 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.563 -2.751 25294 7157 1 17 . 1 1 74 74 VAL CB C 74 31.820 31.820 34.364 -2.544 25294 7158 1 17 . 1 1 75 75 LYS N N 75 125.824 125.824 125.779 0.045 25294 7159 1 17 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.174 -0.064 25294 7160 1 17 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.789 -2.985 25294 7161 1 17 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.346 -2.771 25294 7162 1 17 . 1 1 76 76 ILE N N 76 124.647 124.647 124.009 0.638 25294 7163 1 17 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.710 0.368 25294 7164 1 17 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.510 -3.143 25294 7165 1 17 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.561 -1.968 25294 7166 1 17 . 1 1 77 77 GLU N N 77 128.081 128.081 128.511 -0.430 25294 7167 1 17 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.613 -0.169 25294 7168 1 17 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.275 -2.804 25294 7169 1 17 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.205 -1.291 25294 7170 1 17 . 1 1 78 78 ASP N N 78 126.158 126.158 125.391 0.767 25294 7171 1 17 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.237 -0.137 25294 7172 1 17 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.259 -3.196 25294 7173 1 17 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.347 -3.609 25294 7174 1 17 . 1 1 79 79 ASN N N 79 118.653 118.653 117.791 0.862 25294 7175 1 17 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.017 -0.371 25294 7176 1 17 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.239 -2.030 25294 7177 1 17 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.567 -5.217 25294 7178 1 17 . 1 1 80 80 GLU N N 80 120.378 120.378 121.642 -1.264 25294 7179 1 17 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.087 0.422 25294 7180 1 17 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.657 -2.797 25294 7181 1 17 . 1 1 80 80 GLU CB C 80 29.673 29.673 31.140 -1.467 25294 7182 1 17 . 1 1 81 81 LEU N N 81 125.771 125.771 128.152 -2.381 25294 7183 1 17 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.716 -0.750 25294 7184 1 17 . 1 1 81 81 LEU CA C 81 51.014 51.014 53.367 -2.353 25294 7185 1 17 . 1 1 81 81 LEU CB C 81 42.550 42.550 44.910 -2.360 25294 7186 1 17 . 1 1 82 82 LYS N N 82 128.076 128.076 125.400 2.676 25294 7187 1 17 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.276 -0.031 25294 7188 1 17 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.633 -2.301 25294 7189 1 17 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.313 -4.135 25294 7190 1 17 . 1 1 83 83 VAL N N 83 124.216 124.216 121.500 2.716 25294 7191 1 17 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.897 0.011 25294 7192 1 17 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.340 -1.960 25294 7193 1 17 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.254 -2.086 25294 7194 1 17 . 1 1 84 84 ILE N N 84 129.084 129.084 127.322 1.762 25294 7195 1 17 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.542 -0.012 25294 7196 1 17 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.264 -1.857 25294 7197 1 17 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.743 -2.577 25294 7198 1 17 . 1 1 85 85 ILE N N 85 127.360 127.360 126.138 1.222 25294 7199 1 17 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.672 -0.087 25294 7200 1 17 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.817 -1.357 25294 7201 1 17 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.297 -1.799 25294 7202 1 17 . 1 1 86 86 ASN N N 86 128.337 128.337 124.913 3.424 25294 7203 1 17 . 1 1 86 86 ASN HA H 86 4.766 4.766 5.097 -0.331 25294 7204 1 17 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.488 -2.306 25294 7205 1 17 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.982 -4.091 25294 7206 1 17 . 1 1 87 87 ARG N N 87 119.368 119.368 120.040 -0.672 25294 7207 1 17 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.304 -0.313 25294 7208 1 17 . 1 1 87 87 ARG CA C 87 54.198 54.198 57.045 -2.847 25294 7209 1 17 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.704 -2.301 25294 7210 1 17 . 1 1 88 88 ASN N N 88 125.082 125.082 124.371 0.711 25294 7211 1 17 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.593 0.132 25294 7212 1 17 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.129 -4.026 25294 7213 1 17 . 1 1 88 88 ASN CB C 88 34.757 34.757 39.744 -4.987 25294 7214 1 17 . 1 1 89 89 GLU N N 89 125.309 125.309 120.870 4.439 25294 7215 1 17 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.620 -0.262 25294 7216 1 17 . 1 1 89 89 GLU CA C 89 53.013 53.013 55.760 -2.747 25294 7217 1 17 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.807 -2.723 25294 7218 1 17 . 1 1 90 90 THR N N 90 112.516 112.516 111.031 1.485 25294 7219 1 17 . 1 1 90 90 THR HA H 90 4.534 4.534 4.550 -0.016 25294 7220 1 17 . 1 1 90 90 THR CA C 90 58.161 58.161 59.242 -1.081 25294 7221 1 17 . 1 1 90 90 THR CB C 90 68.409 68.409 71.557 -3.148 25294 7222 1 17 . 1 1 91 91 ASN N N 91 116.717 116.717 118.248 -1.531 25294 7223 1 17 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.977 -0.270 25294 7224 1 17 . 1 1 91 91 ASN CA C 91 49.796 49.796 52.603 -2.807 25294 7225 1 17 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.189 -2.715 25294 7226 1 17 . 1 1 92 92 ALA N N 92 122.025 122.025 123.029 -1.004 25294 7227 1 17 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.646 -0.010 25294 7228 1 17 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.745 -2.696 25294 7229 1 17 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.878 -1.162 25294 7230 1 17 . 1 1 93 93 SER N N 93 115.895 115.895 118.381 -2.486 25294 7231 1 17 . 1 1 93 93 SER HA H 93 4.536 4.536 4.769 -0.233 25294 7232 1 17 . 1 1 93 93 SER CA C 93 54.865 54.865 58.332 -3.467 25294 7233 1 17 . 1 1 93 93 SER CB C 93 61.292 61.292 64.184 -2.892 25294 7234 1 17 . 1 1 94 94 ARG N N 94 119.529 119.529 122.299 -2.770 25294 7235 1 17 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.924 -0.010 25294 7236 1 17 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.504 -2.408 25294 7237 1 17 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.522 -4.010 25294 7238 1 17 . 1 1 95 95 SER N N 95 114.542 114.542 117.139 -2.597 25294 7239 1 17 . 1 1 95 95 SER HA H 95 5.926 5.926 5.261 0.665 25294 7240 1 17 . 1 1 95 95 SER CA C 95 54.219 54.219 57.650 -3.431 25294 7241 1 17 . 1 1 95 95 SER CB C 95 65.271 65.271 65.949 -0.678 25294 7242 1 17 . 1 1 96 96 PHE N N 96 117.183 117.183 124.226 -7.043 25294 7243 1 17 . 1 1 96 96 PHE HA H 96 5.338 5.338 4.938 0.400 25294 7244 1 17 . 1 1 96 96 PHE CA C 96 54.480 54.480 57.919 -3.439 25294 7245 1 17 . 1 1 96 96 PHE CB C 96 38.868 38.868 40.673 -1.805 25294 7246 1 17 . 1 1 97 97 THR N N 97 115.263 115.263 117.494 -2.231 25294 7247 1 17 . 1 1 97 97 THR HA H 97 5.250 5.250 5.115 0.135 25294 7248 1 17 . 1 1 97 97 THR CA C 97 58.178 58.178 61.953 -3.776 25294 7249 1 17 . 1 1 97 97 THR CB C 97 69.068 69.068 70.860 -1.792 25294 7250 1 17 . 1 1 98 98 VAL N N 98 125.442 125.442 123.660 1.782 25294 7251 1 17 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.571 0.286 25294 7252 1 17 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.193 -2.784 25294 7253 1 17 . 1 1 98 98 VAL CB C 98 32.929 32.929 31.766 1.163 25294 7254 1 17 . 1 1 99 99 CYS N N 99 127.111 127.111 125.020 2.091 25294 7255 1 17 . 1 1 99 99 CYS HA H 99 5.346 5.346 4.828 0.518 25294 7256 1 17 . 1 1 99 99 CYS CA C 99 53.951 53.951 57.454 -3.503 25294 7257 1 17 . 1 1 99 99 CYS CB C 99 25.942 25.942 29.010 -3.068 25294 7258 1 17 . 1 1 100 100 VAL N N 100 120.146 120.146 114.695 5.451 25294 7259 1 17 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.132 0.251 25294 7260 1 17 . 1 1 100 100 VAL CA C 100 55.713 55.713 60.044 -4.331 25294 7261 1 17 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.590 -2.947 25294 7262 1 17 . 1 1 101 101 GLU N N 101 118.807 118.807 122.045 -3.238 25294 7263 1 17 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.864 -0.112 25294 7264 1 17 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.683 -3.248 25294 7265 1 17 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.140 -1.419 25294 7266 1 17 . 1 1 102 102 ALA N N 102 124.088 124.088 124.685 -0.597 25294 7267 1 17 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.788 -0.931 25294 7268 1 17 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.703 -2.825 25294 7269 1 17 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.601 -1.576 25294 7270 1 17 . 1 1 103 103 GLY N N 103 111.186 111.186 108.821 2.365 25294 7271 1 17 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.249 -0.606 25294 7272 1 17 . 1 1 104 104 ASN N N 104 123.092 123.092 121.928 1.164 25294 7273 1 17 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.738 -0.066 25294 7274 1 17 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.120 -2.424 25294 7275 1 17 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.009 -2.602 25294 7276 1 17 . 1 1 105 105 ALA N N 105 122.653 122.653 119.249 3.404 25294 7277 1 17 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.038 0.393 25294 7278 1 17 . 1 1 105 105 ALA CA C 105 48.668 48.668 50.978 -2.310 25294 7279 1 17 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.129 -2.193 25294 7280 1 17 . 1 1 106 106 PHE N N 106 116.011 116.011 113.083 2.928 25294 7281 1 17 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.224 0.193 25294 7282 1 17 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.526 -2.968 25294 7283 1 17 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.175 -1.691 25294 7284 1 17 . 1 1 107 107 ASP N N 107 121.992 121.992 120.136 1.856 25294 7285 1 17 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.768 -0.174 25294 7286 1 17 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.642 -3.118 25294 7287 1 17 . 1 1 107 107 ASP CB C 107 43.091 43.091 43.352 -0.261 25294 7288 1 17 . 1 1 108 108 GLU N N 108 119.354 119.354 121.752 -2.398 25294 7289 1 17 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.209 0.800 25294 7290 1 17 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.647 -3.659 25294 7291 1 17 . 1 1 108 108 GLU CB C 108 31.317 31.317 31.367 -0.050 25294 7292 1 17 . 1 1 109 109 PHE N N 109 122.098 122.098 118.447 3.651 25294 7293 1 17 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.937 0.021 25294 7294 1 17 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.001 -3.214 25294 7295 1 17 . 1 1 109 109 PHE CB C 109 40.443 40.443 40.449 -0.006 25294 7296 1 17 . 1 1 110 110 LYS N N 110 124.500 124.500 124.125 0.375 25294 7297 1 17 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.811 -0.119 25294 7298 1 17 . 1 1 110 110 LYS CA C 110 51.891 51.891 56.444 -4.553 25294 7299 1 17 . 1 1 110 110 LYS CB C 110 33.012 33.012 32.758 0.254 25294 7300 1 17 . 1 1 111 111 PHE N N 111 125.010 125.010 123.002 2.008 25294 7301 1 17 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.485 -0.731 25294 7302 1 17 . 1 1 111 111 PHE CA C 111 58.184 58.184 56.765 1.419 25294 7303 1 17 . 1 1 111 111 PHE CB C 111 38.380 38.380 43.521 -5.141 25294 7304 1 17 . 1 1 112 112 VAL N N 112 122.957 122.957 120.451 2.506 25294 7305 1 17 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.653 -0.213 25294 7306 1 17 . 1 1 112 112 VAL CA C 112 58.256 58.256 60.597 -2.341 25294 7307 1 17 . 1 1 112 112 VAL CB C 112 31.093 31.093 34.935 -3.842 25294 7308 1 17 . 1 1 113 113 GLN N N 113 130.864 130.864 129.090 1.774 25294 7309 1 17 . 1 1 113 113 GLN HA H 113 5.319 5.319 5.188 0.131 25294 7310 1 17 . 1 1 113 113 GLN CA C 113 51.119 51.119 53.597 -2.478 25294 7311 1 17 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.055 -3.891 25294 7312 1 17 . 1 1 114 114 ASP N N 114 126.272 126.272 128.531 -2.259 25294 7313 1 17 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.523 -0.196 25294 7314 1 17 . 1 1 114 114 ASP CA C 114 51.773 51.773 56.294 -4.521 25294 7315 1 17 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.615 -2.760 25294 7316 1 17 . 1 1 115 115 ALA N N 115 120.134 120.134 122.629 -2.495 25294 7317 1 17 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.235 -0.536 25294 7318 1 17 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.338 -3.437 25294 7319 1 17 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.868 -2.117 25294 7320 1 17 . 1 1 116 116 ALA N N 116 121.377 121.377 123.398 -2.021 25294 7321 1 17 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.345 -0.392 25294 7322 1 17 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.643 -1.655 25294 7323 1 17 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.160 -2.960 25294 7324 1 17 . 1 1 117 117 LYS N N 117 121.536 121.536 126.630 -5.094 25294 7325 1 17 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.277 -0.138 25294 7326 1 17 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.656 -2.010 25294 7327 1 17 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.148 -0.569 25294 7328 1 18 . 1 1 5 5 SER N N 5 116.267 116.267 114.103 2.164 25294 7329 1 18 . 1 1 5 5 SER HA H 5 4.349 4.349 4.716 -0.367 25294 7330 1 18 . 1 1 5 5 SER CA C 5 55.478 55.478 57.367 -1.889 25294 7331 1 18 . 1 1 5 5 SER CB C 5 61.191 61.191 64.513 -3.322 25294 7332 1 18 . 1 1 6 6 ASP N N 6 123.039 123.039 122.714 0.325 25294 7333 1 18 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.731 0.096 25294 7334 1 18 . 1 1 6 6 ASP CA C 6 49.671 49.671 53.185 -3.514 25294 7335 1 18 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.032 -2.376 25294 7336 1 18 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.399 -0.082 25294 7337 1 18 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.246 -3.099 25294 7338 1 18 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.435 -2.957 25294 7339 1 18 . 1 1 8 8 ASP N N 8 119.159 119.159 114.397 4.762 25294 7340 1 18 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.770 -0.205 25294 7341 1 18 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.183 -2.323 25294 7342 1 18 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.798 -3.073 25294 7343 1 18 . 1 1 9 9 GLY N N 9 108.837 108.837 108.573 0.264 25294 7344 1 18 . 1 1 9 9 GLY CA C 9 43.136 43.136 46.347 -3.211 25294 7345 1 18 . 1 1 10 10 LEU N N 10 121.571 121.571 120.169 1.402 25294 7346 1 18 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.903 -0.636 25294 7347 1 18 . 1 1 10 10 LEU CA C 10 52.391 52.391 52.715 -0.324 25294 7348 1 18 . 1 1 10 10 LEU CB C 10 39.863 39.863 43.864 -4.001 25294 7349 1 18 . 1 1 11 11 ALA N N 11 125.169 125.169 122.477 2.692 25294 7350 1 18 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.555 -0.219 25294 7351 1 18 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.164 -2.180 25294 7352 1 18 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.511 -2.329 25294 7353 1 18 . 1 1 12 12 ASP N N 12 122.672 122.672 125.036 -2.364 25294 7354 1 18 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.880 -0.144 25294 7355 1 18 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.815 -2.113 25294 7356 1 18 . 1 1 12 12 ASP CB C 12 37.831 37.831 41.947 -4.116 25294 7357 1 18 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.382 -0.078 25294 7358 1 18 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.570 -2.970 25294 7359 1 18 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.599 -3.083 25294 7360 1 18 . 1 1 14 14 MET N N 14 120.151 120.151 120.018 0.133 25294 7361 1 18 . 1 1 14 14 MET HA H 14 3.780 3.780 4.522 -0.742 25294 7362 1 18 . 1 1 14 14 MET CA C 14 55.822 55.822 56.162 -0.340 25294 7363 1 18 . 1 1 14 14 MET CB C 14 30.909 30.909 31.922 -1.014 25294 7364 1 18 . 1 1 15 15 LYS N N 15 123.897 123.897 125.822 -1.925 25294 7365 1 18 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.727 -0.270 25294 7366 1 18 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.007 -3.599 25294 7367 1 18 . 1 1 15 15 LYS CB C 15 32.453 32.453 32.837 -0.384 25294 7368 1 18 . 1 1 16 16 TRP N N 16 125.776 125.776 126.678 -0.902 25294 7369 1 18 . 1 1 16 16 TRP HA H 16 5.075 5.075 4.868 0.207 25294 7370 1 18 . 1 1 16 16 TRP CA C 16 53.652 53.652 57.983 -4.331 25294 7371 1 18 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.034 -2.034 25294 7372 1 18 . 1 1 17 17 SER N N 17 120.772 120.772 116.153 4.619 25294 7373 1 18 . 1 1 17 17 SER HA H 17 4.403 4.403 4.622 -0.219 25294 7374 1 18 . 1 1 17 17 SER CA C 17 56.167 56.167 58.987 -2.820 25294 7375 1 18 . 1 1 17 17 SER CB C 17 60.833 60.833 64.361 -3.528 25294 7376 1 18 . 1 1 18 18 LYS N N 18 121.096 121.096 121.224 -0.128 25294 7377 1 18 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.526 0.192 25294 7378 1 18 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.029 -1.294 25294 7379 1 18 . 1 1 18 18 LYS CB C 18 32.917 32.917 33.459 -0.542 25294 7380 1 18 . 1 1 19 19 VAL N N 19 116.358 116.358 116.439 -0.081 25294 7381 1 18 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.004 0.419 25294 7382 1 18 . 1 1 19 19 VAL CA C 19 55.230 55.230 60.157 -4.927 25294 7383 1 18 . 1 1 19 19 VAL CB C 19 31.026 31.026 31.480 -0.454 25294 7384 1 18 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.538 -0.235 25294 7385 1 18 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.140 -2.370 25294 7386 1 18 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.395 -2.842 25294 7387 1 18 . 1 1 21 21 SER N N 21 118.882 118.882 116.700 2.182 25294 7388 1 18 . 1 1 21 21 SER HA H 21 4.084 4.084 4.241 -0.157 25294 7389 1 18 . 1 1 21 21 SER CA C 21 57.657 57.657 59.981 -2.324 25294 7390 1 18 . 1 1 21 21 SER CB C 21 60.173 60.173 63.323 -3.150 25294 7391 1 18 . 1 1 22 22 GLY N N 22 109.523 109.523 108.858 0.665 25294 7392 1 18 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.708 -2.304 25294 7393 1 18 . 1 1 23 23 LEU N N 23 123.003 123.003 119.593 3.410 25294 7394 1 18 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.060 -0.026 25294 7395 1 18 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.665 -2.062 25294 7396 1 18 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.602 -2.531 25294 7397 1 18 . 1 1 24 24 LYS N N 24 129.004 129.004 126.848 2.156 25294 7398 1 18 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.506 0.004 25294 7399 1 18 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.001 -1.764 25294 7400 1 18 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.412 -1.251 25294 7401 1 18 . 1 1 25 25 ASN N N 25 126.336 126.336 122.996 3.340 25294 7402 1 18 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.410 -0.086 25294 7403 1 18 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.685 -2.065 25294 7404 1 18 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.102 -3.117 25294 7405 1 18 . 1 1 26 26 GLY N N 26 103.076 103.076 103.722 -0.646 25294 7406 1 18 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.978 -1.429 25294 7407 1 18 . 1 1 27 27 GLU N N 27 120.878 120.878 122.006 -1.128 25294 7408 1 18 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.018 0.184 25294 7409 1 18 . 1 1 27 27 GLU CA C 27 51.233 51.233 54.310 -3.077 25294 7410 1 18 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.256 -0.495 25294 7411 1 18 . 1 1 28 28 LEU N N 28 128.583 128.583 128.761 -0.178 25294 7412 1 18 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.452 0.103 25294 7413 1 18 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.547 -3.223 25294 7414 1 18 . 1 1 28 28 LEU CB C 28 43.517 43.517 40.283 3.233 25294 7415 1 18 . 1 1 29 29 LYS N N 29 127.554 127.554 126.693 0.861 25294 7416 1 18 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.252 0.649 25294 7417 1 18 . 1 1 29 29 LYS CA C 29 52.839 52.839 56.685 -3.846 25294 7418 1 18 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.829 -3.306 25294 7419 1 18 . 1 1 30 30 VAL N N 30 127.915 127.915 122.439 5.476 25294 7420 1 18 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.390 -0.206 25294 7421 1 18 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.618 -2.310 25294 7422 1 18 . 1 1 30 30 VAL CB C 30 32.270 32.270 36.287 -4.017 25294 7423 1 18 . 1 1 31 31 GLU N N 31 125.151 125.151 124.790 0.361 25294 7424 1 18 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.619 -0.258 25294 7425 1 18 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.289 -1.189 25294 7426 1 18 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.127 -3.424 25294 7427 1 18 . 1 1 32 32 ALA N N 32 126.271 126.271 120.188 6.083 25294 7428 1 18 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.312 -0.296 25294 7429 1 18 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.294 -1.167 25294 7430 1 18 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.507 -3.241 25294 7431 1 18 . 1 1 33 33 GLU N N 33 113.076 113.076 115.872 -2.796 25294 7432 1 18 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.316 -0.351 25294 7433 1 18 . 1 1 33 33 GLU CA C 33 55.985 55.985 55.958 0.027 25294 7434 1 18 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.199 -3.270 25294 7435 1 18 . 1 1 34 34 GLY N N 34 104.905 104.905 109.277 -4.372 25294 7436 1 18 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.169 -4.462 25294 7437 1 18 . 1 1 35 35 GLY N N 35 105.946 105.946 106.146 -0.200 25294 7438 1 18 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.530 -1.542 25294 7439 1 18 . 1 1 36 36 SER N N 36 116.044 116.044 116.006 0.038 25294 7440 1 18 . 1 1 36 36 SER HA H 36 5.539 5.539 5.119 0.420 25294 7441 1 18 . 1 1 36 36 SER CA C 36 54.323 54.323 57.629 -3.306 25294 7442 1 18 . 1 1 36 36 SER CB C 36 62.808 62.808 64.490 -1.681 25294 7443 1 18 . 1 1 37 37 SER N N 37 119.501 119.501 119.523 -0.022 25294 7444 1 18 . 1 1 37 37 SER HA H 37 4.712 4.712 4.840 -0.128 25294 7445 1 18 . 1 1 37 37 SER CA C 37 55.548 55.548 57.391 -1.843 25294 7446 1 18 . 1 1 37 37 SER CB C 37 63.943 63.943 66.811 -2.868 25294 7447 1 18 . 1 1 38 38 LEU N N 38 125.962 125.962 123.155 2.807 25294 7448 1 18 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.980 0.273 25294 7449 1 18 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.210 -2.428 25294 7450 1 18 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.704 -2.870 25294 7451 1 18 . 1 1 39 39 PHE N N 39 124.707 124.707 123.364 1.343 25294 7452 1 18 . 1 1 39 39 PHE HA H 39 5.139 5.139 4.763 0.376 25294 7453 1 18 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.480 -4.349 25294 7454 1 18 . 1 1 39 39 PHE CB C 39 38.952 38.952 40.845 -1.893 25294 7455 1 18 . 1 1 40 40 ALA N N 40 124.994 124.994 127.764 -2.770 25294 7456 1 18 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.066 0.569 25294 7457 1 18 . 1 1 40 40 ALA CA C 40 48.301 48.301 51.222 -2.921 25294 7458 1 18 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.573 -0.127 25294 7459 1 18 . 1 1 41 41 CYS N N 41 125.757 125.757 124.798 0.959 25294 7460 1 18 . 1 1 41 41 CYS HA H 41 4.146 4.146 3.999 0.147 25294 7461 1 18 . 1 1 41 41 CYS CA C 41 56.465 56.465 60.557 -4.092 25294 7462 1 18 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.470 -1.497 25294 7463 1 18 . 1 1 42 42 LYS N N 42 129.019 129.019 125.443 3.576 25294 7464 1 18 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.306 -0.046 25294 7465 1 18 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.813 -2.962 25294 7466 1 18 . 1 1 42 42 LYS CB C 42 32.107 32.107 33.989 -1.882 25294 7467 1 18 . 1 1 43 43 ASN N N 43 113.240 113.240 116.646 -3.406 25294 7468 1 18 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.516 0.009 25294 7469 1 18 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.255 -3.020 25294 7470 1 18 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.155 -4.294 25294 7471 1 18 . 1 1 44 44 TYR N N 44 119.335 119.335 117.500 1.835 25294 7472 1 18 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.652 -0.095 25294 7473 1 18 . 1 1 44 44 TYR CA C 44 55.718 55.718 58.187 -2.469 25294 7474 1 18 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.506 -4.134 25294 7475 1 18 . 1 1 45 45 LYS N N 45 120.676 120.676 121.802 -1.126 25294 7476 1 18 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.897 -0.861 25294 7477 1 18 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.332 -1.794 25294 7478 1 18 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.093 -2.860 25294 7479 1 18 . 1 1 46 46 SER N N 46 108.797 108.797 113.978 -5.181 25294 7480 1 18 . 1 1 46 46 SER HA H 46 4.388 4.388 4.684 -0.296 25294 7481 1 18 . 1 1 46 46 SER CA C 46 53.664 53.664 58.358 -4.694 25294 7482 1 18 . 1 1 46 46 SER CB C 46 61.810 61.810 63.862 -2.052 25294 7483 1 18 . 1 1 47 47 PHE N N 47 117.325 117.325 119.586 -2.261 25294 7484 1 18 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.419 -0.777 25294 7485 1 18 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.972 -3.355 25294 7486 1 18 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.179 -5.078 25294 7487 1 18 . 1 1 48 48 TRP N N 48 117.090 117.090 116.305 0.785 25294 7488 1 18 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.440 -0.205 25294 7489 1 18 . 1 1 48 48 TRP CA C 48 53.492 53.492 54.747 -1.255 25294 7490 1 18 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.642 -1.747 25294 7491 1 18 . 1 1 49 49 ILE N N 49 119.682 119.682 120.782 -1.100 25294 7492 1 18 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.382 -0.351 25294 7493 1 18 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.766 -1.293 25294 7494 1 18 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.978 -0.542 25294 7495 1 18 . 1 1 50 50 SER N N 50 124.071 124.071 122.269 1.802 25294 7496 1 18 . 1 1 50 50 SER HA H 50 4.708 4.708 4.808 -0.100 25294 7497 1 18 . 1 1 50 50 SER CA C 50 56.110 56.110 58.179 -2.069 25294 7498 1 18 . 1 1 50 50 SER CB C 50 63.816 63.816 64.813 -0.997 25294 7499 1 18 . 1 1 51 51 SER N N 51 111.253 111.253 115.957 -4.704 25294 7500 1 18 . 1 1 51 51 SER HA H 51 4.557 4.557 4.384 0.173 25294 7501 1 18 . 1 1 51 51 SER CA C 51 55.564 55.564 57.433 -1.869 25294 7502 1 18 . 1 1 51 51 SER CB C 51 62.821 62.821 66.217 -3.396 25294 7503 1 18 . 1 1 52 52 VAL N N 52 121.147 121.147 123.409 -2.262 25294 7504 1 18 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.867 -0.136 25294 7505 1 18 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.794 -0.668 25294 7506 1 18 . 1 1 52 52 VAL CB C 52 32.500 32.500 34.562 -2.062 25294 7507 1 18 . 1 1 53 53 LYS N N 53 126.128 126.128 125.723 0.405 25294 7508 1 18 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.842 0.165 25294 7509 1 18 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.429 -2.706 25294 7510 1 18 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.982 -2.210 25294 7511 1 18 . 1 1 54 54 GLU N N 54 124.160 124.160 117.812 6.348 25294 7512 1 18 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.891 0.867 25294 7513 1 18 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.824 -2.565 25294 7514 1 18 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.724 -0.666 25294 7515 1 18 . 1 1 55 55 GLU N N 55 127.218 127.218 119.069 8.149 25294 7516 1 18 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.491 -0.583 25294 7517 1 18 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.140 -1.594 25294 7518 1 18 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.791 -5.497 25294 7519 1 18 . 1 1 56 56 GLY N N 56 104.894 104.894 108.604 -3.710 25294 7520 1 18 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.447 -3.566 25294 7521 1 18 . 1 1 57 57 LYS N N 57 120.444 120.444 118.582 1.862 25294 7522 1 18 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.842 -0.278 25294 7523 1 18 . 1 1 57 57 LYS CA C 57 51.959 51.959 53.826 -1.867 25294 7524 1 18 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.895 -2.707 25294 7525 1 18 . 1 1 58 58 PHE N N 58 121.824 121.824 121.620 0.204 25294 7526 1 18 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.017 -0.246 25294 7527 1 18 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.895 -0.730 25294 7528 1 18 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.266 -3.364 25294 7529 1 18 . 1 1 59 59 LYS N N 59 123.205 123.205 123.131 0.074 25294 7530 1 18 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.716 -0.265 25294 7531 1 18 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.936 -3.951 25294 7532 1 18 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.343 -4.551 25294 7533 1 18 . 1 1 60 60 GLU N N 60 122.647 122.647 118.613 4.034 25294 7534 1 18 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.298 -0.038 25294 7535 1 18 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.762 -1.856 25294 7536 1 18 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.484 -2.821 25294 7537 1 18 . 1 1 61 61 ASN N N 61 119.907 119.907 118.700 1.207 25294 7538 1 18 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.983 -0.138 25294 7539 1 18 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.252 -2.500 25294 7540 1 18 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.366 -3.343 25294 7541 1 18 . 1 1 62 62 THR N N 62 113.271 113.271 117.224 -3.953 25294 7542 1 18 . 1 1 62 62 THR HA H 62 4.308 4.308 4.285 0.023 25294 7543 1 18 . 1 1 62 62 THR CA C 62 59.310 59.310 62.752 -3.442 25294 7544 1 18 . 1 1 62 62 THR CB C 62 66.813 66.813 69.050 -2.237 25294 7545 1 18 . 1 1 63 63 SER N N 63 116.521 116.521 113.473 3.048 25294 7546 1 18 . 1 1 63 63 SER HA H 63 4.650 4.650 4.586 0.064 25294 7547 1 18 . 1 1 63 63 SER CA C 63 54.094 54.094 57.332 -3.238 25294 7548 1 18 . 1 1 63 63 SER CB C 63 61.617 61.617 64.598 -2.981 25294 7549 1 18 . 1 1 64 64 TYR N N 64 120.183 120.183 117.616 2.567 25294 7550 1 18 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.849 -0.011 25294 7551 1 18 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.200 -1.797 25294 7552 1 18 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.867 -3.299 25294 7553 1 18 . 1 1 65 65 LYS N N 65 115.195 115.195 115.590 -0.395 25294 7554 1 18 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.652 0.069 25294 7555 1 18 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.341 -3.635 25294 7556 1 18 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.977 -3.157 25294 7557 1 18 . 1 1 66 66 GLU N N 66 117.231 117.231 120.335 -3.104 25294 7558 1 18 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.128 0.085 25294 7559 1 18 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.308 -2.695 25294 7560 1 18 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.320 -2.527 25294 7561 1 18 . 1 1 67 67 PHE N N 67 121.532 121.532 120.760 0.772 25294 7562 1 18 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.811 -0.381 25294 7563 1 18 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.542 -1.273 25294 7564 1 18 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.792 -2.517 25294 7565 1 18 . 1 1 68 68 ASP N N 68 128.157 128.157 125.388 2.769 25294 7566 1 18 . 1 1 68 68 ASP HA H 68 4.428 4.428 5.020 -0.592 25294 7567 1 18 . 1 1 68 68 ASP CA C 68 49.556 49.556 51.996 -2.440 25294 7568 1 18 . 1 1 68 68 ASP CB C 68 38.424 38.424 40.336 -1.912 25294 7569 1 18 . 1 1 69 69 GLY N N 69 114.151 114.151 110.423 3.728 25294 7570 1 18 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.119 -3.220 25294 7571 1 18 . 1 1 70 70 GLY N N 70 113.714 113.714 110.851 2.863 25294 7572 1 18 . 1 1 70 70 GLY CA C 70 43.994 43.994 46.223 -2.229 25294 7573 1 18 . 1 1 71 71 TRP N N 71 117.823 117.823 117.217 0.606 25294 7574 1 18 . 1 1 71 71 TRP HA H 71 4.808 4.808 5.245 -0.437 25294 7575 1 18 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.225 -2.448 25294 7576 1 18 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.925 -5.280 25294 7577 1 18 . 1 1 72 72 TYR N N 72 114.204 114.204 121.300 -7.096 25294 7578 1 18 . 1 1 72 72 TYR HA H 72 5.125 5.125 5.009 0.116 25294 7579 1 18 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.286 -5.851 25294 7580 1 18 . 1 1 72 72 TYR CB C 72 38.620 38.620 41.222 -2.602 25294 7581 1 18 . 1 1 73 73 LEU N N 73 121.469 121.469 125.625 -4.156 25294 7582 1 18 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.303 -0.536 25294 7583 1 18 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.168 -1.836 25294 7584 1 18 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.474 -3.071 25294 7585 1 18 . 1 1 74 74 VAL N N 74 124.558 124.558 124.137 0.421 25294 7586 1 18 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.836 -0.053 25294 7587 1 18 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.343 -2.531 25294 7588 1 18 . 1 1 74 74 VAL CB C 74 31.820 31.820 35.002 -3.182 25294 7589 1 18 . 1 1 75 75 LYS N N 75 125.824 125.824 125.105 0.719 25294 7590 1 18 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.261 -0.151 25294 7591 1 18 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.341 -2.537 25294 7592 1 18 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.152 -2.577 25294 7593 1 18 . 1 1 76 76 ILE N N 76 124.647 124.647 124.880 -0.233 25294 7594 1 18 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.434 0.644 25294 7595 1 18 . 1 1 76 76 ILE CA C 76 57.367 57.367 61.386 -4.019 25294 7596 1 18 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.250 -1.657 25294 7597 1 18 . 1 1 77 77 GLU N N 77 128.081 128.081 123.646 4.435 25294 7598 1 18 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.523 -0.079 25294 7599 1 18 . 1 1 77 77 GLU CA C 77 52.471 52.471 54.967 -2.495 25294 7600 1 18 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.682 -1.768 25294 7601 1 18 . 1 1 78 78 ASP N N 78 126.158 126.158 119.168 6.990 25294 7602 1 18 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.339 -0.239 25294 7603 1 18 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.297 -3.234 25294 7604 1 18 . 1 1 78 78 ASP CB C 78 36.738 36.738 41.178 -4.440 25294 7605 1 18 . 1 1 79 79 ASN N N 79 118.653 118.653 110.665 7.988 25294 7606 1 18 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.903 -0.257 25294 7607 1 18 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.112 -1.903 25294 7608 1 18 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.427 -5.077 25294 7609 1 18 . 1 1 80 80 GLU N N 80 120.378 120.378 121.769 -1.391 25294 7610 1 18 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.125 0.384 25294 7611 1 18 . 1 1 80 80 GLU CA C 80 52.860 52.860 56.287 -3.427 25294 7612 1 18 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.993 -1.320 25294 7613 1 18 . 1 1 81 81 LEU N N 81 125.771 125.771 127.367 -1.596 25294 7614 1 18 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.476 -0.510 25294 7615 1 18 . 1 1 81 81 LEU CA C 81 51.014 51.014 53.473 -2.459 25294 7616 1 18 . 1 1 81 81 LEU CB C 81 42.550 42.550 44.824 -2.274 25294 7617 1 18 . 1 1 82 82 LYS N N 82 128.076 128.076 125.962 2.114 25294 7618 1 18 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.326 -0.081 25294 7619 1 18 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.768 -2.436 25294 7620 1 18 . 1 1 82 82 LYS CB C 82 32.179 32.179 35.839 -3.660 25294 7621 1 18 . 1 1 83 83 VAL N N 83 124.216 124.216 122.307 1.909 25294 7622 1 18 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.119 -0.211 25294 7623 1 18 . 1 1 83 83 VAL CA C 83 58.380 58.380 59.676 -1.296 25294 7624 1 18 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.124 -2.956 25294 7625 1 18 . 1 1 84 84 ILE N N 84 129.084 129.084 128.750 0.334 25294 7626 1 18 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.529 0.001 25294 7627 1 18 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.808 -1.402 25294 7628 1 18 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.202 -3.036 25294 7629 1 18 . 1 1 85 85 ILE N N 85 127.360 127.360 122.616 4.744 25294 7630 1 18 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.569 0.016 25294 7631 1 18 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.586 -1.126 25294 7632 1 18 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.418 -1.920 25294 7633 1 18 . 1 1 86 86 ASN N N 86 128.337 128.337 125.530 2.807 25294 7634 1 18 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.745 0.021 25294 7635 1 18 . 1 1 86 86 ASN CA C 86 50.182 50.182 53.384 -3.202 25294 7636 1 18 . 1 1 86 86 ASN CB C 86 36.891 36.891 39.421 -2.530 25294 7637 1 18 . 1 1 87 87 ARG N N 87 119.368 119.368 120.677 -1.309 25294 7638 1 18 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.192 -0.201 25294 7639 1 18 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.915 -2.717 25294 7640 1 18 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.669 -2.266 25294 7641 1 18 . 1 1 88 88 ASN N N 88 125.082 125.082 123.949 1.133 25294 7642 1 18 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.537 0.188 25294 7643 1 18 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.332 -4.229 25294 7644 1 18 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.751 -3.994 25294 7645 1 18 . 1 1 89 89 GLU N N 89 125.309 125.309 122.988 2.321 25294 7646 1 18 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.391 -0.033 25294 7647 1 18 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.377 -3.364 25294 7648 1 18 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.366 -2.281 25294 7649 1 18 . 1 1 90 90 THR N N 90 112.516 112.516 112.906 -0.390 25294 7650 1 18 . 1 1 90 90 THR HA H 90 4.534 4.534 4.640 -0.106 25294 7651 1 18 . 1 1 90 90 THR CA C 90 58.161 58.161 59.581 -1.420 25294 7652 1 18 . 1 1 90 90 THR CB C 90 68.409 68.409 72.359 -3.950 25294 7653 1 18 . 1 1 91 91 ASN N N 91 116.717 116.717 118.142 -1.425 25294 7654 1 18 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.747 -0.040 25294 7655 1 18 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.515 -3.719 25294 7656 1 18 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.327 -2.853 25294 7657 1 18 . 1 1 92 92 ALA N N 92 122.025 122.025 122.305 -0.280 25294 7658 1 18 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.552 0.084 25294 7659 1 18 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.419 -2.370 25294 7660 1 18 . 1 1 92 92 ALA CB C 92 19.716 19.716 21.285 -1.569 25294 7661 1 18 . 1 1 93 93 SER N N 93 115.895 115.895 118.301 -2.406 25294 7662 1 18 . 1 1 93 93 SER HA H 93 4.536 4.536 5.071 -0.535 25294 7663 1 18 . 1 1 93 93 SER CA C 93 54.865 54.865 57.985 -3.120 25294 7664 1 18 . 1 1 93 93 SER CB C 93 61.292 61.292 64.689 -3.397 25294 7665 1 18 . 1 1 94 94 ARG N N 94 119.529 119.529 119.894 -0.365 25294 7666 1 18 . 1 1 94 94 ARG HA H 94 4.914 4.914 5.016 -0.102 25294 7667 1 18 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.651 -2.555 25294 7668 1 18 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.040 -3.528 25294 7669 1 18 . 1 1 95 95 SER N N 95 114.542 114.542 113.400 1.142 25294 7670 1 18 . 1 1 95 95 SER HA H 95 5.926 5.926 5.121 0.805 25294 7671 1 18 . 1 1 95 95 SER CA C 95 54.219 54.219 57.766 -3.547 25294 7672 1 18 . 1 1 95 95 SER CB C 95 65.271 65.271 66.183 -0.912 25294 7673 1 18 . 1 1 96 96 PHE N N 96 117.183 117.183 119.213 -2.030 25294 7674 1 18 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.153 0.185 25294 7675 1 18 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.605 -2.125 25294 7676 1 18 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.943 -5.075 25294 7677 1 18 . 1 1 97 97 THR N N 97 115.263 115.263 117.687 -2.424 25294 7678 1 18 . 1 1 97 97 THR HA H 97 5.250 5.250 5.073 0.177 25294 7679 1 18 . 1 1 97 97 THR CA C 97 58.178 58.178 61.905 -3.727 25294 7680 1 18 . 1 1 97 97 THR CB C 97 69.068 69.068 71.740 -2.672 25294 7681 1 18 . 1 1 98 98 VAL N N 98 125.442 125.442 126.434 -0.992 25294 7682 1 18 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.604 0.253 25294 7683 1 18 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.829 -3.420 25294 7684 1 18 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.651 -1.722 25294 7685 1 18 . 1 1 99 99 CYS N N 99 127.111 127.111 126.758 0.353 25294 7686 1 18 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.488 -0.142 25294 7687 1 18 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.008 -2.058 25294 7688 1 18 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.983 -5.041 25294 7689 1 18 . 1 1 100 100 VAL N N 100 120.146 120.146 120.230 -0.084 25294 7690 1 18 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.160 0.223 25294 7691 1 18 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.155 -3.442 25294 7692 1 18 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.423 -2.780 25294 7693 1 18 . 1 1 101 101 GLU N N 101 118.807 118.807 119.953 -1.146 25294 7694 1 18 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.704 0.048 25294 7695 1 18 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.954 -2.519 25294 7696 1 18 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.598 -1.877 25294 7697 1 18 . 1 1 102 102 ALA N N 102 124.088 124.088 126.719 -2.631 25294 7698 1 18 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.969 -1.112 25294 7699 1 18 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.300 -2.422 25294 7700 1 18 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.352 -1.327 25294 7701 1 18 . 1 1 103 103 GLY N N 103 111.186 111.186 109.404 1.782 25294 7702 1 18 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.821 -2.178 25294 7703 1 18 . 1 1 104 104 ASN N N 104 123.092 123.092 122.307 0.785 25294 7704 1 18 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.850 -0.178 25294 7705 1 18 . 1 1 104 104 ASN CA C 104 50.696 50.696 52.996 -2.300 25294 7706 1 18 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.382 -2.975 25294 7707 1 18 . 1 1 105 105 ALA N N 105 122.653 122.653 119.022 3.631 25294 7708 1 18 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.359 0.072 25294 7709 1 18 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.385 -2.717 25294 7710 1 18 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.147 -1.211 25294 7711 1 18 . 1 1 106 106 PHE N N 106 116.011 116.011 113.120 2.891 25294 7712 1 18 . 1 1 106 106 PHE HA H 106 5.417 5.417 4.750 0.667 25294 7713 1 18 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.764 -3.206 25294 7714 1 18 . 1 1 106 106 PHE CB C 106 40.484 40.484 41.861 -1.377 25294 7715 1 18 . 1 1 107 107 ASP N N 107 121.992 121.992 119.670 2.322 25294 7716 1 18 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.719 -0.125 25294 7717 1 18 . 1 1 107 107 ASP CA C 107 50.524 50.524 52.681 -2.157 25294 7718 1 18 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.784 -1.693 25294 7719 1 18 . 1 1 108 108 GLU N N 108 119.354 119.354 122.316 -2.962 25294 7720 1 18 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.834 0.175 25294 7721 1 18 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.904 -2.916 25294 7722 1 18 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.793 -1.476 25294 7723 1 18 . 1 1 109 109 PHE N N 109 122.098 122.098 124.680 -2.582 25294 7724 1 18 . 1 1 109 109 PHE HA H 109 4.958 4.958 5.038 -0.080 25294 7725 1 18 . 1 1 109 109 PHE CA C 109 52.787 52.787 55.605 -2.818 25294 7726 1 18 . 1 1 109 109 PHE CB C 109 40.443 40.443 40.813 -0.370 25294 7727 1 18 . 1 1 110 110 LYS N N 110 124.500 124.500 123.700 0.800 25294 7728 1 18 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.843 -0.151 25294 7729 1 18 . 1 1 110 110 LYS CA C 110 51.891 51.891 56.550 -4.659 25294 7730 1 18 . 1 1 110 110 LYS CB C 110 33.012 33.012 33.385 -0.373 25294 7731 1 18 . 1 1 111 111 PHE N N 111 125.010 125.010 120.635 4.375 25294 7732 1 18 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.646 -0.892 25294 7733 1 18 . 1 1 111 111 PHE CA C 111 58.184 58.184 56.454 1.730 25294 7734 1 18 . 1 1 111 111 PHE CB C 111 38.380 38.380 43.416 -5.036 25294 7735 1 18 . 1 1 112 112 VAL N N 112 122.957 122.957 115.834 7.123 25294 7736 1 18 . 1 1 112 112 VAL HA H 112 4.440 4.440 5.031 -0.591 25294 7737 1 18 . 1 1 112 112 VAL CA C 112 58.256 58.256 59.446 -1.190 25294 7738 1 18 . 1 1 112 112 VAL CB C 112 31.093 31.093 33.909 -2.816 25294 7739 1 18 . 1 1 113 113 GLN N N 113 130.864 130.864 120.945 9.919 25294 7740 1 18 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.939 0.380 25294 7741 1 18 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.531 -3.412 25294 7742 1 18 . 1 1 113 113 GLN CB C 113 28.164 28.164 33.232 -5.068 25294 7743 1 18 . 1 1 114 114 ASP N N 114 126.272 126.272 126.966 -0.694 25294 7744 1 18 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.611 -0.284 25294 7745 1 18 . 1 1 114 114 ASP CA C 114 51.773 51.773 55.648 -3.874 25294 7746 1 18 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.544 -2.689 25294 7747 1 18 . 1 1 115 115 ALA N N 115 120.134 120.134 121.551 -1.417 25294 7748 1 18 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.236 -0.537 25294 7749 1 18 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.138 -3.237 25294 7750 1 18 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.927 -2.176 25294 7751 1 18 . 1 1 116 116 ALA N N 116 121.377 121.377 124.751 -3.374 25294 7752 1 18 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.317 -0.364 25294 7753 1 18 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.465 -1.477 25294 7754 1 18 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.168 -2.968 25294 7755 1 18 . 1 1 117 117 LYS N N 117 121.536 121.536 126.475 -4.939 25294 7756 1 18 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.260 -0.121 25294 7757 1 18 . 1 1 117 117 LYS CA C 117 53.646 53.646 56.263 -2.617 25294 7758 1 18 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.519 -0.940 25294 7759 1 19 . 1 1 5 5 SER N N 5 116.267 116.267 113.957 2.310 25294 7760 1 19 . 1 1 5 5 SER HA H 5 4.349 4.349 4.712 -0.363 25294 7761 1 19 . 1 1 5 5 SER CA C 5 55.478 55.478 57.635 -2.156 25294 7762 1 19 . 1 1 5 5 SER CB C 5 61.191 61.191 65.227 -4.036 25294 7763 1 19 . 1 1 6 6 ASP N N 6 123.039 123.039 123.345 -0.306 25294 7764 1 19 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.722 0.105 25294 7765 1 19 . 1 1 6 6 ASP CA C 6 49.671 49.671 53.292 -3.622 25294 7766 1 19 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.005 -2.349 25294 7767 1 19 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.373 -0.056 25294 7768 1 19 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.124 -2.977 25294 7769 1 19 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.507 -3.029 25294 7770 1 19 . 1 1 8 8 ASP N N 8 119.159 119.159 115.809 3.350 25294 7771 1 19 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.647 -0.082 25294 7772 1 19 . 1 1 8 8 ASP CA C 8 51.860 51.860 53.941 -2.082 25294 7773 1 19 . 1 1 8 8 ASP CB C 8 38.725 38.725 40.911 -2.187 25294 7774 1 19 . 1 1 9 9 GLY N N 9 108.837 108.837 108.148 0.689 25294 7775 1 19 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.571 -2.435 25294 7776 1 19 . 1 1 10 10 LEU N N 10 121.571 121.571 118.690 2.881 25294 7777 1 19 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.447 -0.180 25294 7778 1 19 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.590 -2.199 25294 7779 1 19 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.632 -2.769 25294 7780 1 19 . 1 1 11 11 ALA N N 11 125.169 125.169 121.642 3.527 25294 7781 1 19 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.532 -0.196 25294 7782 1 19 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.310 -2.326 25294 7783 1 19 . 1 1 11 11 ALA CB C 11 17.182 17.182 20.518 -3.336 25294 7784 1 19 . 1 1 12 12 ASP N N 12 122.672 122.672 120.665 2.007 25294 7785 1 19 . 1 1 12 12 ASP HA H 12 4.736 4.736 5.129 -0.393 25294 7786 1 19 . 1 1 12 12 ASP CA C 12 49.702 49.702 51.802 -2.100 25294 7787 1 19 . 1 1 12 12 ASP CB C 12 37.831 37.831 43.494 -5.663 25294 7788 1 19 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.458 -0.154 25294 7789 1 19 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.711 -3.111 25294 7790 1 19 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.608 -3.092 25294 7791 1 19 . 1 1 14 14 MET N N 14 120.151 120.151 116.030 4.121 25294 7792 1 19 . 1 1 14 14 MET HA H 14 3.780 3.780 4.698 -0.918 25294 7793 1 19 . 1 1 14 14 MET CA C 14 55.822 55.822 55.197 0.625 25294 7794 1 19 . 1 1 14 14 MET CB C 14 30.909 30.909 31.536 -0.627 25294 7795 1 19 . 1 1 15 15 LYS N N 15 123.897 123.897 122.370 1.527 25294 7796 1 19 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.430 0.027 25294 7797 1 19 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.920 -4.513 25294 7798 1 19 . 1 1 15 15 LYS CB C 15 32.453 32.453 33.739 -1.286 25294 7799 1 19 . 1 1 16 16 TRP N N 16 125.776 125.776 124.414 1.362 25294 7800 1 19 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.408 -0.333 25294 7801 1 19 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.268 -2.616 25294 7802 1 19 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.642 -2.642 25294 7803 1 19 . 1 1 17 17 SER N N 17 120.772 120.772 119.049 1.723 25294 7804 1 19 . 1 1 17 17 SER HA H 17 4.403 4.403 4.576 -0.173 25294 7805 1 19 . 1 1 17 17 SER CA C 17 56.167 56.167 58.438 -2.271 25294 7806 1 19 . 1 1 17 17 SER CB C 17 60.833 60.833 63.307 -2.474 25294 7807 1 19 . 1 1 18 18 LYS N N 18 121.096 121.096 120.022 1.074 25294 7808 1 19 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.589 0.129 25294 7809 1 19 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.260 -1.525 25294 7810 1 19 . 1 1 18 18 LYS CB C 18 32.917 32.917 35.780 -2.863 25294 7811 1 19 . 1 1 19 19 VAL N N 19 116.358 116.358 118.862 -2.504 25294 7812 1 19 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.575 -0.152 25294 7813 1 19 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.392 -3.162 25294 7814 1 19 . 1 1 19 19 VAL CB C 19 31.026 31.026 32.894 -1.868 25294 7815 1 19 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.464 -0.161 25294 7816 1 19 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.440 -2.670 25294 7817 1 19 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.463 -2.910 25294 7818 1 19 . 1 1 21 21 SER N N 21 118.882 118.882 116.660 2.222 25294 7819 1 19 . 1 1 21 21 SER HA H 21 4.084 4.084 4.251 -0.167 25294 7820 1 19 . 1 1 21 21 SER CA C 21 57.657 57.657 60.252 -2.595 25294 7821 1 19 . 1 1 21 21 SER CB C 21 60.173 60.173 63.397 -3.224 25294 7822 1 19 . 1 1 22 22 GLY N N 22 109.523 109.523 108.782 0.741 25294 7823 1 19 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.659 -2.255 25294 7824 1 19 . 1 1 23 23 LEU N N 23 123.003 123.003 121.928 1.075 25294 7825 1 19 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.283 -0.249 25294 7826 1 19 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.639 -2.036 25294 7827 1 19 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.237 -2.166 25294 7828 1 19 . 1 1 24 24 LYS N N 24 129.004 129.004 128.579 0.425 25294 7829 1 19 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.522 -0.012 25294 7830 1 19 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.575 -2.338 25294 7831 1 19 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.750 -1.589 25294 7832 1 19 . 1 1 25 25 ASN N N 25 126.336 126.336 124.247 2.089 25294 7833 1 19 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.444 -0.120 25294 7834 1 19 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.510 -1.890 25294 7835 1 19 . 1 1 25 25 ASN CB C 25 34.985 34.985 37.962 -2.977 25294 7836 1 19 . 1 1 26 26 GLY N N 26 103.076 103.076 102.537 0.539 25294 7837 1 19 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.849 -1.300 25294 7838 1 19 . 1 1 27 27 GLU N N 27 120.878 120.878 121.873 -0.995 25294 7839 1 19 . 1 1 27 27 GLU HA H 27 5.202 5.202 5.043 0.159 25294 7840 1 19 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.791 -4.558 25294 7841 1 19 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.827 -1.066 25294 7842 1 19 . 1 1 28 28 LEU N N 28 128.583 128.583 122.771 5.812 25294 7843 1 19 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.810 -0.255 25294 7844 1 19 . 1 1 28 28 LEU CA C 28 50.324 50.324 54.470 -4.146 25294 7845 1 19 . 1 1 28 28 LEU CB C 28 43.517 43.517 45.125 -1.608 25294 7846 1 19 . 1 1 29 29 LYS N N 29 127.554 127.554 124.851 2.703 25294 7847 1 19 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.545 0.356 25294 7848 1 19 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.914 -3.075 25294 7849 1 19 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.875 -3.352 25294 7850 1 19 . 1 1 30 30 VAL N N 30 127.915 127.915 124.526 3.389 25294 7851 1 19 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.506 -0.322 25294 7852 1 19 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.308 -2.000 25294 7853 1 19 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.410 -3.140 25294 7854 1 19 . 1 1 31 31 GLU N N 31 125.151 125.151 124.421 0.730 25294 7855 1 19 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.703 -0.342 25294 7856 1 19 . 1 1 31 31 GLU CA C 31 54.100 54.100 54.591 -0.491 25294 7857 1 19 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.876 -4.173 25294 7858 1 19 . 1 1 32 32 ALA N N 32 126.271 126.271 122.475 3.796 25294 7859 1 19 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.227 -0.211 25294 7860 1 19 . 1 1 32 32 ALA CA C 32 53.127 53.127 52.722 0.405 25294 7861 1 19 . 1 1 32 32 ALA CB C 32 15.266 15.266 17.044 -1.778 25294 7862 1 19 . 1 1 33 33 GLU N N 33 113.076 113.076 115.492 -2.416 25294 7863 1 19 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.462 -0.497 25294 7864 1 19 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.075 -0.090 25294 7865 1 19 . 1 1 33 33 GLU CB C 33 26.929 26.929 32.501 -5.572 25294 7866 1 19 . 1 1 34 34 GLY N N 34 104.905 104.905 109.058 -4.153 25294 7867 1 19 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.113 -4.406 25294 7868 1 19 . 1 1 35 35 GLY N N 35 105.946 105.946 104.690 1.256 25294 7869 1 19 . 1 1 35 35 GLY CA C 35 42.988 42.988 45.072 -2.084 25294 7870 1 19 . 1 1 36 36 SER N N 36 116.044 116.044 114.099 1.945 25294 7871 1 19 . 1 1 36 36 SER HA H 36 5.539 5.539 5.430 0.109 25294 7872 1 19 . 1 1 36 36 SER CA C 36 54.323 54.323 56.912 -2.589 25294 7873 1 19 . 1 1 36 36 SER CB C 36 62.808 62.808 66.411 -3.603 25294 7874 1 19 . 1 1 37 37 SER N N 37 119.501 119.501 116.629 2.872 25294 7875 1 19 . 1 1 37 37 SER HA H 37 4.712 4.712 4.721 -0.009 25294 7876 1 19 . 1 1 37 37 SER CA C 37 55.548 55.548 57.672 -2.124 25294 7877 1 19 . 1 1 37 37 SER CB C 37 63.943 63.943 65.557 -1.614 25294 7878 1 19 . 1 1 38 38 LEU N N 38 125.962 125.962 121.865 4.097 25294 7879 1 19 . 1 1 38 38 LEU HA H 38 5.253 5.253 5.058 0.195 25294 7880 1 19 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.790 -3.008 25294 7881 1 19 . 1 1 38 38 LEU CB C 38 42.834 42.834 46.021 -3.187 25294 7882 1 19 . 1 1 39 39 PHE N N 39 124.707 124.707 122.889 1.818 25294 7883 1 19 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.258 -0.119 25294 7884 1 19 . 1 1 39 39 PHE CA C 39 52.131 52.131 55.841 -3.710 25294 7885 1 19 . 1 1 39 39 PHE CB C 39 38.952 38.952 42.315 -3.363 25294 7886 1 19 . 1 1 40 40 ALA N N 40 124.994 124.994 127.495 -2.501 25294 7887 1 19 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.324 0.311 25294 7888 1 19 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.117 -1.816 25294 7889 1 19 . 1 1 40 40 ALA CB C 40 19.446 19.446 20.134 -0.688 25294 7890 1 19 . 1 1 41 41 CYS N N 41 125.757 125.757 124.297 1.460 25294 7891 1 19 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.315 -0.169 25294 7892 1 19 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.714 -3.249 25294 7893 1 19 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.903 -1.930 25294 7894 1 19 . 1 1 42 42 LYS N N 42 129.019 129.019 127.188 1.831 25294 7895 1 19 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.519 -0.259 25294 7896 1 19 . 1 1 42 42 LYS CA C 42 54.851 54.851 56.174 -1.323 25294 7897 1 19 . 1 1 42 42 LYS CB C 42 32.107 32.107 33.099 -0.992 25294 7898 1 19 . 1 1 43 43 ASN N N 43 113.240 113.240 115.101 -1.861 25294 7899 1 19 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.619 -0.094 25294 7900 1 19 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.102 -2.867 25294 7901 1 19 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.461 -4.600 25294 7902 1 19 . 1 1 44 44 TYR N N 44 119.335 119.335 119.755 -0.420 25294 7903 1 19 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.558 -0.001 25294 7904 1 19 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.917 -2.199 25294 7905 1 19 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.790 -4.418 25294 7906 1 19 . 1 1 45 45 LYS N N 45 120.676 120.676 122.016 -1.340 25294 7907 1 19 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.684 -0.648 25294 7908 1 19 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.032 -1.494 25294 7909 1 19 . 1 1 45 45 LYS CB C 45 30.233 30.233 32.864 -2.631 25294 7910 1 19 . 1 1 46 46 SER N N 46 108.797 108.797 114.713 -5.916 25294 7911 1 19 . 1 1 46 46 SER HA H 46 4.388 4.388 4.662 -0.274 25294 7912 1 19 . 1 1 46 46 SER CA C 46 53.664 53.664 58.245 -4.581 25294 7913 1 19 . 1 1 46 46 SER CB C 46 61.810 61.810 63.961 -2.151 25294 7914 1 19 . 1 1 47 47 PHE N N 47 117.325 117.325 119.635 -2.310 25294 7915 1 19 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.391 -0.749 25294 7916 1 19 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.837 -3.220 25294 7917 1 19 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.373 -5.271 25294 7918 1 19 . 1 1 48 48 TRP N N 48 117.090 117.090 118.259 -1.169 25294 7919 1 19 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.432 -0.197 25294 7920 1 19 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.082 -1.590 25294 7921 1 19 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.516 -1.621 25294 7922 1 19 . 1 1 49 49 ILE N N 49 119.682 119.682 120.781 -1.099 25294 7923 1 19 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.162 -0.131 25294 7924 1 19 . 1 1 49 49 ILE CA C 49 60.473 60.473 62.109 -1.636 25294 7925 1 19 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.502 -0.066 25294 7926 1 19 . 1 1 50 50 SER N N 50 124.071 124.071 121.872 2.199 25294 7927 1 19 . 1 1 50 50 SER HA H 50 4.708 4.708 4.772 -0.064 25294 7928 1 19 . 1 1 50 50 SER CA C 50 56.110 56.110 58.002 -1.892 25294 7929 1 19 . 1 1 50 50 SER CB C 50 63.816 63.816 65.446 -1.630 25294 7930 1 19 . 1 1 51 51 SER N N 51 111.253 111.253 115.507 -4.254 25294 7931 1 19 . 1 1 51 51 SER HA H 51 4.557 4.557 4.856 -0.299 25294 7932 1 19 . 1 1 51 51 SER CA C 51 55.564 55.564 57.304 -1.740 25294 7933 1 19 . 1 1 51 51 SER CB C 51 62.821 62.821 66.791 -3.970 25294 7934 1 19 . 1 1 52 52 VAL N N 52 121.147 121.147 121.525 -0.378 25294 7935 1 19 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.729 0.002 25294 7936 1 19 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.680 -0.554 25294 7937 1 19 . 1 1 52 52 VAL CB C 52 32.500 32.500 34.925 -2.425 25294 7938 1 19 . 1 1 53 53 LYS N N 53 126.128 126.128 124.932 1.196 25294 7939 1 19 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.923 0.084 25294 7940 1 19 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.257 -2.534 25294 7941 1 19 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.415 -1.643 25294 7942 1 19 . 1 1 54 54 GLU N N 54 124.160 124.160 122.281 1.879 25294 7943 1 19 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.995 0.763 25294 7944 1 19 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.594 -2.335 25294 7945 1 19 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.807 -0.748 25294 7946 1 19 . 1 1 55 55 GLU N N 55 127.218 127.218 119.010 8.208 25294 7947 1 19 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.447 -0.539 25294 7948 1 19 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.493 -1.947 25294 7949 1 19 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.192 -4.898 25294 7950 1 19 . 1 1 56 56 GLY N N 56 104.894 104.894 108.345 -3.451 25294 7951 1 19 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.584 -3.703 25294 7952 1 19 . 1 1 57 57 LYS N N 57 120.444 120.444 118.121 2.323 25294 7953 1 19 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.699 -0.135 25294 7954 1 19 . 1 1 57 57 LYS CA C 57 51.959 51.959 53.839 -1.880 25294 7955 1 19 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.870 -2.682 25294 7956 1 19 . 1 1 58 58 PHE N N 58 121.824 121.824 120.087 1.737 25294 7957 1 19 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.143 -0.372 25294 7958 1 19 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.093 0.072 25294 7959 1 19 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.139 -3.237 25294 7960 1 19 . 1 1 59 59 LYS N N 59 123.205 123.205 120.350 2.855 25294 7961 1 19 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.827 -0.376 25294 7962 1 19 . 1 1 59 59 LYS CA C 59 50.985 50.985 54.923 -3.938 25294 7963 1 19 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.292 -4.501 25294 7964 1 19 . 1 1 60 60 GLU N N 60 122.647 122.647 119.107 3.540 25294 7965 1 19 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.097 0.163 25294 7966 1 19 . 1 1 60 60 GLU CA C 60 53.906 53.906 56.623 -2.716 25294 7967 1 19 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.172 -2.509 25294 7968 1 19 . 1 1 61 61 ASN N N 61 119.907 119.907 116.866 3.041 25294 7969 1 19 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.817 0.028 25294 7970 1 19 . 1 1 61 61 ASN CA C 61 50.752 50.752 52.739 -1.987 25294 7971 1 19 . 1 1 61 61 ASN CB C 61 36.023 36.023 39.900 -3.877 25294 7972 1 19 . 1 1 62 62 THR N N 62 113.271 113.271 115.703 -2.432 25294 7973 1 19 . 1 1 62 62 THR HA H 62 4.308 4.308 4.313 -0.005 25294 7974 1 19 . 1 1 62 62 THR CA C 62 59.310 59.310 63.209 -3.899 25294 7975 1 19 . 1 1 62 62 THR CB C 62 66.813 66.813 68.963 -2.150 25294 7976 1 19 . 1 1 63 63 SER N N 63 116.521 116.521 115.007 1.514 25294 7977 1 19 . 1 1 63 63 SER HA H 63 4.650 4.650 4.258 0.392 25294 7978 1 19 . 1 1 63 63 SER CA C 63 54.094 54.094 57.461 -3.367 25294 7979 1 19 . 1 1 63 63 SER CB C 63 61.617 61.617 64.605 -2.987 25294 7980 1 19 . 1 1 64 64 TYR N N 64 120.183 120.183 117.740 2.443 25294 7981 1 19 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.900 -0.062 25294 7982 1 19 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.496 -2.093 25294 7983 1 19 . 1 1 64 64 TYR CB C 64 36.569 36.569 40.236 -3.667 25294 7984 1 19 . 1 1 65 65 LYS N N 65 115.195 115.195 115.972 -0.777 25294 7985 1 19 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.608 0.113 25294 7986 1 19 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.222 -3.516 25294 7987 1 19 . 1 1 65 65 LYS CB C 65 31.820 31.820 33.819 -1.999 25294 7988 1 19 . 1 1 66 66 GLU N N 66 117.231 117.231 119.830 -2.599 25294 7989 1 19 . 1 1 66 66 GLU HA H 66 5.213 5.213 4.835 0.378 25294 7990 1 19 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.697 -3.084 25294 7991 1 19 . 1 1 66 66 GLU CB C 66 30.793 30.793 32.897 -2.104 25294 7992 1 19 . 1 1 67 67 PHE N N 67 121.532 121.532 125.618 -4.086 25294 7993 1 19 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.909 -0.479 25294 7994 1 19 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.138 -0.869 25294 7995 1 19 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.466 -2.191 25294 7996 1 19 . 1 1 68 68 ASP N N 68 128.157 128.157 126.844 1.313 25294 7997 1 19 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.526 -0.098 25294 7998 1 19 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.901 -3.345 25294 7999 1 19 . 1 1 68 68 ASP CB C 68 38.424 38.424 41.594 -3.170 25294 8000 1 19 . 1 1 69 69 GLY N N 69 114.151 114.151 108.845 5.306 25294 8001 1 19 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.494 -3.595 25294 8002 1 19 . 1 1 70 70 GLY N N 70 113.714 113.714 110.277 3.437 25294 8003 1 19 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.535 -1.541 25294 8004 1 19 . 1 1 71 71 TRP N N 71 117.823 117.823 120.926 -3.103 25294 8005 1 19 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.542 0.266 25294 8006 1 19 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.920 -4.143 25294 8007 1 19 . 1 1 71 71 TRP CB C 71 25.645 25.645 29.809 -4.164 25294 8008 1 19 . 1 1 72 72 TYR N N 72 114.204 114.204 119.403 -5.199 25294 8009 1 19 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.802 0.323 25294 8010 1 19 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.664 -5.229 25294 8011 1 19 . 1 1 72 72 TYR CB C 72 38.620 38.620 39.745 -1.125 25294 8012 1 19 . 1 1 73 73 LEU N N 73 121.469 121.469 127.229 -5.760 25294 8013 1 19 . 1 1 73 73 LEU HA H 73 4.767 4.767 5.035 -0.268 25294 8014 1 19 . 1 1 73 73 LEU CA C 73 51.332 51.332 52.764 -1.432 25294 8015 1 19 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.542 -3.139 25294 8016 1 19 . 1 1 74 74 VAL N N 74 124.558 124.558 124.862 -0.304 25294 8017 1 19 . 1 1 74 74 VAL HA H 74 4.783 4.783 5.044 -0.261 25294 8018 1 19 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.668 -2.856 25294 8019 1 19 . 1 1 74 74 VAL CB C 74 31.820 31.820 34.843 -3.023 25294 8020 1 19 . 1 1 75 75 LYS N N 75 125.824 125.824 124.803 1.021 25294 8021 1 19 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.181 -0.071 25294 8022 1 19 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.555 -2.751 25294 8023 1 19 . 1 1 75 75 LYS CB C 75 34.575 34.575 37.752 -3.177 25294 8024 1 19 . 1 1 76 76 ILE N N 76 124.647 124.647 123.009 1.638 25294 8025 1 19 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.659 0.419 25294 8026 1 19 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.739 -3.372 25294 8027 1 19 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.541 -1.948 25294 8028 1 19 . 1 1 77 77 GLU N N 77 128.081 128.081 128.522 -0.441 25294 8029 1 19 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.647 -0.203 25294 8030 1 19 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.065 -2.594 25294 8031 1 19 . 1 1 77 77 GLU CB C 77 29.914 29.914 30.572 -0.658 25294 8032 1 19 . 1 1 78 78 ASP N N 78 126.158 126.158 127.263 -1.105 25294 8033 1 19 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.130 -0.030 25294 8034 1 19 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.296 -3.233 25294 8035 1 19 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.328 -3.590 25294 8036 1 19 . 1 1 79 79 ASN N N 79 118.653 118.653 116.828 1.825 25294 8037 1 19 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.891 -0.245 25294 8038 1 19 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.185 -1.976 25294 8039 1 19 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.880 -5.530 25294 8040 1 19 . 1 1 80 80 GLU N N 80 120.378 120.378 122.033 -1.655 25294 8041 1 19 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.285 0.224 25294 8042 1 19 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.849 -2.989 25294 8043 1 19 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.769 -1.096 25294 8044 1 19 . 1 1 81 81 LEU N N 81 125.771 125.771 129.782 -4.011 25294 8045 1 19 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.257 -0.291 25294 8046 1 19 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.498 -3.484 25294 8047 1 19 . 1 1 81 81 LEU CB C 81 42.550 42.550 44.178 -1.628 25294 8048 1 19 . 1 1 82 82 LYS N N 82 128.076 128.076 125.463 2.613 25294 8049 1 19 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.190 0.055 25294 8050 1 19 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.035 -1.703 25294 8051 1 19 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.100 -3.921 25294 8052 1 19 . 1 1 83 83 VAL N N 83 124.216 124.216 122.183 2.033 25294 8053 1 19 . 1 1 83 83 VAL HA H 83 4.908 4.908 5.054 -0.146 25294 8054 1 19 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.581 -2.200 25294 8055 1 19 . 1 1 83 83 VAL CB C 83 32.168 32.168 35.117 -2.949 25294 8056 1 19 . 1 1 84 84 ILE N N 84 129.084 129.084 126.903 2.181 25294 8057 1 19 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.809 -0.279 25294 8058 1 19 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.827 -1.421 25294 8059 1 19 . 1 1 84 84 ILE CB C 84 38.166 38.166 41.450 -3.284 25294 8060 1 19 . 1 1 85 85 ILE N N 85 127.360 127.360 124.446 2.914 25294 8061 1 19 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.823 -0.238 25294 8062 1 19 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.541 -1.081 25294 8063 1 19 . 1 1 85 85 ILE CB C 85 38.498 38.498 41.002 -2.504 25294 8064 1 19 . 1 1 86 86 ASN N N 86 128.337 128.337 125.173 3.164 25294 8065 1 19 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.743 0.023 25294 8066 1 19 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.296 -2.114 25294 8067 1 19 . 1 1 86 86 ASN CB C 86 36.891 36.891 39.934 -3.043 25294 8068 1 19 . 1 1 87 87 ARG N N 87 119.368 119.368 119.323 0.045 25294 8069 1 19 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.114 -0.123 25294 8070 1 19 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.060 -1.862 25294 8071 1 19 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.814 -2.411 25294 8072 1 19 . 1 1 88 88 ASN N N 88 125.082 125.082 124.757 0.325 25294 8073 1 19 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.401 0.324 25294 8074 1 19 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.296 -4.193 25294 8075 1 19 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.192 -3.435 25294 8076 1 19 . 1 1 89 89 GLU N N 89 125.309 125.309 123.170 2.139 25294 8077 1 19 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.154 0.204 25294 8078 1 19 . 1 1 89 89 GLU CA C 89 53.013 53.013 57.307 -4.294 25294 8079 1 19 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.493 -2.409 25294 8080 1 19 . 1 1 90 90 THR N N 90 112.516 112.516 110.642 1.874 25294 8081 1 19 . 1 1 90 90 THR HA H 90 4.534 4.534 4.607 -0.073 25294 8082 1 19 . 1 1 90 90 THR CA C 90 58.161 58.161 59.500 -1.339 25294 8083 1 19 . 1 1 90 90 THR CB C 90 68.409 68.409 71.763 -3.354 25294 8084 1 19 . 1 1 91 91 ASN N N 91 116.717 116.717 119.851 -3.134 25294 8085 1 19 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.804 -0.097 25294 8086 1 19 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.433 -3.637 25294 8087 1 19 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.044 -2.570 25294 8088 1 19 . 1 1 92 92 ALA N N 92 122.025 122.025 122.089 -0.064 25294 8089 1 19 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.581 0.055 25294 8090 1 19 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.416 -2.367 25294 8091 1 19 . 1 1 92 92 ALA CB C 92 19.716 19.716 21.074 -1.358 25294 8092 1 19 . 1 1 93 93 SER N N 93 115.895 115.895 119.144 -3.249 25294 8093 1 19 . 1 1 93 93 SER HA H 93 4.536 4.536 4.932 -0.396 25294 8094 1 19 . 1 1 93 93 SER CA C 93 54.865 54.865 57.589 -2.724 25294 8095 1 19 . 1 1 93 93 SER CB C 93 61.292 61.292 64.312 -3.020 25294 8096 1 19 . 1 1 94 94 ARG N N 94 119.529 119.529 119.524 0.005 25294 8097 1 19 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.820 0.094 25294 8098 1 19 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.432 -2.336 25294 8099 1 19 . 1 1 94 94 ARG CB C 94 29.512 29.512 32.807 -3.295 25294 8100 1 19 . 1 1 95 95 SER N N 95 114.542 114.542 113.775 0.767 25294 8101 1 19 . 1 1 95 95 SER HA H 95 5.926 5.926 4.997 0.929 25294 8102 1 19 . 1 1 95 95 SER CA C 95 54.219 54.219 57.442 -3.223 25294 8103 1 19 . 1 1 95 95 SER CB C 95 65.271 65.271 65.393 -0.122 25294 8104 1 19 . 1 1 96 96 PHE N N 96 117.183 117.183 118.773 -1.590 25294 8105 1 19 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.258 0.080 25294 8106 1 19 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.657 -2.177 25294 8107 1 19 . 1 1 96 96 PHE CB C 96 38.868 38.868 43.981 -5.114 25294 8108 1 19 . 1 1 97 97 THR N N 97 115.263 115.263 116.608 -1.345 25294 8109 1 19 . 1 1 97 97 THR HA H 97 5.250 5.250 5.413 -0.163 25294 8110 1 19 . 1 1 97 97 THR CA C 97 58.178 58.178 61.393 -3.215 25294 8111 1 19 . 1 1 97 97 THR CB C 97 69.068 69.068 72.110 -3.042 25294 8112 1 19 . 1 1 98 98 VAL N N 98 125.442 125.442 121.767 3.675 25294 8113 1 19 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.683 0.174 25294 8114 1 19 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.876 -3.467 25294 8115 1 19 . 1 1 98 98 VAL CB C 98 32.929 32.929 35.630 -2.701 25294 8116 1 19 . 1 1 99 99 CYS N N 99 127.111 127.111 127.062 0.049 25294 8117 1 19 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.333 0.013 25294 8118 1 19 . 1 1 99 99 CYS CA C 99 53.951 53.951 55.840 -1.889 25294 8119 1 19 . 1 1 99 99 CYS CB C 99 25.942 25.942 30.411 -4.469 25294 8120 1 19 . 1 1 100 100 VAL N N 100 120.146 120.146 122.975 -2.829 25294 8121 1 19 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.356 0.027 25294 8122 1 19 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.344 -3.631 25294 8123 1 19 . 1 1 100 100 VAL CB C 100 32.643 32.643 35.353 -2.710 25294 8124 1 19 . 1 1 101 101 GLU N N 101 118.807 118.807 121.870 -3.063 25294 8125 1 19 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.821 -0.069 25294 8126 1 19 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.805 -2.370 25294 8127 1 19 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.162 -1.441 25294 8128 1 19 . 1 1 102 102 ALA N N 102 124.088 124.088 123.969 0.119 25294 8129 1 19 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.754 -0.897 25294 8130 1 19 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.313 -2.435 25294 8131 1 19 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.110 -1.085 25294 8132 1 19 . 1 1 103 103 GLY N N 103 111.186 111.186 112.778 -1.592 25294 8133 1 19 . 1 1 103 103 GLY CA C 103 44.643 44.643 47.220 -2.577 25294 8134 1 19 . 1 1 104 104 ASN N N 104 123.092 123.092 123.387 -0.295 25294 8135 1 19 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.578 0.094 25294 8136 1 19 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.908 -3.212 25294 8137 1 19 . 1 1 104 104 ASN CB C 104 36.407 36.407 38.987 -2.580 25294 8138 1 19 . 1 1 105 105 ALA N N 105 122.653 122.653 120.015 2.638 25294 8139 1 19 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.629 -0.198 25294 8140 1 19 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.109 -2.441 25294 8141 1 19 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.686 -1.750 25294 8142 1 19 . 1 1 106 106 PHE N N 106 116.011 116.011 112.821 3.190 25294 8143 1 19 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.112 0.305 25294 8144 1 19 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.568 -3.010 25294 8145 1 19 . 1 1 106 106 PHE CB C 106 40.484 40.484 41.933 -1.449 25294 8146 1 19 . 1 1 107 107 ASP N N 107 121.992 121.992 118.082 3.910 25294 8147 1 19 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.813 -0.219 25294 8148 1 19 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.015 -2.491 25294 8149 1 19 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.815 -1.724 25294 8150 1 19 . 1 1 108 108 GLU N N 108 119.354 119.354 120.671 -1.317 25294 8151 1 19 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.897 0.112 25294 8152 1 19 . 1 1 108 108 GLU CA C 108 51.988 51.988 54.862 -2.874 25294 8153 1 19 . 1 1 108 108 GLU CB C 108 31.317 31.317 33.041 -1.724 25294 8154 1 19 . 1 1 109 109 PHE N N 109 122.098 122.098 121.673 0.425 25294 8155 1 19 . 1 1 109 109 PHE HA H 109 4.958 4.958 5.030 -0.072 25294 8156 1 19 . 1 1 109 109 PHE CA C 109 52.787 52.787 55.358 -2.571 25294 8157 1 19 . 1 1 109 109 PHE CB C 109 40.443 40.443 41.929 -1.486 25294 8158 1 19 . 1 1 110 110 LYS N N 110 124.500 124.500 122.389 2.111 25294 8159 1 19 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.759 -0.067 25294 8160 1 19 . 1 1 110 110 LYS CA C 110 51.891 51.891 54.629 -2.738 25294 8161 1 19 . 1 1 110 110 LYS CB C 110 33.012 33.012 34.714 -1.702 25294 8162 1 19 . 1 1 111 111 PHE N N 111 125.010 125.010 124.563 0.447 25294 8163 1 19 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.677 -0.923 25294 8164 1 19 . 1 1 111 111 PHE CA C 111 58.184 58.184 56.229 1.955 25294 8165 1 19 . 1 1 111 111 PHE CB C 111 38.380 38.380 43.078 -4.698 25294 8166 1 19 . 1 1 112 112 VAL N N 112 122.957 122.957 120.058 2.899 25294 8167 1 19 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.840 -0.400 25294 8168 1 19 . 1 1 112 112 VAL CA C 112 58.256 58.256 61.037 -2.781 25294 8169 1 19 . 1 1 112 112 VAL CB C 112 31.093 31.093 35.778 -4.685 25294 8170 1 19 . 1 1 113 113 GLN N N 113 130.864 130.864 128.941 1.923 25294 8171 1 19 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.996 0.323 25294 8172 1 19 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.006 -2.887 25294 8173 1 19 . 1 1 113 113 GLN CB C 113 28.164 28.164 31.367 -3.203 25294 8174 1 19 . 1 1 114 114 ASP N N 114 126.272 126.272 127.290 -1.018 25294 8175 1 19 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.538 -0.211 25294 8176 1 19 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.690 -2.917 25294 8177 1 19 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.873 -3.018 25294 8178 1 19 . 1 1 115 115 ALA N N 115 120.134 120.134 121.575 -1.441 25294 8179 1 19 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.421 -0.722 25294 8180 1 19 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.524 -2.623 25294 8181 1 19 . 1 1 115 115 ALA CB C 115 17.751 17.751 20.483 -2.732 25294 8182 1 19 . 1 1 116 116 ALA N N 116 121.377 121.377 124.990 -3.613 25294 8183 1 19 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.342 -0.389 25294 8184 1 19 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.027 -2.039 25294 8185 1 19 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.775 -3.575 25294 8186 1 19 . 1 1 117 117 LYS N N 117 121.536 121.536 123.799 -2.263 25294 8187 1 19 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.481 -0.342 25294 8188 1 19 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.528 -1.882 25294 8189 1 19 . 1 1 117 117 LYS CB C 117 30.579 30.579 32.496 -1.917 25294 8190 1 20 . 1 1 5 5 SER N N 5 116.267 116.267 115.446 0.821 25294 8191 1 20 . 1 1 5 5 SER HA H 5 4.349 4.349 4.553 -0.204 25294 8192 1 20 . 1 1 5 5 SER CA C 5 55.478 55.478 57.663 -2.185 25294 8193 1 20 . 1 1 5 5 SER CB C 5 61.191 61.191 64.406 -3.215 25294 8194 1 20 . 1 1 6 6 ASP N N 6 123.039 123.039 125.957 -2.918 25294 8195 1 20 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.749 0.078 25294 8196 1 20 . 1 1 6 6 ASP CA C 6 49.671 49.671 53.833 -4.162 25294 8197 1 20 . 1 1 6 6 ASP CB C 6 38.656 38.656 41.477 -2.821 25294 8198 1 20 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.331 -0.014 25294 8199 1 20 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.609 -3.462 25294 8200 1 20 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.079 -2.601 25294 8201 1 20 . 1 1 8 8 ASP N N 8 119.159 119.159 116.540 2.619 25294 8202 1 20 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.607 -0.042 25294 8203 1 20 . 1 1 8 8 ASP CA C 8 51.860 51.860 53.179 -1.319 25294 8204 1 20 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.389 -2.664 25294 8205 1 20 . 1 1 9 9 GLY N N 9 108.837 108.837 110.501 -1.664 25294 8206 1 20 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.442 -2.306 25294 8207 1 20 . 1 1 10 10 LEU N N 10 121.571 121.571 119.063 2.508 25294 8208 1 20 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.472 -0.205 25294 8209 1 20 . 1 1 10 10 LEU CA C 10 52.391 52.391 54.530 -2.139 25294 8210 1 20 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.390 -2.527 25294 8211 1 20 . 1 1 11 11 ALA N N 11 125.169 125.169 122.438 2.731 25294 8212 1 20 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.626 -0.290 25294 8213 1 20 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.225 -2.241 25294 8214 1 20 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.258 -2.076 25294 8215 1 20 . 1 1 12 12 ASP N N 12 122.672 122.672 124.583 -1.911 25294 8216 1 20 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.812 -0.076 25294 8217 1 20 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.749 -3.047 25294 8218 1 20 . 1 1 12 12 ASP CB C 12 37.831 37.831 42.542 -4.711 25294 8219 1 20 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.646 -0.342 25294 8220 1 20 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.646 -3.046 25294 8221 1 20 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.862 -3.346 25294 8222 1 20 . 1 1 14 14 MET N N 14 120.151 120.151 118.858 1.293 25294 8223 1 20 . 1 1 14 14 MET HA H 14 3.780 3.780 4.481 -0.701 25294 8224 1 20 . 1 1 14 14 MET CA C 14 55.822 55.822 56.587 -0.765 25294 8225 1 20 . 1 1 14 14 MET CB C 14 30.909 30.909 32.952 -2.043 25294 8226 1 20 . 1 1 15 15 LYS N N 15 123.897 123.897 120.838 3.059 25294 8227 1 20 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.745 -0.288 25294 8228 1 20 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.428 -4.021 25294 8229 1 20 . 1 1 15 15 LYS CB C 15 32.453 32.453 35.066 -2.613 25294 8230 1 20 . 1 1 16 16 TRP N N 16 125.776 125.776 123.650 2.126 25294 8231 1 20 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.466 -0.391 25294 8232 1 20 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.807 -3.155 25294 8233 1 20 . 1 1 16 16 TRP CB C 16 28.000 28.000 32.205 -4.205 25294 8234 1 20 . 1 1 17 17 SER N N 17 120.772 120.772 116.757 4.015 25294 8235 1 20 . 1 1 17 17 SER HA H 17 4.403 4.403 4.664 -0.261 25294 8236 1 20 . 1 1 17 17 SER CA C 17 56.167 56.167 58.650 -2.483 25294 8237 1 20 . 1 1 17 17 SER CB C 17 60.833 60.833 63.840 -3.007 25294 8238 1 20 . 1 1 18 18 LYS N N 18 121.096 121.096 121.680 -0.584 25294 8239 1 20 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.578 0.140 25294 8240 1 20 . 1 1 18 18 LYS CA C 18 53.735 53.735 54.924 -1.189 25294 8241 1 20 . 1 1 18 18 LYS CB C 18 32.917 32.917 33.450 -0.533 25294 8242 1 20 . 1 1 19 19 VAL N N 19 116.358 116.358 118.129 -1.771 25294 8243 1 20 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.145 0.278 25294 8244 1 20 . 1 1 19 19 VAL CA C 19 55.230 55.230 59.583 -4.353 25294 8245 1 20 . 1 1 19 19 VAL CB C 19 31.026 31.026 31.764 -0.738 25294 8246 1 20 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.468 -0.165 25294 8247 1 20 . 1 1 20 20 PRO CA C 20 59.770 59.770 61.888 -2.118 25294 8248 1 20 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.319 -2.766 25294 8249 1 20 . 1 1 21 21 SER N N 21 118.882 118.882 115.938 2.944 25294 8250 1 20 . 1 1 21 21 SER HA H 21 4.084 4.084 4.226 -0.142 25294 8251 1 20 . 1 1 21 21 SER CA C 21 57.657 57.657 60.754 -3.097 25294 8252 1 20 . 1 1 21 21 SER CB C 21 60.173 60.173 63.361 -3.188 25294 8253 1 20 . 1 1 22 22 GLY N N 22 109.523 109.523 108.328 1.195 25294 8254 1 20 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.713 -2.309 25294 8255 1 20 . 1 1 23 23 LEU N N 23 123.003 123.003 122.320 0.683 25294 8256 1 20 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.344 -0.310 25294 8257 1 20 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.721 -2.118 25294 8258 1 20 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.154 -2.083 25294 8259 1 20 . 1 1 24 24 LYS N N 24 129.004 129.004 128.177 0.827 25294 8260 1 20 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.570 -0.060 25294 8261 1 20 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.449 -2.212 25294 8262 1 20 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.157 -0.996 25294 8263 1 20 . 1 1 25 25 ASN N N 25 126.336 126.336 121.828 4.508 25294 8264 1 20 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.378 -0.054 25294 8265 1 20 . 1 1 25 25 ASN CA C 25 51.620 51.620 53.878 -2.258 25294 8266 1 20 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.241 -3.256 25294 8267 1 20 . 1 1 26 26 GLY N N 26 103.076 103.076 101.868 1.208 25294 8268 1 20 . 1 1 26 26 GLY CA C 26 43.549 43.549 44.674 -1.125 25294 8269 1 20 . 1 1 27 27 GLU N N 27 120.878 120.878 123.125 -2.247 25294 8270 1 20 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.599 0.603 25294 8271 1 20 . 1 1 27 27 GLU CA C 27 51.233 51.233 56.246 -5.013 25294 8272 1 20 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.046 -0.285 25294 8273 1 20 . 1 1 28 28 LEU N N 28 128.583 128.583 127.065 1.518 25294 8274 1 20 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.900 -0.345 25294 8275 1 20 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.673 -3.349 25294 8276 1 20 . 1 1 28 28 LEU CB C 28 43.517 43.517 43.443 0.074 25294 8277 1 20 . 1 1 29 29 LYS N N 29 127.554 127.554 125.566 1.988 25294 8278 1 20 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.507 0.394 25294 8279 1 20 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.966 -3.127 25294 8280 1 20 . 1 1 29 29 LYS CB C 29 29.523 29.523 32.765 -3.242 25294 8281 1 20 . 1 1 30 30 VAL N N 30 127.915 127.915 125.029 2.886 25294 8282 1 20 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.536 -0.352 25294 8283 1 20 . 1 1 30 30 VAL CA C 30 58.308 58.308 59.976 -1.668 25294 8284 1 20 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.411 -3.141 25294 8285 1 20 . 1 1 31 31 GLU N N 31 125.151 125.151 124.928 0.223 25294 8286 1 20 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.436 -0.075 25294 8287 1 20 . 1 1 31 31 GLU CA C 31 54.100 54.100 56.150 -2.050 25294 8288 1 20 . 1 1 31 31 GLU CB C 31 27.703 27.703 30.441 -2.738 25294 8289 1 20 . 1 1 32 32 ALA N N 32 126.271 126.271 120.555 5.716 25294 8290 1 20 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.276 -0.260 25294 8291 1 20 . 1 1 32 32 ALA CA C 32 53.127 53.127 54.257 -1.130 25294 8292 1 20 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.524 -3.258 25294 8293 1 20 . 1 1 33 33 GLU N N 33 113.076 113.076 115.384 -2.308 25294 8294 1 20 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.396 -0.431 25294 8295 1 20 . 1 1 33 33 GLU CA C 33 55.985 55.985 55.913 0.072 25294 8296 1 20 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.297 -3.368 25294 8297 1 20 . 1 1 34 34 GLY N N 34 104.905 104.905 108.800 -3.895 25294 8298 1 20 . 1 1 34 34 GLY CA C 34 40.707 40.707 44.989 -4.282 25294 8299 1 20 . 1 1 35 35 GLY N N 35 105.946 105.946 105.241 0.705 25294 8300 1 20 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.893 -1.905 25294 8301 1 20 . 1 1 36 36 SER N N 36 116.044 116.044 114.195 1.849 25294 8302 1 20 . 1 1 36 36 SER HA H 36 5.539 5.539 5.384 0.155 25294 8303 1 20 . 1 1 36 36 SER CA C 36 54.323 54.323 56.811 -2.488 25294 8304 1 20 . 1 1 36 36 SER CB C 36 62.808 62.808 67.002 -4.194 25294 8305 1 20 . 1 1 37 37 SER N N 37 119.501 119.501 115.272 4.229 25294 8306 1 20 . 1 1 37 37 SER HA H 37 4.712 4.712 4.691 0.021 25294 8307 1 20 . 1 1 37 37 SER CA C 37 55.548 55.548 57.178 -1.630 25294 8308 1 20 . 1 1 37 37 SER CB C 37 63.943 63.943 66.035 -2.092 25294 8309 1 20 . 1 1 38 38 LEU N N 38 125.962 125.962 123.128 2.834 25294 8310 1 20 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.969 0.284 25294 8311 1 20 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.289 -2.507 25294 8312 1 20 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.797 -2.963 25294 8313 1 20 . 1 1 39 39 PHE N N 39 124.707 124.707 122.957 1.750 25294 8314 1 20 . 1 1 39 39 PHE HA H 39 5.139 5.139 4.846 0.293 25294 8315 1 20 . 1 1 39 39 PHE CA C 39 52.131 52.131 57.161 -5.030 25294 8316 1 20 . 1 1 39 39 PHE CB C 39 38.952 38.952 41.563 -2.611 25294 8317 1 20 . 1 1 40 40 ALA N N 40 124.994 124.994 128.414 -3.420 25294 8318 1 20 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.234 0.401 25294 8319 1 20 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.329 -2.028 25294 8320 1 20 . 1 1 40 40 ALA CB C 40 19.446 19.446 19.519 -0.073 25294 8321 1 20 . 1 1 41 41 CYS N N 41 125.757 125.757 125.199 0.558 25294 8322 1 20 . 1 1 41 41 CYS HA H 41 4.146 4.146 3.985 0.161 25294 8323 1 20 . 1 1 41 41 CYS CA C 41 56.465 56.465 60.007 -3.542 25294 8324 1 20 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.529 -1.556 25294 8325 1 20 . 1 1 42 42 LYS N N 42 129.019 129.019 127.144 1.875 25294 8326 1 20 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.097 0.163 25294 8327 1 20 . 1 1 42 42 LYS CA C 42 54.851 54.851 58.516 -3.665 25294 8328 1 20 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.779 -0.672 25294 8329 1 20 . 1 1 43 43 ASN N N 43 113.240 113.240 113.214 0.026 25294 8330 1 20 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.563 -0.038 25294 8331 1 20 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.188 -2.953 25294 8332 1 20 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.772 -4.911 25294 8333 1 20 . 1 1 44 44 TYR N N 44 119.335 119.335 117.293 2.042 25294 8334 1 20 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.532 0.025 25294 8335 1 20 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.696 -1.978 25294 8336 1 20 . 1 1 44 44 TYR CB C 44 37.372 37.372 42.093 -4.721 25294 8337 1 20 . 1 1 45 45 LYS N N 45 120.676 120.676 121.024 -0.348 25294 8338 1 20 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.890 -0.854 25294 8339 1 20 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.084 -1.546 25294 8340 1 20 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.524 -3.291 25294 8341 1 20 . 1 1 46 46 SER N N 46 108.797 108.797 114.925 -6.128 25294 8342 1 20 . 1 1 46 46 SER HA H 46 4.388 4.388 4.684 -0.296 25294 8343 1 20 . 1 1 46 46 SER CA C 46 53.664 53.664 58.508 -4.844 25294 8344 1 20 . 1 1 46 46 SER CB C 46 61.810 61.810 64.578 -2.768 25294 8345 1 20 . 1 1 47 47 PHE N N 47 117.325 117.325 120.090 -2.765 25294 8346 1 20 . 1 1 47 47 PHE HA H 47 4.642 4.642 4.805 -0.163 25294 8347 1 20 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.642 -3.025 25294 8348 1 20 . 1 1 47 47 PHE CB C 47 37.101 37.101 40.929 -3.828 25294 8349 1 20 . 1 1 48 48 TRP N N 48 117.090 117.090 116.380 0.710 25294 8350 1 20 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.191 0.044 25294 8351 1 20 . 1 1 48 48 TRP CA C 48 53.492 53.492 54.875 -1.383 25294 8352 1 20 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.282 -1.387 25294 8353 1 20 . 1 1 49 49 ILE N N 49 119.682 119.682 119.858 -0.176 25294 8354 1 20 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.328 -0.297 25294 8355 1 20 . 1 1 49 49 ILE CA C 49 60.473 60.473 60.869 -0.396 25294 8356 1 20 . 1 1 49 49 ILE CB C 49 36.436 36.436 37.376 -0.940 25294 8357 1 20 . 1 1 50 50 SER N N 50 124.071 124.071 121.421 2.650 25294 8358 1 20 . 1 1 50 50 SER HA H 50 4.708 4.708 4.735 -0.027 25294 8359 1 20 . 1 1 50 50 SER CA C 50 56.110 56.110 57.848 -1.738 25294 8360 1 20 . 1 1 50 50 SER CB C 50 63.816 63.816 64.434 -0.618 25294 8361 1 20 . 1 1 51 51 SER N N 51 111.253 111.253 116.212 -4.959 25294 8362 1 20 . 1 1 51 51 SER HA H 51 4.557 4.557 4.678 -0.121 25294 8363 1 20 . 1 1 51 51 SER CA C 51 55.564 55.564 57.888 -2.324 25294 8364 1 20 . 1 1 51 51 SER CB C 51 62.821 62.821 64.857 -2.036 25294 8365 1 20 . 1 1 52 52 VAL N N 52 121.147 121.147 124.907 -3.760 25294 8366 1 20 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.947 -0.216 25294 8367 1 20 . 1 1 52 52 VAL CA C 52 59.126 59.126 59.316 -0.190 25294 8368 1 20 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.558 -3.058 25294 8369 1 20 . 1 1 53 53 LYS N N 53 126.128 126.128 125.969 0.159 25294 8370 1 20 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.823 0.184 25294 8371 1 20 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.805 -3.082 25294 8372 1 20 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.250 -1.478 25294 8373 1 20 . 1 1 54 54 GLU N N 54 124.160 124.160 120.856 3.304 25294 8374 1 20 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.961 0.797 25294 8375 1 20 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.537 -2.278 25294 8376 1 20 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.732 -0.673 25294 8377 1 20 . 1 1 55 55 GLU N N 55 127.218 127.218 118.858 8.360 25294 8378 1 20 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.434 -0.526 25294 8379 1 20 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.548 -2.002 25294 8380 1 20 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.548 -5.254 25294 8381 1 20 . 1 1 56 56 GLY N N 56 104.894 104.894 108.651 -3.757 25294 8382 1 20 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.648 -3.767 25294 8383 1 20 . 1 1 57 57 LYS N N 57 120.444 120.444 117.110 3.334 25294 8384 1 20 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.725 -0.161 25294 8385 1 20 . 1 1 57 57 LYS CA C 57 51.959 51.959 53.883 -1.924 25294 8386 1 20 . 1 1 57 57 LYS CB C 57 32.188 32.188 35.421 -3.233 25294 8387 1 20 . 1 1 58 58 PHE N N 58 121.824 121.824 119.989 1.835 25294 8388 1 20 . 1 1 58 58 PHE HA H 58 4.771 4.771 4.815 -0.044 25294 8389 1 20 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.477 -0.312 25294 8390 1 20 . 1 1 58 58 PHE CB C 58 36.902 36.902 39.538 -2.636 25294 8391 1 20 . 1 1 59 59 LYS N N 59 123.205 123.205 122.949 0.256 25294 8392 1 20 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.463 -0.012 25294 8393 1 20 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.413 -4.428 25294 8394 1 20 . 1 1 59 59 LYS CB C 59 29.791 29.791 32.891 -3.100 25294 8395 1 20 . 1 1 60 60 GLU N N 60 122.647 122.647 119.796 2.851 25294 8396 1 20 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.523 -0.263 25294 8397 1 20 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.831 -1.925 25294 8398 1 20 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.900 -3.237 25294 8399 1 20 . 1 1 61 61 ASN N N 61 119.907 119.907 118.568 1.339 25294 8400 1 20 . 1 1 61 61 ASN HA H 61 4.845 4.845 5.182 -0.337 25294 8401 1 20 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.597 -2.845 25294 8402 1 20 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.015 -3.992 25294 8403 1 20 . 1 1 62 62 THR N N 62 113.271 113.271 116.748 -3.477 25294 8404 1 20 . 1 1 62 62 THR HA H 62 4.308 4.308 4.538 -0.230 25294 8405 1 20 . 1 1 62 62 THR CA C 62 59.310 59.310 62.461 -3.151 25294 8406 1 20 . 1 1 62 62 THR CB C 62 66.813 66.813 69.215 -2.402 25294 8407 1 20 . 1 1 63 63 SER N N 63 116.521 116.521 115.236 1.285 25294 8408 1 20 . 1 1 63 63 SER HA H 63 4.650 4.650 4.790 -0.140 25294 8409 1 20 . 1 1 63 63 SER CA C 63 54.094 54.094 57.483 -3.389 25294 8410 1 20 . 1 1 63 63 SER CB C 63 61.617 61.617 64.563 -2.946 25294 8411 1 20 . 1 1 64 64 TYR N N 64 120.183 120.183 119.789 0.394 25294 8412 1 20 . 1 1 64 64 TYR HA H 64 4.838 4.838 5.144 -0.306 25294 8413 1 20 . 1 1 64 64 TYR CA C 64 56.403 56.403 57.845 -1.442 25294 8414 1 20 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.548 -2.979 25294 8415 1 20 . 1 1 65 65 LYS N N 65 115.195 115.195 116.895 -1.700 25294 8416 1 20 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.587 0.134 25294 8417 1 20 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.294 -3.588 25294 8418 1 20 . 1 1 65 65 LYS CB C 65 31.820 31.820 35.655 -3.835 25294 8419 1 20 . 1 1 66 66 GLU N N 66 117.231 117.231 119.212 -1.981 25294 8420 1 20 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.019 0.194 25294 8421 1 20 . 1 1 66 66 GLU CA C 66 52.613 52.613 54.880 -2.267 25294 8422 1 20 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.651 -2.858 25294 8423 1 20 . 1 1 67 67 PHE N N 67 121.532 121.532 119.743 1.789 25294 8424 1 20 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.760 -0.330 25294 8425 1 20 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.534 -1.265 25294 8426 1 20 . 1 1 67 67 PHE CB C 67 40.275 40.275 43.413 -3.138 25294 8427 1 20 . 1 1 68 68 ASP N N 68 128.157 128.157 123.244 4.913 25294 8428 1 20 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.945 -0.517 25294 8429 1 20 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.698 -3.142 25294 8430 1 20 . 1 1 68 68 ASP CB C 68 38.424 38.424 39.949 -1.525 25294 8431 1 20 . 1 1 69 69 GLY N N 69 114.151 114.151 108.253 5.898 25294 8432 1 20 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.446 -3.547 25294 8433 1 20 . 1 1 70 70 GLY N N 70 113.714 113.714 112.258 1.456 25294 8434 1 20 . 1 1 70 70 GLY CA C 70 43.994 43.994 46.229 -2.235 25294 8435 1 20 . 1 1 71 71 TRP N N 71 117.823 117.823 119.709 -1.886 25294 8436 1 20 . 1 1 71 71 TRP HA H 71 4.808 4.808 5.002 -0.194 25294 8437 1 20 . 1 1 71 71 TRP CA C 71 52.777 52.777 55.370 -2.593 25294 8438 1 20 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.567 -4.922 25294 8439 1 20 . 1 1 72 72 TYR N N 72 114.204 114.204 120.601 -6.397 25294 8440 1 20 . 1 1 72 72 TYR HA H 72 5.125 5.125 5.169 -0.044 25294 8441 1 20 . 1 1 72 72 TYR CA C 72 51.435 51.435 57.128 -5.693 25294 8442 1 20 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.811 -2.191 25294 8443 1 20 . 1 1 73 73 LEU N N 73 121.469 121.469 125.193 -3.724 25294 8444 1 20 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.934 -0.167 25294 8445 1 20 . 1 1 73 73 LEU CA C 73 51.332 51.332 52.803 -1.472 25294 8446 1 20 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.275 -2.872 25294 8447 1 20 . 1 1 74 74 VAL N N 74 124.558 124.558 125.185 -0.627 25294 8448 1 20 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.793 -0.010 25294 8449 1 20 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.303 -2.491 25294 8450 1 20 . 1 1 74 74 VAL CB C 74 31.820 31.820 33.523 -1.703 25294 8451 1 20 . 1 1 75 75 LYS N N 75 125.824 125.824 127.055 -1.231 25294 8452 1 20 . 1 1 75 75 LYS HA H 75 5.110 5.110 4.791 0.319 25294 8453 1 20 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.526 -2.722 25294 8454 1 20 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.169 -1.595 25294 8455 1 20 . 1 1 76 76 ILE N N 76 124.647 124.647 125.741 -1.094 25294 8456 1 20 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.210 0.868 25294 8457 1 20 . 1 1 76 76 ILE CA C 76 57.367 57.367 61.103 -3.736 25294 8458 1 20 . 1 1 76 76 ILE CB C 76 37.593 37.593 38.356 -0.763 25294 8459 1 20 . 1 1 77 77 GLU N N 77 128.081 128.081 128.321 -0.240 25294 8460 1 20 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.485 -0.041 25294 8461 1 20 . 1 1 77 77 GLU CA C 77 52.471 52.471 54.704 -2.233 25294 8462 1 20 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.042 -1.128 25294 8463 1 20 . 1 1 78 78 ASP N N 78 126.158 126.158 119.086 7.072 25294 8464 1 20 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.345 -0.245 25294 8465 1 20 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.833 -3.770 25294 8466 1 20 . 1 1 78 78 ASP CB C 78 36.738 36.738 41.205 -4.467 25294 8467 1 20 . 1 1 79 79 ASN N N 79 118.653 118.653 112.086 6.567 25294 8468 1 20 . 1 1 79 79 ASN HA H 79 4.646 4.646 5.040 -0.394 25294 8469 1 20 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.395 -2.186 25294 8470 1 20 . 1 1 79 79 ASN CB C 79 35.350 35.350 39.405 -4.055 25294 8471 1 20 . 1 1 80 80 GLU N N 80 120.378 120.378 120.052 0.326 25294 8472 1 20 . 1 1 80 80 GLU HA H 80 5.509 5.509 4.973 0.536 25294 8473 1 20 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.374 -2.514 25294 8474 1 20 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.887 -1.214 25294 8475 1 20 . 1 1 81 81 LEU N N 81 125.771 125.771 129.324 -3.553 25294 8476 1 20 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.303 -0.337 25294 8477 1 20 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.251 -3.237 25294 8478 1 20 . 1 1 81 81 LEU CB C 81 42.550 42.550 44.465 -1.915 25294 8479 1 20 . 1 1 82 82 LYS N N 82 128.076 128.076 125.113 2.963 25294 8480 1 20 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.210 0.035 25294 8481 1 20 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.635 -2.303 25294 8482 1 20 . 1 1 82 82 LYS CB C 82 32.179 32.179 35.875 -3.696 25294 8483 1 20 . 1 1 83 83 VAL N N 83 124.216 124.216 122.604 1.612 25294 8484 1 20 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.884 0.024 25294 8485 1 20 . 1 1 83 83 VAL CA C 83 58.380 58.380 60.441 -2.061 25294 8486 1 20 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.089 -1.921 25294 8487 1 20 . 1 1 84 84 ILE N N 84 129.084 129.084 128.794 0.290 25294 8488 1 20 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.349 0.181 25294 8489 1 20 . 1 1 84 84 ILE CA C 84 58.406 58.406 60.383 -1.977 25294 8490 1 20 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.971 -2.804 25294 8491 1 20 . 1 1 85 85 ILE N N 85 127.360 127.360 124.259 3.101 25294 8492 1 20 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.870 -0.285 25294 8493 1 20 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.862 -1.402 25294 8494 1 20 . 1 1 85 85 ILE CB C 85 38.498 38.498 41.031 -2.533 25294 8495 1 20 . 1 1 86 86 ASN N N 86 128.337 128.337 124.191 4.146 25294 8496 1 20 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.991 -0.225 25294 8497 1 20 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.580 -2.398 25294 8498 1 20 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.578 -3.687 25294 8499 1 20 . 1 1 87 87 ARG N N 87 119.368 119.368 119.400 -0.032 25294 8500 1 20 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.225 -0.234 25294 8501 1 20 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.504 -2.306 25294 8502 1 20 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.751 -2.348 25294 8503 1 20 . 1 1 88 88 ASN N N 88 125.082 125.082 124.463 0.619 25294 8504 1 20 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.354 0.371 25294 8505 1 20 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.101 -3.998 25294 8506 1 20 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.715 -3.958 25294 8507 1 20 . 1 1 89 89 GLU N N 89 125.309 125.309 123.508 1.801 25294 8508 1 20 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.275 0.083 25294 8509 1 20 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.479 -3.466 25294 8510 1 20 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.293 -2.208 25294 8511 1 20 . 1 1 90 90 THR N N 90 112.516 112.516 110.808 1.708 25294 8512 1 20 . 1 1 90 90 THR HA H 90 4.534 4.534 4.547 -0.013 25294 8513 1 20 . 1 1 90 90 THR CA C 90 58.161 58.161 59.757 -1.596 25294 8514 1 20 . 1 1 90 90 THR CB C 90 68.409 68.409 72.143 -3.734 25294 8515 1 20 . 1 1 91 91 ASN N N 91 116.717 116.717 119.145 -2.428 25294 8516 1 20 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.921 -0.214 25294 8517 1 20 . 1 1 91 91 ASN CA C 91 49.796 49.796 52.729 -2.933 25294 8518 1 20 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.534 -3.060 25294 8519 1 20 . 1 1 92 92 ALA N N 92 122.025 122.025 123.195 -1.170 25294 8520 1 20 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.592 0.044 25294 8521 1 20 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.431 -2.382 25294 8522 1 20 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.833 -1.117 25294 8523 1 20 . 1 1 93 93 SER N N 93 115.895 115.895 119.325 -3.430 25294 8524 1 20 . 1 1 93 93 SER HA H 93 4.536 4.536 4.559 -0.023 25294 8525 1 20 . 1 1 93 93 SER CA C 93 54.865 54.865 58.859 -3.994 25294 8526 1 20 . 1 1 93 93 SER CB C 93 61.292 61.292 64.118 -2.826 25294 8527 1 20 . 1 1 94 94 ARG N N 94 119.529 119.529 121.193 -1.664 25294 8528 1 20 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.812 0.102 25294 8529 1 20 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.746 -2.651 25294 8530 1 20 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.248 -3.736 25294 8531 1 20 . 1 1 95 95 SER N N 95 114.542 114.542 113.839 0.703 25294 8532 1 20 . 1 1 95 95 SER HA H 95 5.926 5.926 5.234 0.692 25294 8533 1 20 . 1 1 95 95 SER CA C 95 54.219 54.219 57.486 -3.268 25294 8534 1 20 . 1 1 95 95 SER CB C 95 65.271 65.271 66.398 -1.127 25294 8535 1 20 . 1 1 96 96 PHE N N 96 117.183 117.183 120.129 -2.946 25294 8536 1 20 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.090 0.248 25294 8537 1 20 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.746 -2.266 25294 8538 1 20 . 1 1 96 96 PHE CB C 96 38.868 38.868 42.554 -3.686 25294 8539 1 20 . 1 1 97 97 THR N N 97 115.263 115.263 117.002 -1.739 25294 8540 1 20 . 1 1 97 97 THR HA H 97 5.250 5.250 5.225 0.025 25294 8541 1 20 . 1 1 97 97 THR CA C 97 58.178 58.178 61.437 -3.259 25294 8542 1 20 . 1 1 97 97 THR CB C 97 69.068 69.068 71.420 -2.352 25294 8543 1 20 . 1 1 98 98 VAL N N 98 125.442 125.442 120.631 4.811 25294 8544 1 20 . 1 1 98 98 VAL HA H 98 4.857 4.857 5.012 -0.155 25294 8545 1 20 . 1 1 98 98 VAL CA C 98 57.409 57.409 59.647 -2.238 25294 8546 1 20 . 1 1 98 98 VAL CB C 98 32.929 32.929 34.324 -1.395 25294 8547 1 20 . 1 1 99 99 CYS N N 99 127.111 127.111 126.745 0.366 25294 8548 1 20 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.436 -0.090 25294 8549 1 20 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.501 -2.550 25294 8550 1 20 . 1 1 99 99 CYS CB C 99 25.942 25.942 29.495 -3.553 25294 8551 1 20 . 1 1 100 100 VAL N N 100 120.146 120.146 124.297 -4.151 25294 8552 1 20 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.220 0.163 25294 8553 1 20 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.609 -3.896 25294 8554 1 20 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.205 -1.562 25294 8555 1 20 . 1 1 101 101 GLU N N 101 118.807 118.807 121.333 -2.526 25294 8556 1 20 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.647 0.105 25294 8557 1 20 . 1 1 101 101 GLU CA C 101 51.435 51.435 53.877 -2.442 25294 8558 1 20 . 1 1 101 101 GLU CB C 101 31.721 31.721 33.654 -1.933 25294 8559 1 20 . 1 1 102 102 ALA N N 102 124.088 124.088 122.693 1.395 25294 8560 1 20 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.239 -0.382 25294 8561 1 20 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.128 -2.250 25294 8562 1 20 . 1 1 102 102 ALA CB C 102 18.025 18.025 18.892 -0.867 25294 8563 1 20 . 1 1 103 103 GLY N N 103 111.186 111.186 108.864 2.322 25294 8564 1 20 . 1 1 103 103 GLY CA C 103 44.643 44.643 45.646 -1.003 25294 8565 1 20 . 1 1 104 104 ASN N N 104 123.092 123.092 125.404 -2.312 25294 8566 1 20 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.614 0.058 25294 8567 1 20 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.135 -2.439 25294 8568 1 20 . 1 1 104 104 ASN CB C 104 36.407 36.407 37.644 -1.237 25294 8569 1 20 . 1 1 105 105 ALA N N 105 122.653 122.653 118.005 4.648 25294 8570 1 20 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.688 -0.257 25294 8571 1 20 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.578 -2.910 25294 8572 1 20 . 1 1 105 105 ALA CB C 105 18.936 18.936 21.431 -2.495 25294 8573 1 20 . 1 1 106 106 PHE N N 106 116.011 116.011 116.704 -0.693 25294 8574 1 20 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.557 -0.140 25294 8575 1 20 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.668 -3.110 25294 8576 1 20 . 1 1 106 106 PHE CB C 106 40.484 40.484 43.937 -3.453 25294 8577 1 20 . 1 1 107 107 ASP N N 107 121.992 121.992 118.736 3.256 25294 8578 1 20 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.901 -0.307 25294 8579 1 20 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.636 -3.112 25294 8580 1 20 . 1 1 107 107 ASP CB C 107 43.091 43.091 45.323 -2.232 25294 8581 1 20 . 1 1 108 108 GLU N N 108 119.354 119.354 121.480 -2.126 25294 8582 1 20 . 1 1 108 108 GLU HA H 108 5.009 5.009 5.029 -0.020 25294 8583 1 20 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.052 -3.064 25294 8584 1 20 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.994 -1.677 25294 8585 1 20 . 1 1 109 109 PHE N N 109 122.098 122.098 121.748 0.350 25294 8586 1 20 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.911 0.047 25294 8587 1 20 . 1 1 109 109 PHE CA C 109 52.787 52.787 56.441 -3.654 25294 8588 1 20 . 1 1 109 109 PHE CB C 109 40.443 40.443 42.118 -1.675 25294 8589 1 20 . 1 1 110 110 LYS N N 110 124.500 124.500 124.535 -0.035 25294 8590 1 20 . 1 1 110 110 LYS HA H 110 4.692 4.692 5.012 -0.320 25294 8591 1 20 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.153 -3.262 25294 8592 1 20 . 1 1 110 110 LYS CB C 110 33.012 33.012 33.437 -0.425 25294 8593 1 20 . 1 1 111 111 PHE N N 111 125.010 125.010 125.771 -0.761 25294 8594 1 20 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.197 -0.443 25294 8595 1 20 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.850 0.334 25294 8596 1 20 . 1 1 111 111 PHE CB C 111 38.380 38.380 40.795 -2.415 25294 8597 1 20 . 1 1 112 112 VAL N N 112 122.957 122.957 122.335 0.622 25294 8598 1 20 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.747 -0.307 25294 8599 1 20 . 1 1 112 112 VAL CA C 112 58.256 58.256 60.648 -2.392 25294 8600 1 20 . 1 1 112 112 VAL CB C 112 31.093 31.093 34.078 -2.985 25294 8601 1 20 . 1 1 113 113 GLN N N 113 130.864 130.864 126.336 4.528 25294 8602 1 20 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.995 0.324 25294 8603 1 20 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.080 -2.961 25294 8604 1 20 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.072 -3.908 25294 8605 1 20 . 1 1 114 114 ASP N N 114 126.272 126.272 125.710 0.562 25294 8606 1 20 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.621 -0.294 25294 8607 1 20 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.512 -2.739 25294 8608 1 20 . 1 1 114 114 ASP CB C 114 39.855 39.855 43.007 -3.152 25294 8609 1 20 . 1 1 115 115 ALA N N 115 120.134 120.134 122.104 -1.970 25294 8610 1 20 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.151 -0.452 25294 8611 1 20 . 1 1 115 115 ALA CA C 115 48.901 48.901 52.184 -3.283 25294 8612 1 20 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.833 -2.082 25294 8613 1 20 . 1 1 116 116 ALA N N 116 121.377 121.377 125.929 -4.552 25294 8614 1 20 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.428 -0.475 25294 8615 1 20 . 1 1 116 116 ALA CA C 116 49.988 49.988 52.025 -2.037 25294 8616 1 20 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.893 -3.693 25294 8617 1 20 . 1 1 117 117 LYS N N 117 121.536 121.536 123.648 -2.112 25294 8618 1 20 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.505 -0.366 25294 8619 1 20 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.455 -1.809 25294 8620 1 20 . 1 1 117 117 LYS CB C 117 30.579 30.579 32.045 -1.466 25294 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 110 2.883 -0.324 2.878 25294 2 1 1 "Average Difference" HA 112 0.434 0.085 0.427 25294 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25294 4 1 1 "Average Difference" CA 113 2.748 2.538 1.058 25294 5 1 1 "Average Difference" CB 104 2.869 2.540 1.339 25294 6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 25294 7 1 2 "Average Difference" N 110 2.970 -0.466 2.947 25294 8 1 2 "Average Difference" HA 112 0.407 0.092 0.399 25294 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25294 10 1 2 "Average Difference" CA 113 2.765 2.539 1.100 25294 11 1 2 "Average Difference" CB 104 2.799 2.490 1.284 25294 12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 25294 13 1 3 "Average Difference" N 110 3.034 -0.421 3.019 25294 14 1 3 "Average Difference" HA 112 0.400 0.069 0.396 25294 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25294 16 1 3 "Average Difference" CA 113 2.736 2.547 1.004 25294 17 1 3 "Average Difference" CB 104 2.835 2.499 1.346 25294 18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 25294 19 1 4 "Average Difference" N 110 2.647 -0.512 2.609 25294 20 1 4 "Average Difference" HA 112 0.442 0.090 0.435 25294 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25294 22 1 4 "Average Difference" CA 113 2.814 2.614 1.045 25294 23 1 4 "Average Difference" CB 104 2.990 2.704 1.282 25294 24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 25294 25 1 5 "Average Difference" N 110 2.764 -0.195 2.770 25294 26 1 5 "Average Difference" HA 112 0.430 0.085 0.424 25294 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25294 28 1 5 "Average Difference" CA 113 2.768 2.549 1.085 25294 29 1 5 "Average Difference" CB 104 2.859 2.448 1.484 25294 30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 25294 31 1 6 "Average Difference" N 110 2.959 -0.179 2.967 25294 32 1 6 "Average Difference" HA 112 0.457 0.081 0.452 25294 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25294 34 1 6 "Average Difference" CA 113 2.788 2.548 1.137 25294 35 1 6 "Average Difference" CB 104 2.916 2.548 1.424 25294 36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 25294 37 1 7 "Average Difference" N 110 2.752 0.025 2.765 25294 38 1 7 "Average Difference" HA 112 0.467 0.054 0.466 25294 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25294 40 1 7 "Average Difference" CA 113 2.817 2.635 1.001 25294 41 1 7 "Average Difference" CB 104 2.849 2.444 1.472 25294 42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 25294 43 1 8 "Average Difference" N 110 2.831 -0.236 2.834 25294 44 1 8 "Average Difference" HA 112 0.433 0.103 0.422 25294 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25294 46 1 8 "Average Difference" CA 113 2.793 2.548 1.151 25294 47 1 8 "Average Difference" CB 104 2.876 2.548 1.339 25294 48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 25294 49 1 9 "Average Difference" N 110 2.927 -0.433 2.908 25294 50 1 9 "Average Difference" HA 112 0.436 0.085 0.430 25294 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25294 52 1 9 "Average Difference" CA 113 2.780 2.556 1.097 25294 53 1 9 "Average Difference" CB 104 2.942 2.543 1.485 25294 54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 25294 55 1 10 "Average Difference" N 110 2.886 -0.394 2.872 25294 56 1 10 "Average Difference" HA 112 0.428 0.089 0.421 25294 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25294 58 1 10 "Average Difference" CA 113 2.726 2.525 1.031 25294 59 1 10 "Average Difference" CB 104 2.793 2.419 1.404 25294 60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 25294 61 1 11 "Average Difference" N 110 3.159 -0.571 3.121 25294 62 1 11 "Average Difference" HA 112 0.396 0.131 0.375 25294 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25294 64 1 11 "Average Difference" CA 113 2.777 2.559 1.083 25294 65 1 11 "Average Difference" CB 104 3.049 2.759 1.306 25294 66 1 11 "Average Difference" HN 0 0.000 0.000 0.000 25294 67 1 12 "Average Difference" N 110 2.865 -0.497 2.834 25294 68 1 12 "Average Difference" HA 112 0.468 0.076 0.464 25294 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25294 70 1 12 "Average Difference" CA 113 2.878 2.641 1.148 25294 71 1 12 "Average Difference" CB 104 2.891 2.552 1.366 25294 72 1 12 "Average Difference" HN 0 0.000 0.000 0.000 25294 73 1 13 "Average Difference" N 110 3.130 -0.555 3.095 25294 74 1 13 "Average Difference" HA 112 0.444 0.088 0.437 25294 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25294 76 1 13 "Average Difference" CA 113 2.749 2.562 1.001 25294 77 1 13 "Average Difference" CB 104 2.999 2.659 1.393 25294 78 1 13 "Average Difference" HN 0 0.000 0.000 0.000 25294 79 1 14 "Average Difference" N 110 2.886 -0.293 2.884 25294 80 1 14 "Average Difference" HA 112 0.449 0.087 0.442 25294 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25294 82 1 14 "Average Difference" CA 113 2.830 2.578 1.172 25294 83 1 14 "Average Difference" CB 104 2.876 2.476 1.471 25294 84 1 14 "Average Difference" HN 0 0.000 0.000 0.000 25294 85 1 15 "Average Difference" N 110 2.799 -0.594 2.747 25294 86 1 15 "Average Difference" HA 112 0.420 0.091 0.412 25294 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25294 88 1 15 "Average Difference" CA 113 2.738 2.542 1.021 25294 89 1 15 "Average Difference" CB 104 2.891 2.579 1.313 25294 90 1 15 "Average Difference" HN 0 0.000 0.000 0.000 25294 91 1 16 "Average Difference" N 110 3.138 -0.662 3.081 25294 92 1 16 "Average Difference" HA 112 0.445 0.121 0.430 25294 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25294 94 1 16 "Average Difference" CA 113 2.745 2.547 1.030 25294 95 1 16 "Average Difference" CB 104 3.017 2.685 1.383 25294 96 1 16 "Average Difference" HN 0 0.000 0.000 0.000 25294 97 1 17 "Average Difference" N 110 2.828 -0.322 2.822 25294 98 1 17 "Average Difference" HA 112 0.428 0.105 0.417 25294 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25294 100 1 17 "Average Difference" CA 113 2.750 2.546 1.042 25294 101 1 17 "Average Difference" CB 104 2.791 2.478 1.290 25294 102 1 17 "Average Difference" HN 0 0.000 0.000 0.000 25294 103 1 18 "Average Difference" N 110 3.100 -0.628 3.050 25294 104 1 18 "Average Difference" HA 112 0.444 0.106 0.433 25294 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25294 106 1 18 "Average Difference" CA 113 2.794 2.564 1.115 25294 107 1 18 "Average Difference" CB 104 2.918 2.578 1.372 25294 108 1 18 "Average Difference" HN 0 0.000 0.000 0.000 25294 109 1 19 "Average Difference" N 110 2.640 -0.499 2.604 25294 110 1 19 "Average Difference" HA 112 0.414 0.116 0.399 25294 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25294 112 1 19 "Average Difference" CA 113 2.722 2.484 1.119 25294 113 1 19 "Average Difference" CB 104 2.969 2.710 1.217 25294 114 1 19 "Average Difference" HN 0 0.000 0.000 0.000 25294 115 1 20 "Average Difference" N 110 2.892 -0.453 2.869 25294 116 1 20 "Average Difference" HA 112 0.413 0.094 0.404 25294 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25294 118 1 20 "Average Difference" CA 113 2.787 2.576 1.068 25294 119 1 20 "Average Difference" CB 104 2.797 2.540 1.176 25294 120 1 20 "Average Difference" HN 0 0.000 0.000 0.000 25294 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 25294 _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 5 5 SER N N 5 116.267 116.267 116.801 -0.534 25294 2 1 . 1 1 5 5 SER HA H 5 4.349 4.349 4.657 -0.308 25294 3 1 . 1 1 5 5 SER CA C 5 55.478 55.478 57.595 -2.117 25294 4 1 . 1 1 5 5 SER CB C 5 61.191 61.191 64.708 -3.517 25294 5 1 . 1 1 6 6 ASP N N 6 123.039 123.039 122.595 0.444 25294 6 1 . 1 1 6 6 ASP HA H 6 4.827 4.827 4.892 -0.066 25294 7 1 . 1 1 6 6 ASP CA C 6 49.671 49.671 52.441 -2.770 25294 8 1 . 1 1 6 6 ASP CB C 6 38.656 38.656 40.963 -2.307 25294 9 1 . 1 1 7 7 PRO HA H 7 4.317 4.317 4.373 -0.056 25294 10 1 . 1 1 7 7 PRO CA C 7 61.147 61.147 64.360 -3.213 25294 11 1 . 1 1 7 7 PRO CB C 7 29.478 29.478 32.126 -2.648 25294 12 1 . 1 1 8 8 ASP N N 8 119.159 119.159 117.073 2.086 25294 13 1 . 1 1 8 8 ASP HA H 8 4.565 4.565 4.718 -0.153 25294 14 1 . 1 1 8 8 ASP CA C 8 51.860 51.860 54.096 -2.236 25294 15 1 . 1 1 8 8 ASP CB C 8 38.725 38.725 41.076 -2.351 25294 16 1 . 1 1 9 9 GLY N N 9 108.837 108.837 108.971 -0.134 25294 17 1 . 1 1 9 9 GLY CA C 9 43.136 43.136 45.437 -2.301 25294 18 1 . 1 1 10 10 LEU N N 10 121.571 121.571 118.973 2.598 25294 19 1 . 1 1 10 10 LEU HA H 10 4.267 4.267 4.693 -0.426 25294 20 1 . 1 1 10 10 LEU CA C 10 52.391 52.391 53.839 -1.448 25294 21 1 . 1 1 10 10 LEU CB C 10 39.863 39.863 42.962 -3.099 25294 22 1 . 1 1 11 11 ALA N N 11 125.169 125.169 122.410 2.759 25294 23 1 . 1 1 11 11 ALA HA H 11 4.336 4.336 4.557 -0.221 25294 24 1 . 1 1 11 11 ALA CA C 11 48.984 48.984 51.350 -2.366 25294 25 1 . 1 1 11 11 ALA CB C 11 17.182 17.182 19.762 -2.580 25294 26 1 . 1 1 12 12 ASP N N 12 122.672 122.672 123.770 -1.098 25294 27 1 . 1 1 12 12 ASP HA H 12 4.736 4.736 4.912 -0.176 25294 28 1 . 1 1 12 12 ASP CA C 12 49.702 49.702 52.120 -2.418 25294 29 1 . 1 1 12 12 ASP CB C 12 37.831 37.831 42.249 -4.418 25294 30 1 . 1 1 13 13 PRO HA H 13 4.304 4.304 4.472 -0.168 25294 31 1 . 1 1 13 13 PRO CA C 13 59.600 59.600 62.619 -3.018 25294 32 1 . 1 1 13 13 PRO CB C 13 29.516 29.516 32.681 -3.165 25294 33 1 . 1 1 14 14 MET N N 14 120.151 120.151 118.959 1.192 25294 34 1 . 1 1 14 14 MET HA H 14 3.780 3.780 4.559 -0.779 25294 35 1 . 1 1 14 14 MET CA C 14 55.822 55.822 55.946 -0.124 25294 36 1 . 1 1 14 14 MET CB C 14 30.909 30.909 32.529 -1.620 25294 37 1 . 1 1 15 15 LYS N N 15 123.897 123.897 122.606 1.291 25294 38 1 . 1 1 15 15 LYS HA H 15 4.457 4.457 4.601 -0.144 25294 39 1 . 1 1 15 15 LYS CA C 15 51.407 51.407 55.530 -4.123 25294 40 1 . 1 1 15 15 LYS CB C 15 32.453 32.453 34.522 -2.069 25294 41 1 . 1 1 16 16 TRP N N 16 125.776 125.776 124.668 1.108 25294 42 1 . 1 1 16 16 TRP HA H 16 5.075 5.075 5.248 -0.173 25294 43 1 . 1 1 16 16 TRP CA C 16 53.652 53.652 56.742 -3.090 25294 44 1 . 1 1 16 16 TRP CB C 16 28.000 28.000 30.971 -2.971 25294 45 1 . 1 1 17 17 SER N N 17 120.772 120.772 118.541 2.231 25294 46 1 . 1 1 17 17 SER HA H 17 4.403 4.403 4.564 -0.161 25294 47 1 . 1 1 17 17 SER CA C 17 56.167 56.167 59.112 -2.945 25294 48 1 . 1 1 17 17 SER CB C 17 60.833 60.833 63.671 -2.838 25294 49 1 . 1 1 18 18 LYS N N 18 121.096 121.096 121.223 -0.127 25294 50 1 . 1 1 18 18 LYS HA H 18 4.718 4.718 4.583 0.135 25294 51 1 . 1 1 18 18 LYS CA C 18 53.735 53.735 55.634 -1.899 25294 52 1 . 1 1 18 18 LYS CB C 18 32.917 32.917 34.819 -1.902 25294 53 1 . 1 1 19 19 VAL N N 19 116.358 116.358 119.159 -2.801 25294 54 1 . 1 1 19 19 VAL HA H 19 4.423 4.423 4.496 -0.073 25294 55 1 . 1 1 19 19 VAL CA C 19 55.230 55.230 58.495 -3.265 25294 56 1 . 1 1 19 19 VAL CB C 19 31.026 31.026 33.256 -2.230 25294 57 1 . 1 1 20 20 PRO HA H 20 4.303 4.303 4.494 -0.191 25294 58 1 . 1 1 20 20 PRO CA C 20 59.770 59.770 62.315 -2.545 25294 59 1 . 1 1 20 20 PRO CB C 20 29.553 29.553 32.455 -2.902 25294 60 1 . 1 1 21 21 SER N N 21 118.882 118.882 116.684 2.198 25294 61 1 . 1 1 21 21 SER HA H 21 4.084 4.084 4.248 -0.164 25294 62 1 . 1 1 21 21 SER CA C 21 57.657 57.657 60.066 -2.409 25294 63 1 . 1 1 21 21 SER CB C 21 60.173 60.173 63.074 -2.901 25294 64 1 . 1 1 22 22 GLY N N 22 109.523 109.523 109.396 0.128 25294 65 1 . 1 1 22 22 GLY CA C 22 42.404 42.404 44.796 -2.392 25294 66 1 . 1 1 23 23 LEU N N 23 123.003 123.003 122.018 0.985 25294 67 1 . 1 1 23 23 LEU HA H 23 4.034 4.034 4.315 -0.281 25294 68 1 . 1 1 23 23 LEU CA C 23 53.603 53.603 55.411 -1.808 25294 69 1 . 1 1 23 23 LEU CB C 23 40.071 40.071 42.311 -2.240 25294 70 1 . 1 1 24 24 LYS N N 24 129.004 129.004 127.850 1.154 25294 71 1 . 1 1 24 24 LYS HA H 24 4.510 4.510 4.491 0.019 25294 72 1 . 1 1 24 24 LYS CA C 24 53.237 53.237 55.297 -2.060 25294 73 1 . 1 1 24 24 LYS CB C 24 32.161 32.161 33.489 -1.328 25294 74 1 . 1 1 25 25 ASN N N 25 126.336 126.336 123.315 3.021 25294 75 1 . 1 1 25 25 ASN HA H 25 4.324 4.324 4.428 -0.104 25294 76 1 . 1 1 25 25 ASN CA C 25 51.620 51.620 54.020 -2.400 25294 77 1 . 1 1 25 25 ASN CB C 25 34.985 34.985 38.013 -3.028 25294 78 1 . 1 1 26 26 GLY N N 26 103.076 103.076 103.277 -0.201 25294 79 1 . 1 1 26 26 GLY CA C 26 43.549 43.549 45.010 -1.462 25294 80 1 . 1 1 27 27 GLU N N 27 120.878 120.878 121.921 -1.043 25294 81 1 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.941 0.261 25294 82 1 . 1 1 27 27 GLU CA C 27 51.233 51.233 55.260 -4.027 25294 83 1 . 1 1 27 27 GLU CB C 27 30.761 30.761 31.744 -0.983 25294 84 1 . 1 1 28 28 LEU N N 28 128.583 128.583 126.053 2.530 25294 85 1 . 1 1 28 28 LEU HA H 28 4.555 4.555 4.728 -0.173 25294 86 1 . 1 1 28 28 LEU CA C 28 50.324 50.324 53.512 -3.188 25294 87 1 . 1 1 28 28 LEU CB C 28 43.517 43.517 43.236 0.280 25294 88 1 . 1 1 29 29 LYS N N 29 127.554 127.554 124.646 2.908 25294 89 1 . 1 1 29 29 LYS HA H 29 4.901 4.901 4.614 0.287 25294 90 1 . 1 1 29 29 LYS CA C 29 52.839 52.839 55.980 -3.141 25294 91 1 . 1 1 29 29 LYS CB C 29 29.523 29.523 33.460 -3.937 25294 92 1 . 1 1 30 30 VAL N N 30 127.915 127.915 122.908 5.007 25294 93 1 . 1 1 30 30 VAL HA H 30 4.184 4.184 4.493 -0.309 25294 94 1 . 1 1 30 30 VAL CA C 30 58.308 58.308 60.355 -2.047 25294 95 1 . 1 1 30 30 VAL CB C 30 32.270 32.270 35.827 -3.557 25294 96 1 . 1 1 31 31 GLU N N 31 125.151 125.151 124.045 1.106 25294 97 1 . 1 1 31 31 GLU HA H 31 4.361 4.361 4.565 -0.204 25294 98 1 . 1 1 31 31 GLU CA C 31 54.100 54.100 55.205 -1.105 25294 99 1 . 1 1 31 31 GLU CB C 31 27.703 27.703 31.031 -3.328 25294 100 1 . 1 1 32 32 ALA N N 32 126.271 126.271 121.131 5.140 25294 101 1 . 1 1 32 32 ALA HA H 32 4.016 4.016 4.265 -0.249 25294 102 1 . 1 1 32 32 ALA CA C 32 53.127 53.127 53.978 -0.851 25294 103 1 . 1 1 32 32 ALA CB C 32 15.266 15.266 18.219 -2.953 25294 104 1 . 1 1 33 33 GLU N N 33 113.076 113.076 115.875 -2.799 25294 105 1 . 1 1 33 33 GLU HA H 33 3.965 3.965 4.340 -0.375 25294 106 1 . 1 1 33 33 GLU CA C 33 55.985 55.985 56.399 -0.414 25294 107 1 . 1 1 33 33 GLU CB C 33 26.929 26.929 30.612 -3.683 25294 108 1 . 1 1 34 34 GLY N N 34 104.905 104.905 108.265 -3.360 25294 109 1 . 1 1 34 34 GLY CA C 34 40.707 40.707 45.113 -4.406 25294 110 1 . 1 1 35 35 GLY N N 35 105.946 105.946 106.512 -0.566 25294 111 1 . 1 1 35 35 GLY CA C 35 42.988 42.988 44.605 -1.617 25294 112 1 . 1 1 36 36 SER N N 36 116.044 116.044 115.328 0.716 25294 113 1 . 1 1 36 36 SER HA H 36 5.539 5.539 5.300 0.239 25294 114 1 . 1 1 36 36 SER CA C 36 54.323 54.323 57.478 -3.155 25294 115 1 . 1 1 36 36 SER CB C 36 62.808 62.808 65.467 -2.659 25294 116 1 . 1 1 37 37 SER N N 37 119.501 119.501 116.576 2.925 25294 117 1 . 1 1 37 37 SER HA H 37 4.712 4.712 4.702 0.010 25294 118 1 . 1 1 37 37 SER CA C 37 55.548 55.548 57.674 -2.126 25294 119 1 . 1 1 37 37 SER CB C 37 63.943 63.943 65.967 -2.024 25294 120 1 . 1 1 38 38 LEU N N 38 125.962 125.962 122.886 3.076 25294 121 1 . 1 1 38 38 LEU HA H 38 5.253 5.253 4.950 0.303 25294 122 1 . 1 1 38 38 LEU CA C 38 51.782 51.782 54.620 -2.838 25294 123 1 . 1 1 38 38 LEU CB C 38 42.834 42.834 45.488 -2.654 25294 124 1 . 1 1 39 39 PHE N N 39 124.707 124.707 123.800 0.907 25294 125 1 . 1 1 39 39 PHE HA H 39 5.139 5.139 5.160 -0.021 25294 126 1 . 1 1 39 39 PHE CA C 39 52.131 52.131 56.039 -3.908 25294 127 1 . 1 1 39 39 PHE CB C 39 38.952 38.952 41.203 -2.251 25294 128 1 . 1 1 40 40 ALA N N 40 124.994 124.994 126.888 -1.894 25294 129 1 . 1 1 40 40 ALA HA H 40 5.635 5.635 5.304 0.331 25294 130 1 . 1 1 40 40 ALA CA C 40 48.301 48.301 50.405 -2.105 25294 131 1 . 1 1 40 40 ALA CB C 40 19.446 19.446 20.247 -0.801 25294 132 1 . 1 1 41 41 CYS N N 41 125.757 125.757 124.551 1.206 25294 133 1 . 1 1 41 41 CYS HA H 41 4.146 4.146 4.212 -0.066 25294 134 1 . 1 1 41 41 CYS CA C 41 56.465 56.465 59.343 -2.878 25294 135 1 . 1 1 41 41 CYS CB C 41 25.973 25.973 27.808 -1.835 25294 136 1 . 1 1 42 42 LYS N N 42 129.019 129.019 126.692 2.327 25294 137 1 . 1 1 42 42 LYS HA H 42 4.260 4.260 4.275 -0.015 25294 138 1 . 1 1 42 42 LYS CA C 42 54.851 54.851 57.417 -2.566 25294 139 1 . 1 1 42 42 LYS CB C 42 32.107 32.107 32.827 -0.720 25294 140 1 . 1 1 43 43 ASN N N 43 113.240 113.240 115.162 -1.922 25294 141 1 . 1 1 43 43 ASN HA H 43 4.525 4.525 4.599 -0.074 25294 142 1 . 1 1 43 43 ASN CA C 43 50.235 50.235 53.238 -3.003 25294 143 1 . 1 1 43 43 ASN CB C 43 34.861 34.861 39.626 -4.765 25294 144 1 . 1 1 44 44 TYR N N 44 119.335 119.335 118.769 0.566 25294 145 1 . 1 1 44 44 TYR HA H 44 4.557 4.557 4.587 -0.030 25294 146 1 . 1 1 44 44 TYR CA C 44 55.718 55.718 57.940 -2.222 25294 147 1 . 1 1 44 44 TYR CB C 44 37.372 37.372 41.179 -3.807 25294 148 1 . 1 1 45 45 LYS N N 45 120.676 120.676 121.602 -0.926 25294 149 1 . 1 1 45 45 LYS HA H 45 4.036 4.036 4.723 -0.687 25294 150 1 . 1 1 45 45 LYS CA C 45 54.538 54.538 56.319 -1.781 25294 151 1 . 1 1 45 45 LYS CB C 45 30.233 30.233 33.146 -2.913 25294 152 1 . 1 1 46 46 SER N N 46 108.797 108.797 114.547 -5.750 25294 153 1 . 1 1 46 46 SER HA H 46 4.388 4.388 4.745 -0.357 25294 154 1 . 1 1 46 46 SER CA C 46 53.664 53.664 58.032 -4.368 25294 155 1 . 1 1 46 46 SER CB C 46 61.810 61.810 63.681 -1.871 25294 156 1 . 1 1 47 47 PHE N N 47 117.325 117.325 119.656 -2.331 25294 157 1 . 1 1 47 47 PHE HA H 47 4.642 4.642 5.305 -0.663 25294 158 1 . 1 1 47 47 PHE CA C 47 53.617 53.617 56.591 -2.974 25294 159 1 . 1 1 47 47 PHE CB C 47 37.101 37.101 42.105 -5.004 25294 160 1 . 1 1 48 48 TRP N N 48 117.090 117.090 117.435 -0.345 25294 161 1 . 1 1 48 48 TRP HA H 48 5.235 5.235 5.213 0.022 25294 162 1 . 1 1 48 48 TRP CA C 48 53.492 53.492 55.215 -1.723 25294 163 1 . 1 1 48 48 TRP CB C 48 29.895 29.895 31.327 -1.432 25294 164 1 . 1 1 49 49 ILE N N 49 119.682 119.682 120.785 -1.103 25294 165 1 . 1 1 49 49 ILE HA H 49 4.031 4.031 4.379 -0.347 25294 166 1 . 1 1 49 49 ILE CA C 49 60.473 60.473 61.434 -0.961 25294 167 1 . 1 1 49 49 ILE CB C 49 36.436 36.436 36.906 -0.470 25294 168 1 . 1 1 50 50 SER N N 50 124.071 124.071 122.117 1.954 25294 169 1 . 1 1 50 50 SER HA H 50 4.708 4.708 4.788 -0.080 25294 170 1 . 1 1 50 50 SER CA C 50 56.110 56.110 58.413 -2.303 25294 171 1 . 1 1 50 50 SER CB C 50 63.816 63.816 64.722 -0.906 25294 172 1 . 1 1 51 51 SER N N 51 111.253 111.253 115.421 -4.168 25294 173 1 . 1 1 51 51 SER HA H 51 4.557 4.557 4.700 -0.143 25294 174 1 . 1 1 51 51 SER CA C 51 55.564 55.564 57.545 -1.981 25294 175 1 . 1 1 51 51 SER CB C 51 62.821 62.821 65.954 -3.133 25294 176 1 . 1 1 52 52 VAL N N 52 121.147 121.147 121.221 -0.074 25294 177 1 . 1 1 52 52 VAL HA H 52 4.731 4.731 4.685 0.046 25294 178 1 . 1 1 52 52 VAL CA C 52 59.126 59.126 60.278 -1.152 25294 179 1 . 1 1 52 52 VAL CB C 52 32.500 32.500 35.290 -2.790 25294 180 1 . 1 1 53 53 LYS N N 53 126.128 126.128 124.864 1.264 25294 181 1 . 1 1 53 53 LYS HA H 53 5.007 5.007 4.817 0.190 25294 182 1 . 1 1 53 53 LYS CA C 53 51.723 51.723 54.590 -2.867 25294 183 1 . 1 1 53 53 LYS CB C 53 33.772 33.772 35.212 -1.441 25294 184 1 . 1 1 54 54 GLU N N 54 124.160 124.160 122.563 1.597 25294 185 1 . 1 1 54 54 GLU HA H 54 4.758 4.758 3.852 0.906 25294 186 1 . 1 1 54 54 GLU CA C 54 53.259 53.259 55.914 -2.655 25294 187 1 . 1 1 54 54 GLU CB C 54 31.059 31.059 31.551 -0.492 25294 188 1 . 1 1 55 55 GLU N N 55 127.218 127.218 118.714 8.504 25294 189 1 . 1 1 55 55 GLU HA H 55 3.908 3.908 4.470 -0.562 25294 190 1 . 1 1 55 55 GLU CA C 55 54.546 54.546 56.209 -1.663 25294 191 1 . 1 1 55 55 GLU CB C 55 25.294 25.294 30.675 -5.381 25294 192 1 . 1 1 56 56 GLY N N 56 104.894 104.894 108.315 -3.421 25294 193 1 . 1 1 56 56 GLY CA C 56 42.881 42.881 46.130 -3.249 25294 194 1 . 1 1 57 57 LYS N N 57 120.444 120.444 117.551 2.893 25294 195 1 . 1 1 57 57 LYS HA H 57 4.564 4.564 4.726 -0.162 25294 196 1 . 1 1 57 57 LYS CA C 57 51.959 51.959 54.092 -2.133 25294 197 1 . 1 1 57 57 LYS CB C 57 32.188 32.188 34.823 -2.635 25294 198 1 . 1 1 58 58 PHE N N 58 121.824 121.824 120.151 1.673 25294 199 1 . 1 1 58 58 PHE HA H 58 4.771 4.771 5.152 -0.381 25294 200 1 . 1 1 58 58 PHE CA C 58 56.165 56.165 56.669 -0.504 25294 201 1 . 1 1 58 58 PHE CB C 58 36.902 36.902 40.176 -3.274 25294 202 1 . 1 1 59 59 LYS N N 59 123.205 123.205 121.315 1.890 25294 203 1 . 1 1 59 59 LYS HA H 59 4.451 4.451 4.722 -0.271 25294 204 1 . 1 1 59 59 LYS CA C 59 50.985 50.985 55.047 -4.062 25294 205 1 . 1 1 59 59 LYS CB C 59 29.791 29.791 34.487 -4.696 25294 206 1 . 1 1 60 60 GLU N N 60 122.647 122.647 119.262 3.385 25294 207 1 . 1 1 60 60 GLU HA H 60 4.260 4.260 4.388 -0.128 25294 208 1 . 1 1 60 60 GLU CA C 60 53.906 53.906 55.942 -2.036 25294 209 1 . 1 1 60 60 GLU CB C 60 27.663 27.663 30.714 -3.051 25294 210 1 . 1 1 61 61 ASN N N 61 119.907 119.907 118.233 1.674 25294 211 1 . 1 1 61 61 ASN HA H 61 4.845 4.845 4.930 -0.085 25294 212 1 . 1 1 61 61 ASN CA C 61 50.752 50.752 53.047 -2.295 25294 213 1 . 1 1 61 61 ASN CB C 61 36.023 36.023 40.039 -4.016 25294 214 1 . 1 1 62 62 THR N N 62 113.271 113.271 114.874 -1.603 25294 215 1 . 1 1 62 62 THR HA H 62 4.308 4.308 4.409 -0.101 25294 216 1 . 1 1 62 62 THR CA C 62 59.310 59.310 62.441 -3.131 25294 217 1 . 1 1 62 62 THR CB C 62 66.813 66.813 69.132 -2.319 25294 218 1 . 1 1 63 63 SER N N 63 116.521 116.521 115.154 1.367 25294 219 1 . 1 1 63 63 SER HA H 63 4.650 4.650 4.532 0.118 25294 220 1 . 1 1 63 63 SER CA C 63 54.094 54.094 57.522 -3.428 25294 221 1 . 1 1 63 63 SER CB C 63 61.617 61.617 64.617 -3.000 25294 222 1 . 1 1 64 64 TYR N N 64 120.183 120.183 119.487 0.696 25294 223 1 . 1 1 64 64 TYR HA H 64 4.838 4.838 4.926 -0.088 25294 224 1 . 1 1 64 64 TYR CA C 64 56.403 56.403 58.194 -1.791 25294 225 1 . 1 1 64 64 TYR CB C 64 36.569 36.569 39.302 -2.733 25294 226 1 . 1 1 65 65 LYS N N 65 115.195 115.195 115.786 -0.591 25294 227 1 . 1 1 65 65 LYS HA H 65 4.721 4.721 4.591 0.130 25294 228 1 . 1 1 65 65 LYS CA C 65 52.706 52.706 56.379 -3.673 25294 229 1 . 1 1 65 65 LYS CB C 65 31.820 31.820 34.291 -2.471 25294 230 1 . 1 1 66 66 GLU N N 66 117.231 117.231 119.247 -2.016 25294 231 1 . 1 1 66 66 GLU HA H 66 5.213 5.213 5.046 0.167 25294 232 1 . 1 1 66 66 GLU CA C 66 52.613 52.613 55.237 -2.624 25294 233 1 . 1 1 66 66 GLU CB C 66 30.793 30.793 33.628 -2.835 25294 234 1 . 1 1 67 67 PHE N N 67 121.532 121.532 121.760 -0.228 25294 235 1 . 1 1 67 67 PHE HA H 67 4.430 4.430 4.807 -0.377 25294 236 1 . 1 1 67 67 PHE CA C 67 56.269 56.269 57.315 -1.046 25294 237 1 . 1 1 67 67 PHE CB C 67 40.275 40.275 42.761 -2.486 25294 238 1 . 1 1 68 68 ASP N N 68 128.157 128.157 125.786 2.371 25294 239 1 . 1 1 68 68 ASP HA H 68 4.428 4.428 4.826 -0.398 25294 240 1 . 1 1 68 68 ASP CA C 68 49.556 49.556 52.429 -2.873 25294 241 1 . 1 1 68 68 ASP CB C 68 38.424 38.424 41.565 -3.141 25294 242 1 . 1 1 69 69 GLY N N 69 114.151 114.151 109.673 4.478 25294 243 1 . 1 1 69 69 GLY CA C 69 40.899 40.899 44.332 -3.433 25294 244 1 . 1 1 70 70 GLY N N 70 113.714 113.714 110.605 3.109 25294 245 1 . 1 1 70 70 GLY CA C 70 43.994 43.994 45.755 -1.761 25294 246 1 . 1 1 71 71 TRP N N 71 117.823 117.823 120.391 -2.568 25294 247 1 . 1 1 71 71 TRP HA H 71 4.808 4.808 4.741 0.067 25294 248 1 . 1 1 71 71 TRP CA C 71 52.777 52.777 56.005 -3.228 25294 249 1 . 1 1 71 71 TRP CB C 71 25.645 25.645 30.055 -4.410 25294 250 1 . 1 1 72 72 TYR N N 72 114.204 114.204 120.162 -5.958 25294 251 1 . 1 1 72 72 TYR HA H 72 5.125 5.125 4.908 0.217 25294 252 1 . 1 1 72 72 TYR CA C 72 51.435 51.435 56.981 -5.546 25294 253 1 . 1 1 72 72 TYR CB C 72 38.620 38.620 40.557 -1.937 25294 254 1 . 1 1 73 73 LEU N N 73 121.469 121.469 126.571 -5.102 25294 255 1 . 1 1 73 73 LEU HA H 73 4.767 4.767 4.938 -0.171 25294 256 1 . 1 1 73 73 LEU CA C 73 51.332 51.332 53.492 -2.160 25294 257 1 . 1 1 73 73 LEU CB C 73 43.403 43.403 46.000 -2.597 25294 258 1 . 1 1 74 74 VAL N N 74 124.558 124.558 125.220 -0.662 25294 259 1 . 1 1 74 74 VAL HA H 74 4.783 4.783 4.683 0.100 25294 260 1 . 1 1 74 74 VAL CA C 74 57.812 57.812 60.798 -2.986 25294 261 1 . 1 1 74 74 VAL CB C 74 31.820 31.820 33.915 -2.095 25294 262 1 . 1 1 75 75 LYS N N 75 125.824 125.824 126.053 -0.229 25294 263 1 . 1 1 75 75 LYS HA H 75 5.110 5.110 5.090 0.020 25294 264 1 . 1 1 75 75 LYS CA C 75 52.804 52.804 55.447 -2.643 25294 265 1 . 1 1 75 75 LYS CB C 75 34.575 34.575 36.903 -2.328 25294 266 1 . 1 1 76 76 ILE N N 76 124.647 124.647 124.692 -0.045 25294 267 1 . 1 1 76 76 ILE HA H 76 5.078 5.078 4.519 0.559 25294 268 1 . 1 1 76 76 ILE CA C 76 57.367 57.367 60.830 -3.463 25294 269 1 . 1 1 76 76 ILE CB C 76 37.593 37.593 39.191 -1.598 25294 270 1 . 1 1 77 77 GLU N N 77 128.081 128.081 128.020 0.061 25294 271 1 . 1 1 77 77 GLU HA H 77 4.444 4.444 4.593 -0.149 25294 272 1 . 1 1 77 77 GLU CA C 77 52.471 52.471 55.177 -2.706 25294 273 1 . 1 1 77 77 GLU CB C 77 29.914 29.914 31.494 -1.580 25294 274 1 . 1 1 78 78 ASP N N 78 126.158 126.158 123.974 2.184 25294 275 1 . 1 1 78 78 ASP HA H 78 4.100 4.100 4.228 -0.128 25294 276 1 . 1 1 78 78 ASP CA C 78 54.063 54.063 57.389 -3.326 25294 277 1 . 1 1 78 78 ASP CB C 78 36.738 36.738 40.495 -3.757 25294 278 1 . 1 1 79 79 ASN N N 79 118.653 118.653 116.267 2.386 25294 279 1 . 1 1 79 79 ASN HA H 79 4.646 4.646 4.948 -0.302 25294 280 1 . 1 1 79 79 ASN CA C 79 51.209 51.209 53.340 -2.131 25294 281 1 . 1 1 79 79 ASN CB C 79 35.350 35.350 40.465 -5.115 25294 282 1 . 1 1 80 80 GLU N N 80 120.378 120.378 121.943 -1.565 25294 283 1 . 1 1 80 80 GLU HA H 80 5.509 5.509 5.162 0.347 25294 284 1 . 1 1 80 80 GLU CA C 80 52.860 52.860 55.610 -2.750 25294 285 1 . 1 1 80 80 GLU CB C 80 29.673 29.673 30.969 -1.296 25294 286 1 . 1 1 81 81 LEU N N 81 125.771 125.771 128.423 -2.652 25294 287 1 . 1 1 81 81 LEU HA H 81 4.966 4.966 5.148 -0.182 25294 288 1 . 1 1 81 81 LEU CA C 81 51.014 51.014 54.618 -3.604 25294 289 1 . 1 1 81 81 LEU CB C 81 42.550 42.550 44.014 -1.464 25294 290 1 . 1 1 82 82 LYS N N 82 128.076 128.076 125.723 2.353 25294 291 1 . 1 1 82 82 LYS HA H 82 5.245 5.245 5.274 -0.029 25294 292 1 . 1 1 82 82 LYS CA C 82 52.332 52.332 54.740 -2.408 25294 293 1 . 1 1 82 82 LYS CB C 82 32.179 32.179 36.027 -3.848 25294 294 1 . 1 1 83 83 VAL N N 83 124.216 124.216 120.123 4.092 25294 295 1 . 1 1 83 83 VAL HA H 83 4.908 4.908 4.994 -0.086 25294 296 1 . 1 1 83 83 VAL CA C 83 58.380 58.380 59.863 -1.483 25294 297 1 . 1 1 83 83 VAL CB C 83 32.168 32.168 34.965 -2.798 25294 298 1 . 1 1 84 84 ILE N N 84 129.084 129.084 125.939 3.145 25294 299 1 . 1 1 84 84 ILE HA H 84 4.530 4.530 4.542 -0.012 25294 300 1 . 1 1 84 84 ILE CA C 84 58.406 58.406 59.956 -1.550 25294 301 1 . 1 1 84 84 ILE CB C 84 38.166 38.166 40.990 -2.824 25294 302 1 . 1 1 85 85 ILE N N 85 127.360 127.360 125.259 2.101 25294 303 1 . 1 1 85 85 ILE HA H 85 4.585 4.585 4.658 -0.072 25294 304 1 . 1 1 85 85 ILE CA C 85 58.460 58.460 59.866 -1.406 25294 305 1 . 1 1 85 85 ILE CB C 85 38.498 38.498 40.212 -1.714 25294 306 1 . 1 1 86 86 ASN N N 86 128.337 128.337 124.360 3.977 25294 307 1 . 1 1 86 86 ASN HA H 86 4.766 4.766 4.898 -0.132 25294 308 1 . 1 1 86 86 ASN CA C 86 50.182 50.182 52.843 -2.661 25294 309 1 . 1 1 86 86 ASN CB C 86 36.891 36.891 40.312 -3.421 25294 310 1 . 1 1 87 87 ARG N N 87 119.368 119.368 120.258 -0.890 25294 311 1 . 1 1 87 87 ARG HA H 87 3.991 3.991 4.240 -0.249 25294 312 1 . 1 1 87 87 ARG CA C 87 54.198 54.198 56.513 -2.315 25294 313 1 . 1 1 87 87 ARG CB C 87 28.403 28.403 30.673 -2.270 25294 314 1 . 1 1 88 88 ASN N N 88 125.082 125.082 124.018 1.064 25294 315 1 . 1 1 88 88 ASN HA H 88 4.725 4.725 4.515 0.210 25294 316 1 . 1 1 88 88 ASN CA C 88 49.103 49.103 53.149 -4.046 25294 317 1 . 1 1 88 88 ASN CB C 88 34.757 34.757 38.942 -4.185 25294 318 1 . 1 1 89 89 GLU N N 89 125.309 125.309 122.610 2.699 25294 319 1 . 1 1 89 89 GLU HA H 89 4.358 4.358 4.343 0.015 25294 320 1 . 1 1 89 89 GLU CA C 89 53.013 53.013 56.307 -3.294 25294 321 1 . 1 1 89 89 GLU CB C 89 27.084 27.084 29.497 -2.413 25294 322 1 . 1 1 90 90 THR N N 90 112.516 112.516 111.759 0.757 25294 323 1 . 1 1 90 90 THR HA H 90 4.534 4.534 4.554 -0.020 25294 324 1 . 1 1 90 90 THR CA C 90 58.161 58.161 59.883 -1.722 25294 325 1 . 1 1 90 90 THR CB C 90 68.409 68.409 71.947 -3.538 25294 326 1 . 1 1 91 91 ASN N N 91 116.717 116.717 119.448 -2.731 25294 327 1 . 1 1 91 91 ASN HA H 91 4.707 4.707 4.780 -0.073 25294 328 1 . 1 1 91 91 ASN CA C 91 49.796 49.796 53.420 -3.624 25294 329 1 . 1 1 91 91 ASN CB C 91 35.474 35.474 38.110 -2.636 25294 330 1 . 1 1 92 92 ALA N N 92 122.025 122.025 122.521 -0.496 25294 331 1 . 1 1 92 92 ALA HA H 92 4.636 4.636 4.584 0.052 25294 332 1 . 1 1 92 92 ALA CA C 92 48.049 48.049 50.548 -2.499 25294 333 1 . 1 1 92 92 ALA CB C 92 19.716 19.716 20.807 -1.091 25294 334 1 . 1 1 93 93 SER N N 93 115.895 115.895 118.888 -2.993 25294 335 1 . 1 1 93 93 SER HA H 93 4.536 4.536 4.679 -0.143 25294 336 1 . 1 1 93 93 SER CA C 93 54.865 54.865 58.472 -3.607 25294 337 1 . 1 1 93 93 SER CB C 93 61.292 61.292 64.194 -2.902 25294 338 1 . 1 1 94 94 ARG N N 94 119.529 119.529 120.795 -1.266 25294 339 1 . 1 1 94 94 ARG HA H 94 4.914 4.914 4.803 0.111 25294 340 1 . 1 1 94 94 ARG CA C 94 52.096 52.096 54.652 -2.556 25294 341 1 . 1 1 94 94 ARG CB C 94 29.512 29.512 33.079 -3.567 25294 342 1 . 1 1 95 95 SER N N 95 114.542 114.542 114.234 0.308 25294 343 1 . 1 1 95 95 SER HA H 95 5.926 5.926 5.101 0.825 25294 344 1 . 1 1 95 95 SER CA C 95 54.219 54.219 57.608 -3.389 25294 345 1 . 1 1 95 95 SER CB C 95 65.271 65.271 66.079 -0.808 25294 346 1 . 1 1 96 96 PHE N N 96 117.183 117.183 119.500 -2.317 25294 347 1 . 1 1 96 96 PHE HA H 96 5.338 5.338 5.114 0.224 25294 348 1 . 1 1 96 96 PHE CA C 96 54.480 54.480 56.751 -2.271 25294 349 1 . 1 1 96 96 PHE CB C 96 38.868 38.868 42.968 -4.100 25294 350 1 . 1 1 97 97 THR N N 97 115.263 115.263 116.652 -1.389 25294 351 1 . 1 1 97 97 THR HA H 97 5.250 5.250 5.164 0.086 25294 352 1 . 1 1 97 97 THR CA C 97 58.178 58.178 61.706 -3.528 25294 353 1 . 1 1 97 97 THR CB C 97 69.068 69.068 71.722 -2.654 25294 354 1 . 1 1 98 98 VAL N N 98 125.442 125.442 122.767 2.675 25294 355 1 . 1 1 98 98 VAL HA H 98 4.857 4.857 4.639 0.218 25294 356 1 . 1 1 98 98 VAL CA C 98 57.409 57.409 60.535 -3.126 25294 357 1 . 1 1 98 98 VAL CB C 98 32.929 32.929 33.832 -0.903 25294 358 1 . 1 1 99 99 CYS N N 99 127.111 127.111 125.861 1.250 25294 359 1 . 1 1 99 99 CYS HA H 99 5.346 5.346 5.120 0.226 25294 360 1 . 1 1 99 99 CYS CA C 99 53.951 53.951 56.857 -2.906 25294 361 1 . 1 1 99 99 CYS CB C 99 25.942 25.942 29.943 -4.001 25294 362 1 . 1 1 100 100 VAL N N 100 120.146 120.146 120.151 -0.005 25294 363 1 . 1 1 100 100 VAL HA H 100 5.383 5.383 5.157 0.226 25294 364 1 . 1 1 100 100 VAL CA C 100 55.713 55.713 59.473 -3.760 25294 365 1 . 1 1 100 100 VAL CB C 100 32.643 32.643 34.899 -2.256 25294 366 1 . 1 1 101 101 GLU N N 101 118.807 118.807 122.430 -3.623 25294 367 1 . 1 1 101 101 GLU HA H 101 4.752 4.752 4.726 0.026 25294 368 1 . 1 1 101 101 GLU CA C 101 51.435 51.435 54.186 -2.751 25294 369 1 . 1 1 101 101 GLU CB C 101 31.721 31.721 32.975 -1.254 25294 370 1 . 1 1 102 102 ALA N N 102 124.088 124.088 125.274 -1.186 25294 371 1 . 1 1 102 102 ALA HA H 102 3.857 3.857 4.805 -0.948 25294 372 1 . 1 1 102 102 ALA CA C 102 47.878 47.878 50.610 -2.732 25294 373 1 . 1 1 102 102 ALA CB C 102 18.025 18.025 19.574 -1.549 25294 374 1 . 1 1 103 103 GLY N N 103 111.186 111.186 109.807 1.379 25294 375 1 . 1 1 103 103 GLY CA C 103 44.643 44.643 46.325 -1.682 25294 376 1 . 1 1 104 104 ASN N N 104 123.092 123.092 121.905 1.187 25294 377 1 . 1 1 104 104 ASN HA H 104 4.672 4.672 4.736 -0.065 25294 378 1 . 1 1 104 104 ASN CA C 104 50.696 50.696 53.262 -2.566 25294 379 1 . 1 1 104 104 ASN CB C 104 36.407 36.407 39.332 -2.925 25294 380 1 . 1 1 105 105 ALA N N 105 122.653 122.653 119.813 2.840 25294 381 1 . 1 1 105 105 ALA HA H 105 4.431 4.431 4.386 0.045 25294 382 1 . 1 1 105 105 ALA CA C 105 48.668 48.668 51.157 -2.489 25294 383 1 . 1 1 105 105 ALA CB C 105 18.936 18.936 20.955 -2.019 25294 384 1 . 1 1 106 106 PHE N N 106 116.011 116.011 114.757 1.254 25294 385 1 . 1 1 106 106 PHE HA H 106 5.417 5.417 5.163 0.254 25294 386 1 . 1 1 106 106 PHE CA C 106 53.558 53.558 56.340 -2.782 25294 387 1 . 1 1 106 106 PHE CB C 106 40.484 40.484 42.337 -1.853 25294 388 1 . 1 1 107 107 ASP N N 107 121.992 121.992 120.682 1.310 25294 389 1 . 1 1 107 107 ASP HA H 107 4.594 4.594 4.760 -0.166 25294 390 1 . 1 1 107 107 ASP CA C 107 50.524 50.524 53.067 -2.543 25294 391 1 . 1 1 107 107 ASP CB C 107 43.091 43.091 44.370 -1.279 25294 392 1 . 1 1 108 108 GLU N N 108 119.354 119.354 122.059 -2.705 25294 393 1 . 1 1 108 108 GLU HA H 108 5.009 5.009 4.649 0.360 25294 394 1 . 1 1 108 108 GLU CA C 108 51.988 51.988 55.092 -3.104 25294 395 1 . 1 1 108 108 GLU CB C 108 31.317 31.317 32.249 -0.932 25294 396 1 . 1 1 109 109 PHE N N 109 122.098 122.098 123.297 -1.199 25294 397 1 . 1 1 109 109 PHE HA H 109 4.958 4.958 4.911 0.047 25294 398 1 . 1 1 109 109 PHE CA C 109 52.787 52.787 55.844 -3.057 25294 399 1 . 1 1 109 109 PHE CB C 109 40.443 40.443 41.081 -0.638 25294 400 1 . 1 1 110 110 LYS N N 110 124.500 124.500 123.910 0.590 25294 401 1 . 1 1 110 110 LYS HA H 110 4.692 4.692 4.789 -0.097 25294 402 1 . 1 1 110 110 LYS CA C 110 51.891 51.891 55.534 -3.643 25294 403 1 . 1 1 110 110 LYS CB C 110 33.012 33.012 33.476 -0.464 25294 404 1 . 1 1 111 111 PHE N N 111 125.010 125.010 123.481 1.529 25294 405 1 . 1 1 111 111 PHE HA H 111 4.754 4.754 5.231 -0.477 25294 406 1 . 1 1 111 111 PHE CA C 111 58.184 58.184 57.450 0.734 25294 407 1 . 1 1 111 111 PHE CB C 111 38.380 38.380 41.968 -3.588 25294 408 1 . 1 1 112 112 VAL N N 112 122.957 122.957 120.836 2.121 25294 409 1 . 1 1 112 112 VAL HA H 112 4.440 4.440 4.747 -0.307 25294 410 1 . 1 1 112 112 VAL CA C 112 58.256 58.256 60.711 -2.455 25294 411 1 . 1 1 112 112 VAL CB C 112 31.093 31.093 34.981 -3.888 25294 412 1 . 1 1 113 113 GLN N N 113 130.864 130.864 126.813 4.051 25294 413 1 . 1 1 113 113 GLN HA H 113 5.319 5.319 4.989 0.330 25294 414 1 . 1 1 113 113 GLN CA C 113 51.119 51.119 54.144 -3.025 25294 415 1 . 1 1 113 113 GLN CB C 113 28.164 28.164 32.060 -3.896 25294 416 1 . 1 1 114 114 ASP N N 114 126.272 126.272 126.516 -0.244 25294 417 1 . 1 1 114 114 ASP HA H 114 4.327 4.327 4.625 -0.298 25294 418 1 . 1 1 114 114 ASP CA C 114 51.773 51.773 54.810 -3.037 25294 419 1 . 1 1 114 114 ASP CB C 114 39.855 39.855 42.799 -2.944 25294 420 1 . 1 1 115 115 ALA N N 115 120.134 120.134 121.705 -1.571 25294 421 1 . 1 1 115 115 ALA HA H 115 3.699 3.699 4.364 -0.665 25294 422 1 . 1 1 115 115 ALA CA C 115 48.901 48.901 51.921 -3.020 25294 423 1 . 1 1 115 115 ALA CB C 115 17.751 17.751 19.970 -2.219 25294 424 1 . 1 1 116 116 ALA N N 116 121.377 121.377 124.500 -3.123 25294 425 1 . 1 1 116 116 ALA HA H 116 3.953 3.953 4.348 -0.395 25294 426 1 . 1 1 116 116 ALA CA C 116 49.988 49.988 51.827 -1.839 25294 427 1 . 1 1 116 116 ALA CB C 116 16.200 16.200 19.535 -3.335 25294 428 1 . 1 1 117 117 LYS N N 117 121.536 121.536 124.609 -3.073 25294 429 1 . 1 1 117 117 LYS HA H 117 4.139 4.139 4.379 -0.240 25294 430 1 . 1 1 117 117 LYS CA C 117 53.646 53.646 55.755 -2.109 25294 431 1 . 1 1 117 117 LYS CB C 117 30.579 30.579 31.660 -1.081 25294 stop_ save_