data_25259 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25259 _Entry.PDB_ID 2MVB 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 25259 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.114 -0.439 25259 2 1 1 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.693 -2.885 25259 3 1 1 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.068 -2.998 25259 4 1 1 . 1 1 3 3 ALA N N 3 126.741 126.741 121.659 5.082 25259 5 1 1 . 1 1 3 3 ALA HA H 3 4.494 4.494 5.072 -0.578 25259 6 1 1 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.541 -1.339 25259 7 1 1 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.246 -4.428 25259 8 1 1 . 1 1 3 3 ALA H H 3 8.440 8.440 8.743 -0.303 25259 9 1 1 . 1 1 4 4 THR N N 4 116.015 116.015 113.981 2.034 25259 10 1 1 . 1 1 4 4 THR HA H 4 4.393 4.393 4.858 -0.465 25259 11 1 1 . 1 1 4 4 THR CA C 4 59.148 59.148 61.598 -2.450 25259 12 1 1 . 1 1 4 4 THR CB C 4 67.580 67.580 70.572 -2.991 25259 13 1 1 . 1 1 4 4 THR H H 4 8.050 8.050 8.317 -0.267 25259 14 1 1 . 1 1 5 5 LYS N N 5 126.350 126.350 121.291 5.059 25259 15 1 1 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.888 -0.383 25259 16 1 1 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.488 -1.571 25259 17 1 1 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.342 -3.658 25259 18 1 1 . 1 1 5 5 LYS H H 5 8.332 8.332 8.672 -0.340 25259 19 1 1 . 1 1 6 6 THR N N 6 118.124 118.124 112.434 5.690 25259 20 1 1 . 1 1 6 6 THR HA H 6 4.440 4.440 4.654 -0.214 25259 21 1 1 . 1 1 6 6 THR CA C 6 59.282 59.282 61.372 -2.090 25259 22 1 1 . 1 1 6 6 THR CB C 6 67.685 67.685 71.007 -3.322 25259 23 1 1 . 1 1 6 6 THR H H 6 8.283 8.283 8.513 -0.230 25259 24 1 1 . 1 1 7 7 GLU N N 7 125.934 125.934 120.264 5.670 25259 25 1 1 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.928 -0.585 25259 26 1 1 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.428 -1.246 25259 27 1 1 . 1 1 7 7 GLU CB C 7 27.816 27.816 31.941 -4.125 25259 28 1 1 . 1 1 7 7 GLU H H 7 8.487 8.487 8.619 -0.132 25259 29 1 1 . 1 1 8 8 LYS N N 8 123.945 123.945 119.268 4.677 25259 30 1 1 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.604 -1.669 25259 31 1 1 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.759 -4.194 25259 32 1 1 . 1 1 8 8 LYS H H 8 8.278 8.278 8.671 -0.393 25259 33 1 1 . 1 1 9 9 ASP N N 9 123.624 123.624 119.883 3.741 25259 34 1 1 . 1 1 9 9 ASP HA H 9 4.339 4.339 5.155 -0.816 25259 35 1 1 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.933 -1.810 25259 36 1 1 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.943 -4.010 25259 37 1 1 . 1 1 9 9 ASP H H 9 8.277 8.277 8.590 -0.313 25259 38 1 1 . 1 1 10 10 THR N N 10 116.812 116.812 116.431 0.381 25259 39 1 1 . 1 1 10 10 THR HA H 10 4.349 4.349 4.535 -0.186 25259 40 1 1 . 1 1 10 10 THR CA C 10 59.634 59.634 61.732 -2.098 25259 41 1 1 . 1 1 10 10 THR CB C 10 67.254 67.254 69.682 -2.428 25259 42 1 1 . 1 1 10 10 THR H H 10 8.049 8.049 8.223 -0.174 25259 43 1 1 . 1 1 11 11 LEU N N 11 126.610 126.610 124.855 1.755 25259 44 1 1 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.715 -0.323 25259 45 1 1 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.190 -1.112 25259 46 1 1 . 1 1 11 11 LEU CB C 11 39.633 39.633 43.117 -3.484 25259 47 1 1 . 1 1 11 11 LEU H H 11 8.191 8.191 8.266 -0.075 25259 48 1 1 . 1 1 12 12 GLN N N 12 123.274 123.274 120.538 2.736 25259 49 1 1 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.604 -0.222 25259 50 1 1 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.638 -2.064 25259 51 1 1 . 1 1 12 12 GLN CB C 12 26.803 26.803 30.161 -3.358 25259 52 1 1 . 1 1 12 12 GLN H H 12 8.280 8.280 8.668 -0.388 25259 53 1 1 . 1 1 13 13 SER N N 13 119.027 119.027 116.042 2.985 25259 54 1 1 . 1 1 13 13 SER HA H 13 4.471 4.471 4.958 -0.487 25259 55 1 1 . 1 1 13 13 SER CA C 13 55.869 55.869 57.669 -1.800 25259 56 1 1 . 1 1 13 13 SER CB C 13 61.424 61.424 64.142 -2.719 25259 57 1 1 . 1 1 13 13 SER H H 13 8.178 8.178 8.362 -0.184 25259 58 1 1 . 1 1 14 14 ALA N N 14 128.314 128.314 123.631 4.683 25259 59 1 1 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.526 -0.092 25259 60 1 1 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.696 -2.000 25259 61 1 1 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.286 -2.205 25259 62 1 1 . 1 1 14 14 ALA H H 14 8.195 8.195 8.287 -0.092 25259 63 1 1 . 1 1 15 15 LEU N N 15 125.175 125.175 121.361 3.814 25259 64 1 1 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.478 0.162 25259 65 1 1 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.701 -3.097 25259 66 1 1 . 1 1 15 15 LEU CB C 15 39.467 39.467 41.121 -1.654 25259 67 1 1 . 1 1 15 15 LEU H H 15 8.050 8.050 8.263 -0.213 25259 68 1 1 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.446 0.058 25259 69 1 1 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.894 -2.263 25259 70 1 1 . 1 1 16 16 PRO CB C 16 29.658 29.658 31.474 -1.816 25259 71 1 1 . 1 1 17 17 VAL N N 17 123.223 123.223 126.337 -3.114 25259 72 1 1 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.285 -0.151 25259 73 1 1 . 1 1 17 17 VAL CA C 17 59.827 59.827 62.250 -2.423 25259 74 1 1 . 1 1 17 17 VAL CB C 17 30.377 30.377 31.817 -1.440 25259 75 1 1 . 1 1 17 17 VAL H H 17 8.134 8.134 8.527 -0.393 25259 76 1 1 . 1 1 18 18 ILE N N 18 127.777 127.777 123.791 3.986 25259 77 1 1 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.627 -0.384 25259 78 1 1 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.209 -1.887 25259 79 1 1 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.585 -4.331 25259 80 1 1 . 1 1 18 18 ILE H H 18 8.187 8.187 7.878 0.309 25259 81 1 1 . 1 1 19 19 GLU N N 19 128.148 128.148 119.486 8.662 25259 82 1 1 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.656 -0.319 25259 83 1 1 . 1 1 19 19 GLU CA C 19 54.091 54.091 56.197 -2.106 25259 84 1 1 . 1 1 19 19 GLU CB C 19 28.176 28.176 30.358 -2.182 25259 85 1 1 . 1 1 19 19 GLU H H 19 8.475 8.475 8.823 -0.348 25259 86 1 1 . 1 1 20 20 ASN N N 20 122.788 122.788 118.102 4.686 25259 87 1 1 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.265 -0.570 25259 88 1 1 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.431 -1.609 25259 89 1 1 . 1 1 20 20 ASN CB C 20 36.366 36.366 41.155 -4.789 25259 90 1 1 . 1 1 20 20 ASN H H 20 8.477 8.477 8.206 0.271 25259 91 1 1 . 1 1 21 21 ALA N N 21 127.253 127.253 123.466 3.787 25259 92 1 1 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.509 -0.188 25259 93 1 1 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.915 -1.227 25259 94 1 1 . 1 1 21 21 ALA CB C 21 16.913 16.913 21.083 -4.170 25259 95 1 1 . 1 1 21 21 ALA H H 21 8.325 8.325 8.276 0.049 25259 96 1 1 . 1 1 22 22 GLU N N 22 122.044 122.044 121.416 0.628 25259 97 1 1 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.468 -0.175 25259 98 1 1 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.655 -2.072 25259 99 1 1 . 1 1 22 22 GLU CB C 22 27.285 27.285 30.995 -3.710 25259 100 1 1 . 1 1 22 22 GLU H H 22 8.415 8.415 8.643 -0.228 25259 101 1 1 . 1 1 23 23 LYS N N 23 123.622 123.622 127.133 -3.511 25259 102 1 1 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.345 -0.020 25259 103 1 1 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.424 -1.928 25259 104 1 1 . 1 1 23 23 LYS CB C 23 30.653 30.653 31.571 -0.918 25259 105 1 1 . 1 1 23 23 LYS H H 23 8.127 8.127 8.721 -0.594 25259 106 1 1 . 1 1 24 24 ASN N N 24 120.652 120.652 119.374 1.278 25259 107 1 1 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.880 -0.039 25259 108 1 1 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.923 -2.260 25259 109 1 1 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.582 -2.807 25259 110 1 1 . 1 1 24 24 ASN H H 24 8.424 8.424 7.973 0.451 25259 111 1 1 . 1 1 25 25 THR N N 25 117.102 117.102 114.916 2.186 25259 112 1 1 . 1 1 25 25 THR HA H 25 4.367 4.367 4.161 0.206 25259 113 1 1 . 1 1 25 25 THR CA C 25 59.500 59.500 62.880 -3.380 25259 114 1 1 . 1 1 25 25 THR CB C 25 67.610 67.610 68.811 -1.201 25259 115 1 1 . 1 1 25 25 THR H H 25 7.852 7.852 7.877 -0.025 25259 116 1 1 . 1 1 26 26 VAL N N 26 126.491 126.491 127.128 -0.637 25259 117 1 1 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.209 -0.042 25259 118 1 1 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.762 -1.569 25259 119 1 1 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.183 -4.578 25259 120 1 1 . 1 1 26 26 VAL H H 26 8.080 8.080 8.357 -0.277 25259 121 1 1 . 1 1 27 27 VAL N N 27 132.992 132.992 124.434 8.558 25259 122 1 1 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.709 -0.628 25259 123 1 1 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.077 -1.093 25259 124 1 1 . 1 1 27 27 VAL CB C 27 31.540 31.540 34.003 -2.463 25259 125 1 1 . 1 1 27 27 VAL H H 27 8.830 8.830 8.350 0.480 25259 126 1 1 . 1 1 28 28 THR N N 28 123.576 123.576 116.105 7.471 25259 127 1 1 . 1 1 28 28 THR HA H 28 5.553 5.553 4.876 0.677 25259 128 1 1 . 1 1 28 28 THR CA C 28 58.738 58.738 61.040 -2.302 25259 129 1 1 . 1 1 28 28 THR CB C 28 68.443 68.443 70.577 -2.134 25259 130 1 1 . 1 1 28 28 THR H H 28 8.165 8.165 8.122 0.043 25259 131 1 1 . 1 1 29 29 LYS N N 29 129.099 129.099 127.530 1.569 25259 132 1 1 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.641 0.301 25259 133 1 1 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.359 -3.580 25259 134 1 1 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.428 0.668 25259 135 1 1 . 1 1 29 29 LYS H H 29 9.273 9.273 9.208 0.065 25259 136 1 1 . 1 1 30 30 THR N N 30 123.510 123.510 118.707 4.803 25259 137 1 1 . 1 1 30 30 THR HA H 30 5.428 5.428 4.818 0.610 25259 138 1 1 . 1 1 30 30 THR CA C 30 59.784 59.784 61.885 -2.101 25259 139 1 1 . 1 1 30 30 THR CB C 30 67.818 67.818 68.775 -0.957 25259 140 1 1 . 1 1 30 30 THR H H 30 8.993 8.993 8.282 0.711 25259 141 1 1 . 1 1 31 31 LEU N N 31 128.293 128.293 127.127 1.166 25259 142 1 1 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.314 0.906 25259 143 1 1 . 1 1 31 31 LEU CA C 31 50.055 50.055 55.196 -5.141 25259 144 1 1 . 1 1 31 31 LEU CB C 31 43.399 43.399 42.425 0.974 25259 145 1 1 . 1 1 31 31 LEU H H 31 9.557 9.557 8.736 0.821 25259 146 1 1 . 1 1 32 32 VAL N N 32 126.919 126.919 126.249 0.670 25259 147 1 1 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.035 0.416 25259 148 1 1 . 1 1 32 32 VAL CA C 32 59.664 59.664 62.141 -2.477 25259 149 1 1 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.978 -1.529 25259 150 1 1 . 1 1 32 32 VAL H H 32 9.364 9.364 8.220 1.144 25259 151 1 1 . 1 1 33 33 LEU N N 33 133.503 133.503 129.045 4.458 25259 152 1 1 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.358 0.198 25259 153 1 1 . 1 1 33 33 LEU CA C 33 52.004 52.004 54.274 -2.270 25259 154 1 1 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.063 -4.216 25259 155 1 1 . 1 1 33 33 LEU H H 33 8.587 8.587 7.793 0.794 25259 156 1 1 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.455 0.026 25259 157 1 1 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.284 -1.839 25259 158 1 1 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.395 -2.830 25259 159 1 1 . 1 1 35 35 LYS N N 35 127.420 127.420 118.335 9.085 25259 160 1 1 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.084 0.282 25259 161 1 1 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.212 -2.093 25259 162 1 1 . 1 1 35 35 LYS CB C 35 30.594 30.594 33.085 -2.491 25259 163 1 1 . 1 1 35 35 LYS H H 35 8.666 8.666 8.271 0.395 25259 164 1 1 . 1 1 36 36 SER N N 36 122.222 122.222 115.813 6.409 25259 165 1 1 . 1 1 36 36 SER HA H 36 4.753 4.753 4.391 0.362 25259 166 1 1 . 1 1 36 36 SER CA C 36 55.328 55.328 57.832 -2.504 25259 167 1 1 . 1 1 36 36 SER CB C 36 61.728 61.728 63.793 -2.065 25259 168 1 1 . 1 1 36 36 SER H H 36 8.771 8.771 8.522 0.249 25259 169 1 1 . 1 1 37 37 ASP N N 37 126.346 126.346 121.360 4.986 25259 170 1 1 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.474 -0.020 25259 171 1 1 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.650 -2.034 25259 172 1 1 . 1 1 37 37 ASP CB C 37 37.985 37.985 41.341 -3.356 25259 173 1 1 . 1 1 37 37 ASP H H 37 8.859 8.859 8.604 0.255 25259 174 1 1 . 1 1 38 38 ASP N N 38 119.171 119.171 116.576 2.595 25259 175 1 1 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.744 -0.129 25259 176 1 1 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.692 -3.904 25259 177 1 1 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.506 -3.871 25259 178 1 1 . 1 1 38 38 ASP H H 38 7.944 7.944 7.988 -0.044 25259 179 1 1 . 1 1 39 39 GLY N N 39 110.352 110.352 111.215 -0.863 25259 180 1 1 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.125 -2.364 25259 181 1 1 . 1 1 39 39 GLY H H 39 8.145 8.145 8.279 -0.134 25259 182 1 1 . 1 1 40 40 SER N N 40 120.090 120.090 115.174 4.916 25259 183 1 1 . 1 1 40 40 SER HA H 40 4.877 4.877 5.100 -0.223 25259 184 1 1 . 1 1 40 40 SER CA C 40 56.525 56.525 57.097 -0.572 25259 185 1 1 . 1 1 40 40 SER CB C 40 62.245 62.245 66.230 -3.985 25259 186 1 1 . 1 1 40 40 SER H H 40 8.344 8.344 7.638 0.706 25259 187 1 1 . 1 1 41 41 GLN N N 41 122.551 122.551 121.530 1.021 25259 188 1 1 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.682 0.245 25259 189 1 1 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.312 -1.898 25259 190 1 1 . 1 1 41 41 GLN CB C 41 30.314 30.314 32.917 -2.603 25259 191 1 1 . 1 1 41 41 GLN H H 41 8.627 8.627 8.984 -0.357 25259 192 1 1 . 1 1 42 42 GLN N N 42 131.724 131.724 119.865 11.859 25259 193 1 1 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.759 0.852 25259 194 1 1 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.564 -2.492 25259 195 1 1 . 1 1 42 42 GLN CB C 42 30.319 30.319 31.898 -1.579 25259 196 1 1 . 1 1 42 42 GLN H H 42 9.189 9.189 8.661 0.528 25259 197 1 1 . 1 1 43 43 THR N N 43 122.202 122.202 113.524 8.678 25259 198 1 1 . 1 1 43 43 THR HA H 43 5.380 5.380 4.845 0.535 25259 199 1 1 . 1 1 43 43 THR CA C 43 58.863 58.863 60.990 -2.127 25259 200 1 1 . 1 1 43 43 THR CB C 43 68.893 68.893 71.212 -2.319 25259 201 1 1 . 1 1 43 43 THR H H 43 9.139 9.139 8.278 0.861 25259 202 1 1 . 1 1 44 44 GLN N N 44 127.190 127.190 119.617 7.573 25259 203 1 1 . 1 1 44 44 GLN HA H 44 5.634 5.634 4.835 0.799 25259 204 1 1 . 1 1 44 44 GLN CA C 44 51.668 51.668 55.297 -3.629 25259 205 1 1 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.845 -3.935 25259 206 1 1 . 1 1 44 44 GLN H H 44 9.760 9.760 8.391 1.369 25259 207 1 1 . 1 1 45 45 THR N N 45 123.479 123.479 119.853 3.626 25259 208 1 1 . 1 1 45 45 THR HA H 45 5.421 5.421 5.191 0.230 25259 209 1 1 . 1 1 45 45 THR CA C 45 60.071 60.071 61.140 -1.069 25259 210 1 1 . 1 1 45 45 THR CB C 45 67.541 67.541 69.957 -2.416 25259 211 1 1 . 1 1 45 45 THR H H 45 9.518 9.518 9.177 0.341 25259 212 1 1 . 1 1 46 46 ILE N N 46 133.908 133.908 126.637 7.271 25259 213 1 1 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.647 0.356 25259 214 1 1 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.954 -2.483 25259 215 1 1 . 1 1 46 46 ILE CB C 46 39.945 39.945 40.288 -0.343 25259 216 1 1 . 1 1 46 46 ILE H H 46 9.830 9.830 9.137 0.693 25259 217 1 1 . 1 1 47 47 THR N N 47 124.701 124.701 125.175 -0.474 25259 218 1 1 . 1 1 47 47 THR HA H 47 6.048 6.048 5.316 0.732 25259 219 1 1 . 1 1 47 47 THR CA C 47 58.551 58.551 61.801 -3.250 25259 220 1 1 . 1 1 47 47 THR CB C 47 67.819 67.819 69.352 -1.533 25259 221 1 1 . 1 1 47 47 THR H H 47 8.843 8.843 8.890 -0.047 25259 222 1 1 . 1 1 48 48 TYR N N 48 127.369 127.369 122.315 5.054 25259 223 1 1 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.072 0.206 25259 224 1 1 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.296 -2.567 25259 225 1 1 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.311 -1.879 25259 226 1 1 . 1 1 48 48 TYR H H 48 9.638 9.638 8.057 1.581 25259 227 1 1 . 1 1 49 49 LYS N N 49 122.138 122.138 116.989 5.149 25259 228 1 1 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.369 0.287 25259 229 1 1 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.423 -3.451 25259 230 1 1 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.171 -0.568 25259 231 1 1 . 1 1 49 49 LYS H H 49 8.560 8.560 8.611 -0.051 25259 232 1 1 . 1 1 50 50 ASP N N 50 130.208 130.208 121.481 8.727 25259 233 1 1 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.719 -0.415 25259 234 1 1 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.896 -0.136 25259 235 1 1 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.744 -5.405 25259 236 1 1 . 1 1 50 50 ASP H H 50 9.597 9.597 8.494 1.103 25259 237 1 1 . 1 1 51 51 LYS N N 51 124.586 124.586 119.073 5.513 25259 238 1 1 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.701 -0.170 25259 239 1 1 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.112 -2.378 25259 240 1 1 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.692 -4.297 25259 241 1 1 . 1 1 51 51 LYS H H 51 8.450 8.450 8.190 0.260 25259 242 1 1 . 1 1 52 52 THR N N 52 120.044 120.044 113.659 6.385 25259 243 1 1 . 1 1 52 52 THR HA H 52 4.717 4.717 4.529 0.188 25259 244 1 1 . 1 1 52 52 THR CA C 52 59.313 59.313 61.378 -2.065 25259 245 1 1 . 1 1 52 52 THR CB C 52 68.815 68.815 71.180 -2.365 25259 246 1 1 . 1 1 52 52 THR H H 52 8.658 8.658 7.650 1.008 25259 247 1 1 . 1 1 53 53 PHE N N 53 128.987 128.987 122.536 6.451 25259 248 1 1 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.675 -0.392 25259 249 1 1 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.585 -0.596 25259 250 1 1 . 1 1 53 53 PHE CB C 53 38.311 38.311 38.393 -0.082 25259 251 1 1 . 1 1 53 53 PHE H H 53 9.218 9.218 8.602 0.616 25259 252 1 1 . 1 1 54 54 LEU N N 54 124.874 124.874 126.489 -1.615 25259 253 1 1 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.337 0.592 25259 254 1 1 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.882 -2.641 25259 255 1 1 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.873 -2.356 25259 256 1 1 . 1 1 54 54 LEU H H 54 9.391 9.391 8.946 0.445 25259 257 1 1 . 1 1 55 55 SER N N 55 115.516 115.516 109.026 6.490 25259 258 1 1 . 1 1 55 55 SER HA H 55 5.194 5.194 5.112 0.082 25259 259 1 1 . 1 1 55 55 SER CA C 55 55.818 55.818 57.478 -1.660 25259 260 1 1 . 1 1 55 55 SER CB C 55 63.474 63.474 66.763 -3.289 25259 261 1 1 . 1 1 55 55 SER H H 55 8.736 8.736 7.762 0.974 25259 262 1 1 . 1 1 56 56 LEU N N 56 124.352 124.352 121.482 2.870 25259 263 1 1 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.302 0.241 25259 264 1 1 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.588 -2.951 25259 265 1 1 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.799 -1.286 25259 266 1 1 . 1 1 56 56 LEU H H 56 8.328 8.328 8.560 -0.232 25259 267 1 1 . 1 1 57 57 ALA N N 57 131.450 131.450 127.162 4.288 25259 268 1 1 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.452 0.053 25259 269 1 1 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.193 -1.991 25259 270 1 1 . 1 1 57 57 ALA CB C 57 18.964 18.964 22.881 -3.917 25259 271 1 1 . 1 1 57 57 ALA H H 57 9.208 9.208 8.702 0.506 25259 272 1 1 . 1 1 58 58 ILE N N 58 126.248 126.248 121.305 4.943 25259 273 1 1 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.472 0.312 25259 274 1 1 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.154 -1.907 25259 275 1 1 . 1 1 58 58 ILE CB C 58 38.045 38.045 39.813 -1.768 25259 276 1 1 . 1 1 58 58 ILE H H 58 9.597 9.597 8.852 0.745 25259 277 1 1 . 1 1 59 59 GLN N N 59 132.065 132.065 126.982 5.083 25259 278 1 1 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.368 0.879 25259 279 1 1 . 1 1 59 59 GLN CA C 59 52.164 52.164 56.920 -4.756 25259 280 1 1 . 1 1 59 59 GLN CB C 59 29.661 29.661 29.388 0.273 25259 281 1 1 . 1 1 59 59 GLN H H 59 9.389 9.389 8.721 0.668 25259 282 1 1 . 1 1 60 60 GLN N N 60 130.314 130.314 117.391 12.923 25259 283 1 1 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.511 0.698 25259 284 1 1 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.714 -3.693 25259 285 1 1 . 1 1 60 60 GLN CB C 60 29.476 29.476 32.620 -3.144 25259 286 1 1 . 1 1 60 60 GLN H H 60 9.471 9.471 8.436 1.035 25259 287 1 1 . 1 1 61 61 LYS N N 61 131.044 131.044 126.954 4.090 25259 288 1 1 . 1 1 61 61 LYS HA H 61 5.415 5.415 4.744 0.671 25259 289 1 1 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.790 -2.670 25259 290 1 1 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.628 -3.211 25259 291 1 1 . 1 1 61 61 LYS H H 61 8.893 8.893 9.060 -0.167 25259 292 1 1 . 1 1 62 62 ARG N N 62 125.397 125.397 123.191 2.206 25259 293 1 1 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.065 -0.062 25259 294 1 1 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.924 -2.833 25259 295 1 1 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.504 -1.626 25259 296 1 1 . 1 1 62 62 ARG H H 62 9.120 9.120 7.992 1.128 25259 297 1 1 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.815 0.160 25259 298 1 1 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.724 -3.227 25259 299 1 1 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.579 -2.695 25259 300 1 1 . 1 1 64 64 VAL N N 64 121.305 121.305 116.778 4.527 25259 301 1 1 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.147 -0.123 25259 302 1 1 . 1 1 64 64 VAL CA C 64 59.677 59.677 62.096 -2.419 25259 303 1 1 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.678 -2.313 25259 304 1 1 . 1 1 64 64 VAL H H 64 7.520 7.520 7.974 -0.454 25259 305 1 1 . 1 1 65 65 SER N N 65 123.215 123.215 113.553 9.662 25259 306 1 1 . 1 1 65 65 SER HA H 65 4.521 4.521 4.755 -0.234 25259 307 1 1 . 1 1 65 65 SER CA C 65 54.897 54.897 57.284 -2.387 25259 308 1 1 . 1 1 65 65 SER CB C 65 62.564 62.564 65.882 -3.318 25259 309 1 1 . 1 1 65 65 SER H H 65 8.080 8.080 8.051 0.029 25259 310 1 1 . 1 1 66 66 ASP N N 66 123.802 123.802 122.975 0.827 25259 311 1 1 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.520 -0.091 25259 312 1 1 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.590 -1.212 25259 313 1 1 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.802 -2.764 25259 314 1 1 . 1 1 66 66 ASP H H 66 8.900 8.900 8.762 0.138 25259 315 1 1 . 1 1 67 67 GLU N N 67 121.943 121.943 120.395 1.548 25259 316 1 1 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.012 0.177 25259 317 1 1 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.350 -1.910 25259 318 1 1 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.484 -2.699 25259 319 1 1 . 1 1 67 67 GLU H H 67 8.717 8.717 8.653 0.064 25259 320 1 1 . 1 1 68 68 LEU N N 68 125.458 125.458 119.132 6.326 25259 321 1 1 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.240 0.103 25259 322 1 1 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.720 -2.248 25259 323 1 1 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.365 -1.961 25259 324 1 1 . 1 1 68 68 LEU H H 68 7.820 7.820 7.687 0.133 25259 325 1 1 . 1 1 69 69 LYS N N 69 123.868 123.868 120.513 3.355 25259 326 1 1 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.063 -0.057 25259 327 1 1 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.948 -2.331 25259 328 1 1 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.974 -1.937 25259 329 1 1 . 1 1 69 69 LYS H H 69 8.690 8.690 7.884 0.806 25259 330 1 1 . 1 1 70 70 THR N N 70 117.109 117.109 116.428 0.681 25259 331 1 1 . 1 1 70 70 THR HA H 70 4.088 4.088 4.002 0.086 25259 332 1 1 . 1 1 70 70 THR CA C 70 63.879 63.879 67.024 -3.145 25259 333 1 1 . 1 1 70 70 THR CB C 70 66.383 66.383 68.724 -2.341 25259 334 1 1 . 1 1 70 70 THR H H 70 7.935 7.935 7.965 -0.030 25259 335 1 1 . 1 1 71 71 TYR N N 71 127.006 127.006 122.702 4.304 25259 336 1 1 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.263 -0.058 25259 337 1 1 . 1 1 71 71 TYR CA C 71 60.225 60.225 62.076 -1.851 25259 338 1 1 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.267 -1.722 25259 339 1 1 . 1 1 71 71 TYR H H 71 7.683 7.683 7.629 0.054 25259 340 1 1 . 1 1 72 72 ILE N N 72 125.064 125.064 120.321 4.743 25259 341 1 1 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.790 -0.111 25259 342 1 1 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.323 -2.428 25259 343 1 1 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.858 -1.582 25259 344 1 1 . 1 1 72 72 ILE H H 72 9.083 9.083 8.222 0.861 25259 345 1 1 . 1 1 73 73 ASP N N 73 124.900 124.900 120.217 4.683 25259 346 1 1 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.352 0.037 25259 347 1 1 . 1 1 73 73 ASP CA C 73 55.038 55.038 57.470 -2.432 25259 348 1 1 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.969 -2.862 25259 349 1 1 . 1 1 73 73 ASP H H 73 8.751 8.751 8.159 0.592 25259 350 1 1 . 1 1 74 74 GLN N N 74 117.025 117.025 117.611 -0.586 25259 351 1 1 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.960 0.178 25259 352 1 1 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.282 -3.472 25259 353 1 1 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.167 -1.603 25259 354 1 1 . 1 1 74 74 GLN H H 74 7.447 7.447 7.776 -0.329 25259 355 1 1 . 1 1 75 75 HIS N N 75 116.494 116.494 115.822 0.672 25259 356 1 1 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.436 0.280 25259 357 1 1 . 1 1 75 75 HIS CA C 75 54.066 54.066 57.451 -3.385 25259 358 1 1 . 1 1 75 75 HIS CB C 75 28.302 28.302 31.679 -3.377 25259 359 1 1 . 1 1 75 75 HIS H H 75 8.402 8.402 8.145 0.257 25259 360 1 1 . 1 1 76 76 GLY N N 76 112.564 112.564 104.916 7.648 25259 361 1 1 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.550 -2.654 25259 362 1 1 . 1 1 76 76 GLY H H 76 9.091 9.091 7.864 1.227 25259 363 1 1 . 1 1 77 77 VAL N N 77 124.763 124.763 122.201 2.562 25259 364 1 1 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.724 -0.159 25259 365 1 1 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.137 -0.186 25259 366 1 1 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.062 -2.224 25259 367 1 1 . 1 1 77 77 VAL H H 77 8.927 8.927 8.798 0.129 25259 368 1 1 . 1 1 78 78 GLU N N 78 124.388 124.388 117.891 6.497 25259 369 1 1 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.011 0.137 25259 370 1 1 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.272 -0.956 25259 371 1 1 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.524 -2.065 25259 372 1 1 . 1 1 78 78 GLU H H 78 8.781 8.781 8.680 0.101 25259 373 1 1 . 1 1 79 79 GLU N N 79 121.887 121.887 118.350 3.537 25259 374 1 1 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.512 -0.324 25259 375 1 1 . 1 1 79 79 GLU CA C 79 56.545 56.545 57.749 -1.204 25259 376 1 1 . 1 1 79 79 GLU CB C 79 27.033 27.033 30.581 -3.547 25259 377 1 1 . 1 1 79 79 GLU H H 79 9.231 9.231 7.832 1.399 25259 378 1 1 . 1 1 80 80 THR N N 80 120.781 120.781 118.204 2.577 25259 379 1 1 . 1 1 80 80 THR HA H 80 4.059 4.059 3.842 0.217 25259 380 1 1 . 1 1 80 80 THR CA C 80 65.487 65.487 67.197 -1.710 25259 381 1 1 . 1 1 80 80 THR CB C 80 64.369 64.369 68.762 -4.393 25259 382 1 1 . 1 1 80 80 THR H H 80 7.858 7.858 7.893 -0.035 25259 383 1 1 . 1 1 81 81 GLN N N 81 125.303 125.303 120.856 4.447 25259 384 1 1 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.883 0.161 25259 385 1 1 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.695 -2.726 25259 386 1 1 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.439 -2.362 25259 387 1 1 . 1 1 81 81 GLN H H 81 8.765 8.765 7.808 0.957 25259 388 1 1 . 1 1 82 82 LYS N N 82 120.458 120.458 118.696 1.762 25259 389 1 1 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.958 0.131 25259 390 1 1 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.733 -1.421 25259 391 1 1 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.728 -1.574 25259 392 1 1 . 1 1 82 82 LYS H H 82 7.521 7.521 7.564 -0.043 25259 393 1 1 . 1 1 83 83 ALA N N 83 125.234 125.234 122.176 3.058 25259 394 1 1 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.942 0.275 25259 395 1 1 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.717 -2.275 25259 396 1 1 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.749 -2.462 25259 397 1 1 . 1 1 83 83 ALA H H 83 7.782 7.782 7.636 0.146 25259 398 1 1 . 1 1 84 84 LEU N N 84 123.348 123.348 119.856 3.492 25259 399 1 1 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.846 0.212 25259 400 1 1 . 1 1 84 84 LEU CA C 84 55.499 55.499 58.588 -3.089 25259 401 1 1 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.553 -2.245 25259 402 1 1 . 1 1 84 84 LEU H H 84 8.590 8.590 7.933 0.657 25259 403 1 1 . 1 1 85 85 LEU N N 85 122.872 122.872 118.274 4.598 25259 404 1 1 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.881 0.289 25259 405 1 1 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.720 -2.324 25259 406 1 1 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.681 -1.940 25259 407 1 1 . 1 1 85 85 LEU H H 85 7.892 7.892 7.843 0.050 25259 408 1 1 . 1 1 86 86 GLU N N 86 122.713 122.713 119.018 3.695 25259 409 1 1 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.964 0.121 25259 410 1 1 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.087 -2.342 25259 411 1 1 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.649 -2.746 25259 412 1 1 . 1 1 86 86 GLU H H 86 8.124 8.124 8.038 0.086 25259 413 1 1 . 1 1 87 87 ALA N N 87 123.163 123.163 120.582 2.581 25259 414 1 1 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.111 0.030 25259 415 1 1 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.635 -2.367 25259 416 1 1 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.358 -2.726 25259 417 1 1 . 1 1 87 87 ALA H H 87 7.765 7.765 7.634 0.131 25259 418 1 1 . 1 1 88 88 GLU N N 88 121.945 121.945 116.439 5.506 25259 419 1 1 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.208 -0.124 25259 420 1 1 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.347 -1.412 25259 421 1 1 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.835 -1.808 25259 422 1 1 . 1 1 88 88 GLU H H 88 7.846 7.846 7.732 0.114 25259 423 1 1 . 1 1 89 89 GLU N N 89 117.978 117.978 117.786 0.192 25259 424 1 1 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.111 -0.018 25259 425 1 1 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.537 -3.323 25259 426 1 1 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.133 -1.726 25259 427 1 1 . 1 1 89 89 GLU H H 89 7.634 7.634 7.737 -0.103 25259 428 1 1 . 1 1 90 90 LYS N N 90 117.519 117.519 116.251 1.268 25259 429 1 1 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.414 0.017 25259 430 1 1 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.296 -2.278 25259 431 1 1 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.877 -1.846 25259 432 1 1 . 1 1 90 90 LYS H H 90 7.247 7.247 7.453 -0.206 25259 433 1 1 . 1 1 91 91 ASP N N 91 124.888 124.888 122.710 2.178 25259 434 1 1 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.593 0.090 25259 435 1 1 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.028 -2.829 25259 436 1 1 . 1 1 91 91 ASP CB C 91 39.581 39.581 41.448 -1.867 25259 437 1 1 . 1 1 91 91 ASP H H 91 7.370 7.370 7.533 -0.163 25259 438 1 1 . 1 1 92 92 LYS N N 92 129.311 129.311 126.524 2.787 25259 439 1 1 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.993 0.020 25259 440 1 1 . 1 1 92 92 LYS CA C 92 57.216 57.216 58.903 -1.687 25259 441 1 1 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.389 -2.374 25259 442 1 1 . 1 1 92 92 LYS H H 92 8.795 8.795 8.864 -0.069 25259 443 1 1 . 1 1 93 93 SER N N 93 118.112 118.112 115.855 2.257 25259 444 1 1 . 1 1 93 93 SER HA H 93 4.439 4.439 4.205 0.234 25259 445 1 1 . 1 1 93 93 SER CA C 93 58.945 58.945 61.807 -2.862 25259 446 1 1 . 1 1 93 93 SER CB C 93 60.278 60.278 63.243 -2.965 25259 447 1 1 . 1 1 93 93 SER H H 93 8.488 8.488 8.056 0.432 25259 448 1 1 . 1 1 94 94 ILE N N 94 128.950 128.950 122.774 6.176 25259 449 1 1 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.643 -0.161 25259 450 1 1 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.969 -2.620 25259 451 1 1 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.721 -2.968 25259 452 1 1 . 1 1 94 94 ILE H H 94 7.722 7.722 7.348 0.374 25259 453 1 1 . 1 1 95 95 ILE N N 95 123.598 123.598 120.737 2.861 25259 454 1 1 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.445 0.150 25259 455 1 1 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.803 -3.056 25259 456 1 1 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.557 -1.585 25259 457 1 1 . 1 1 95 95 ILE H H 95 8.378 8.378 8.230 0.148 25259 458 1 1 . 1 1 96 96 GLU N N 96 118.317 118.317 118.462 -0.145 25259 459 1 1 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.902 0.082 25259 460 1 1 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.262 -2.767 25259 461 1 1 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.469 -2.296 25259 462 1 1 . 1 1 96 96 GLU H H 96 7.680 7.680 8.021 -0.341 25259 463 1 1 . 1 1 97 97 ALA N N 97 124.797 124.797 122.699 2.098 25259 464 1 1 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.727 0.098 25259 465 1 1 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.517 -2.220 25259 466 1 1 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.538 -2.549 25259 467 1 1 . 1 1 97 97 ALA H H 97 7.383 7.383 7.592 -0.209 25259 468 1 1 . 1 1 98 98 ARG N N 98 115.469 115.469 114.984 0.485 25259 469 1 1 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.293 0.013 25259 470 1 1 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.304 -0.814 25259 471 1 1 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.728 -1.490 25259 472 1 1 . 1 1 98 98 ARG H H 98 8.229 8.229 8.087 0.142 25259 473 1 1 . 1 1 99 99 LYS N N 99 120.219 120.219 117.992 2.227 25259 474 1 1 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.091 0.167 25259 475 1 1 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.542 -2.301 25259 476 1 1 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.577 -2.081 25259 477 1 1 . 1 1 99 99 LYS H H 99 7.270 7.270 7.320 -0.050 25259 478 1 1 . 1 1 100 100 LEU N N 100 123.800 123.800 120.325 3.475 25259 479 1 1 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.292 0.049 25259 480 1 1 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.713 -2.634 25259 481 1 1 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.350 -3.219 25259 482 1 1 . 1 1 100 100 LEU H H 100 7.837 7.837 7.637 0.200 25259 483 1 1 . 1 1 101 101 ALA N N 101 130.512 130.512 125.181 5.331 25259 484 1 1 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.410 -0.034 25259 485 1 1 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.170 -2.766 25259 486 1 1 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.897 -3.101 25259 487 1 1 . 1 1 101 101 ALA H H 101 8.213 8.213 8.943 -0.730 25259 488 1 1 . 1 1 102 102 GLY N N 102 110.659 110.659 105.411 5.248 25259 489 1 1 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.863 -0.970 25259 490 1 1 . 1 1 102 102 GLY H H 102 8.738 8.738 7.860 0.878 25259 491 1 1 . 1 1 103 103 PHE N N 103 123.097 123.097 121.983 1.114 25259 492 1 1 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.644 -0.424 25259 493 1 1 . 1 1 103 103 PHE CA C 103 53.768 53.768 55.941 -2.173 25259 494 1 1 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.989 -2.415 25259 495 1 1 . 1 1 103 103 PHE H H 103 7.514 7.514 7.551 -0.037 25259 496 1 1 . 1 1 104 104 LYS N N 104 130.652 130.652 123.477 7.175 25259 497 1 1 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.326 -0.206 25259 498 1 1 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.380 -1.401 25259 499 1 1 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.615 -2.378 25259 500 1 1 . 1 1 104 104 LYS H H 104 7.473 7.473 8.056 -0.583 25259 501 1 1 . 1 1 105 105 LEU N N 105 127.372 127.372 124.800 2.572 25259 502 1 1 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.146 -0.150 25259 503 1 1 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.761 -2.026 25259 504 1 1 . 1 1 105 105 LEU CB C 105 43.964 43.964 44.972 -1.008 25259 505 1 1 . 1 1 105 105 LEU H H 105 8.393 8.393 8.265 0.128 25259 506 1 1 . 1 1 106 106 GLU N N 106 129.358 129.358 127.351 2.007 25259 507 1 1 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.702 0.142 25259 508 1 1 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.671 -1.881 25259 509 1 1 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.483 -1.855 25259 510 1 1 . 1 1 106 106 GLU H H 106 8.849 8.849 8.983 -0.134 25259 511 1 1 . 1 1 107 107 THR N N 107 131.118 131.118 118.457 12.661 25259 512 1 1 . 1 1 107 107 THR HA H 107 5.110 5.110 4.931 0.179 25259 513 1 1 . 1 1 107 107 THR CA C 107 59.832 59.832 60.903 -1.071 25259 514 1 1 . 1 1 107 107 THR CB C 107 66.671 66.671 70.594 -3.924 25259 515 1 1 . 1 1 107 107 THR H H 107 9.433 9.433 8.341 1.092 25259 516 1 1 . 1 1 108 108 LYS N N 108 129.114 129.114 122.772 6.342 25259 517 1 1 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.680 0.144 25259 518 1 1 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.695 -2.501 25259 519 1 1 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.297 -0.909 25259 520 1 1 . 1 1 108 108 LYS H H 108 9.410 9.410 8.700 0.710 25259 521 1 1 . 1 1 109 109 LEU N N 109 129.323 129.323 124.199 5.124 25259 522 1 1 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.609 0.095 25259 523 1 1 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.391 -2.283 25259 524 1 1 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.212 -2.557 25259 525 1 1 . 1 1 109 109 LEU H H 109 8.862 8.862 8.670 0.192 25259 526 1 1 . 1 1 110 110 LEU N N 110 129.123 129.123 127.827 1.296 25259 527 1 1 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.205 0.018 25259 528 1 1 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.381 -2.599 25259 529 1 1 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.322 -1.661 25259 530 1 1 . 1 1 110 110 LEU H H 110 8.373 8.373 8.418 -0.045 25259 531 1 1 . 1 1 111 111 SER N N 111 114.587 114.587 111.053 3.534 25259 532 1 1 . 1 1 111 111 SER HA H 111 4.557 4.557 4.680 -0.123 25259 533 1 1 . 1 1 111 111 SER CA C 111 53.889 53.889 57.308 -3.419 25259 534 1 1 . 1 1 111 111 SER CB C 111 61.830 61.830 65.054 -3.224 25259 535 1 1 . 1 1 111 111 SER H H 111 8.400 8.400 7.743 0.657 25259 536 1 1 . 1 1 112 112 ALA N N 112 118.269 118.269 123.632 -5.363 25259 537 1 1 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.237 0.072 25259 538 1 1 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.679 -3.465 25259 539 1 1 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.478 -1.890 25259 540 1 1 . 1 1 112 112 ALA H H 112 8.556 8.556 8.641 -0.085 25259 541 1 1 . 1 1 113 113 THR N N 113 102.878 102.878 102.035 0.843 25259 542 1 1 . 1 1 113 113 THR HA H 113 4.662 4.662 4.385 0.277 25259 543 1 1 . 1 1 113 113 THR CA C 113 58.689 58.689 61.563 -2.874 25259 544 1 1 . 1 1 113 113 THR CB C 113 67.905 67.905 69.674 -1.768 25259 545 1 1 . 1 1 113 113 THR H H 113 8.065 8.065 7.727 0.338 25259 546 1 1 . 1 1 114 114 GLU N N 114 126.514 126.514 121.688 4.826 25259 547 1 1 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.998 0.016 25259 548 1 1 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.207 -2.200 25259 549 1 1 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.035 -1.122 25259 550 1 1 . 1 1 114 114 GLU H H 114 7.357 7.357 8.038 -0.681 25259 551 1 1 . 1 1 115 115 LEU N N 115 128.058 128.058 121.436 6.622 25259 552 1 1 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.247 -0.325 25259 553 1 1 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.320 -1.996 25259 554 1 1 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.988 -1.849 25259 555 1 1 . 1 1 115 115 LEU H H 115 8.930 8.930 8.775 0.155 25259 556 1 1 . 1 1 116 116 GLN N N 116 126.540 126.540 121.901 4.639 25259 557 1 1 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.215 0.500 25259 558 1 1 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.430 -2.730 25259 559 1 1 . 1 1 116 116 GLN CB C 116 32.292 32.292 32.524 -0.232 25259 560 1 1 . 1 1 116 116 GLN H H 116 9.221 9.221 8.952 0.269 25259 561 1 1 . 1 1 117 117 THR N N 117 125.213 125.213 119.278 5.935 25259 562 1 1 . 1 1 117 117 THR HA H 117 5.353 5.353 5.337 0.016 25259 563 1 1 . 1 1 117 117 THR CA C 117 58.926 58.926 61.206 -2.280 25259 564 1 1 . 1 1 117 117 THR CB C 117 68.948 68.948 72.670 -3.722 25259 565 1 1 . 1 1 117 117 THR H H 117 9.030 9.030 8.362 0.668 25259 566 1 1 . 1 1 118 118 THR N N 118 127.799 127.799 117.359 10.440 25259 567 1 1 . 1 1 118 118 THR HA H 118 5.527 5.527 4.881 0.646 25259 568 1 1 . 1 1 118 118 THR CA C 118 59.201 59.201 61.698 -2.497 25259 569 1 1 . 1 1 118 118 THR CB C 118 67.721 67.721 71.731 -4.010 25259 570 1 1 . 1 1 118 118 THR H H 118 9.459 9.459 8.780 0.679 25259 571 1 1 . 1 1 119 119 THR N N 119 129.258 129.258 123.514 5.744 25259 572 1 1 . 1 1 119 119 THR HA H 119 4.885 4.885 4.780 0.105 25259 573 1 1 . 1 1 119 119 THR CA C 119 58.463 58.463 61.308 -2.845 25259 574 1 1 . 1 1 119 119 THR CB C 119 67.459 67.459 70.128 -2.669 25259 575 1 1 . 1 1 119 119 THR H H 119 9.147 9.147 8.896 0.251 25259 576 1 1 . 1 1 120 120 SER N N 120 123.389 123.389 122.308 1.081 25259 577 1 1 . 1 1 120 120 SER HA H 120 5.328 5.328 5.128 0.200 25259 578 1 1 . 1 1 120 120 SER CA C 120 54.386 54.386 57.456 -3.070 25259 579 1 1 . 1 1 120 120 SER CB C 120 63.031 63.031 65.117 -2.086 25259 580 1 1 . 1 1 120 120 SER H H 120 8.786 8.786 8.678 0.108 25259 581 1 1 . 1 1 121 121 PHE N N 121 121.245 121.245 121.738 -0.493 25259 582 1 1 . 1 1 121 121 PHE HA H 121 5.112 5.112 5.017 0.095 25259 583 1 1 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.380 -3.188 25259 584 1 1 . 1 1 121 121 PHE CB C 121 40.265 40.265 41.818 -1.553 25259 585 1 1 . 1 1 121 121 PHE H H 121 8.831 8.831 9.278 -0.447 25259 586 1 1 . 1 1 122 122 ASP N N 122 124.765 124.765 124.361 0.404 25259 587 1 1 . 1 1 122 122 ASP HA H 122 4.840 4.840 5.086 -0.246 25259 588 1 1 . 1 1 122 122 ASP CA C 122 49.837 49.837 52.688 -2.851 25259 589 1 1 . 1 1 122 122 ASP CB C 122 38.485 38.485 41.161 -2.676 25259 590 1 1 . 1 1 122 122 ASP H H 122 8.819 8.819 8.913 -0.094 25259 591 1 1 . 1 1 123 123 PHE N N 123 124.303 124.303 120.887 3.416 25259 592 1 1 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.321 0.353 25259 593 1 1 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.230 -2.432 25259 594 1 1 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.257 -2.717 25259 595 1 1 . 1 1 123 123 PHE H H 123 8.262 8.262 8.465 -0.203 25259 596 1 1 . 1 1 124 124 GLN N N 124 120.792 120.792 117.607 3.185 25259 597 1 1 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.274 0.160 25259 598 1 1 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.178 -2.095 25259 599 1 1 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.261 -2.131 25259 600 1 1 . 1 1 124 124 GLN H H 124 8.954 8.954 8.523 0.431 25259 601 1 1 . 1 1 125 125 VAL N N 125 114.091 114.091 110.989 3.102 25259 602 1 1 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.514 -0.105 25259 603 1 1 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.086 -2.788 25259 604 1 1 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.583 -1.011 25259 605 1 1 . 1 1 125 125 VAL H H 125 7.026 7.026 8.207 -1.181 25259 606 1 1 . 1 1 126 126 LEU N N 126 125.158 125.158 123.067 2.091 25259 607 1 1 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.437 0.038 25259 608 1 1 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.418 -2.243 25259 609 1 1 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.073 -1.019 25259 610 1 1 . 1 1 126 126 LEU H H 126 8.106 8.106 7.871 0.235 25259 611 1 1 . 1 1 127 127 ASP N N 127 130.026 130.026 127.985 2.041 25259 612 1 1 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.808 0.033 25259 613 1 1 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.787 -3.589 25259 614 1 1 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.829 -3.140 25259 615 1 1 . 1 1 127 127 ASP H H 127 9.129 9.129 8.705 0.424 25259 616 1 1 . 1 1 128 128 VAL N N 128 128.833 128.833 124.335 4.498 25259 617 1 1 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.523 0.001 25259 618 1 1 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.519 -2.851 25259 619 1 1 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.773 -2.278 25259 620 1 1 . 1 1 128 128 VAL H H 128 8.288 8.288 7.805 0.483 25259 621 1 1 . 1 1 129 129 LYS N N 129 123.914 123.914 117.516 6.398 25259 622 1 1 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.994 0.049 25259 623 1 1 . 1 1 129 129 LYS CA C 129 56.789 56.789 59.047 -2.258 25259 624 1 1 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.910 -2.973 25259 625 1 1 . 1 1 129 129 LYS H H 129 8.226 8.226 8.330 -0.104 25259 626 1 1 . 1 1 130 130 LYS N N 130 121.888 121.888 117.328 4.560 25259 627 1 1 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.236 -0.151 25259 628 1 1 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.874 -1.728 25259 629 1 1 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.146 -2.806 25259 630 1 1 . 1 1 130 130 LYS H H 130 7.590 7.590 7.657 -0.067 25259 631 1 1 . 1 1 131 131 ALA N N 131 123.088 123.088 121.797 1.291 25259 632 1 1 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.199 -0.272 25259 633 1 1 . 1 1 131 131 ALA CA C 131 52.402 52.402 54.570 -2.168 25259 634 1 1 . 1 1 131 131 ALA CB C 131 16.447 16.447 17.808 -1.361 25259 635 1 1 . 1 1 131 131 ALA H H 131 8.506 8.506 8.237 0.269 25259 636 1 1 . 1 1 132 132 SER N N 132 110.456 110.456 113.303 -2.847 25259 637 1 1 . 1 1 132 132 SER HA H 132 4.117 4.117 4.286 -0.169 25259 638 1 1 . 1 1 132 132 SER CA C 132 58.289 58.289 60.437 -2.148 25259 639 1 1 . 1 1 132 132 SER CB C 132 61.034 61.034 63.115 -2.081 25259 640 1 1 . 1 1 132 132 SER H H 132 7.986 7.986 7.992 -0.006 25259 641 1 1 . 1 1 133 133 GLN N N 133 119.034 119.034 116.760 2.274 25259 642 1 1 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.627 -0.225 25259 643 1 1 . 1 1 133 133 GLN CA C 133 52.525 52.525 55.274 -2.749 25259 644 1 1 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.616 -2.382 25259 645 1 1 . 1 1 133 133 GLN H H 133 7.233 7.233 8.015 -0.782 25259 646 1 1 . 1 1 134 134 LEU N N 134 123.291 123.291 123.058 0.233 25259 647 1 1 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.565 -0.172 25259 648 1 1 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.062 -1.746 25259 649 1 1 . 1 1 134 134 LEU CB C 134 38.847 38.847 39.772 -0.925 25259 650 1 1 . 1 1 134 134 LEU H H 134 7.411 7.411 7.805 -0.394 25259 651 1 1 . 1 1 135 135 GLU N N 135 128.446 128.446 122.210 6.236 25259 652 1 1 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.740 0.206 25259 653 1 1 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.413 -2.029 25259 654 1 1 . 1 1 135 135 GLU CB C 135 27.296 27.296 28.462 -1.166 25259 655 1 1 . 1 1 135 135 GLU H H 135 8.986 8.986 8.271 0.715 25259 656 1 1 . 1 1 136 136 HIS N N 136 117.593 117.593 119.666 -2.073 25259 657 1 1 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.349 0.034 25259 658 1 1 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.748 -2.063 25259 659 1 1 . 1 1 136 136 HIS CB C 136 28.413 28.413 30.129 -1.716 25259 660 1 1 . 1 1 136 136 HIS H H 136 9.226 9.226 8.034 1.192 25259 661 1 1 . 1 1 137 137 LEU N N 137 115.463 115.463 117.343 -1.880 25259 662 1 1 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.591 -0.084 25259 663 1 1 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.164 -2.216 25259 664 1 1 . 1 1 137 137 LEU CB C 137 39.807 39.807 40.115 -0.308 25259 665 1 1 . 1 1 137 137 LEU H H 137 7.090 7.090 8.091 -1.001 25259 666 1 1 . 1 1 138 138 LYS N N 138 124.686 124.686 120.719 3.967 25259 667 1 1 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.774 -0.605 25259 668 1 1 . 1 1 138 138 LYS CA C 138 57.158 57.158 57.747 -0.589 25259 669 1 1 . 1 1 138 138 LYS CB C 138 30.088 30.088 33.893 -3.805 25259 670 1 1 . 1 1 138 138 LYS H H 138 7.698 7.698 7.963 -0.265 25259 671 1 1 . 1 1 139 139 ASN N N 139 118.077 118.077 116.909 1.168 25259 672 1 1 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.611 0.062 25259 673 1 1 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.463 -2.681 25259 674 1 1 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.965 -3.148 25259 675 1 1 . 1 1 139 139 ASN H H 139 8.485 8.485 7.860 0.625 25259 676 1 1 . 1 1 140 140 ILE N N 140 120.880 120.880 120.641 0.239 25259 677 1 1 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.124 -0.094 25259 678 1 1 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.796 -2.230 25259 679 1 1 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.370 -2.596 25259 680 1 1 . 1 1 140 140 ILE H H 140 7.549 7.549 7.723 -0.174 25259 681 1 1 . 1 1 141 141 GLY N N 141 110.676 110.676 112.159 -1.483 25259 682 1 1 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.408 0.256 25259 683 1 1 . 1 1 141 141 GLY H H 141 7.663 7.663 8.644 -0.981 25259 684 1 1 . 1 1 142 142 LEU N N 142 123.857 123.857 124.029 -0.172 25259 685 1 1 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.950 -0.257 25259 686 1 1 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.800 -2.607 25259 687 1 1 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.699 -1.090 25259 688 1 1 . 1 1 142 142 LEU H H 142 8.496 8.496 7.692 0.804 25259 689 1 1 . 1 1 143 143 GLU N N 143 118.407 118.407 118.619 -0.212 25259 690 1 1 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.952 -0.166 25259 691 1 1 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.300 -2.078 25259 692 1 1 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.957 -2.444 25259 693 1 1 . 1 1 143 143 GLU H H 143 8.672 8.672 8.585 0.087 25259 694 1 1 . 1 1 144 144 ASN N N 144 118.477 118.477 116.321 2.156 25259 695 1 1 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.430 0.012 25259 696 1 1 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.797 -2.085 25259 697 1 1 . 1 1 144 144 ASN CB C 144 35.955 35.955 37.951 -1.996 25259 698 1 1 . 1 1 144 144 ASN H H 144 7.656 7.656 8.283 -0.627 25259 699 1 1 . 1 1 145 145 LEU N N 145 125.354 125.354 119.558 5.796 25259 700 1 1 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.784 0.013 25259 701 1 1 . 1 1 145 145 LEU CA C 145 56.323 56.323 56.784 -0.461 25259 702 1 1 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.016 -2.443 25259 703 1 1 . 1 1 145 145 LEU H H 145 7.758 7.758 7.300 0.458 25259 704 1 1 . 1 1 146 146 LEU N N 146 116.372 116.372 114.975 1.397 25259 705 1 1 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.914 -0.038 25259 706 1 1 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.934 -2.691 25259 707 1 1 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.605 -2.708 25259 708 1 1 . 1 1 146 146 LEU H H 146 7.242 7.242 7.122 0.120 25259 709 1 1 . 1 1 147 147 LYS N N 147 120.054 120.054 115.528 4.526 25259 710 1 1 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.288 0.024 25259 711 1 1 . 1 1 147 147 LYS CA C 147 54.623 54.623 56.000 -1.377 25259 712 1 1 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.001 -1.741 25259 713 1 1 . 1 1 147 147 LYS H H 147 7.185 7.185 7.766 -0.581 25259 714 1 1 . 1 1 148 148 ASN N N 148 119.498 119.498 117.509 1.989 25259 715 1 1 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.738 0.224 25259 716 1 1 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.909 -2.135 25259 717 1 1 . 1 1 148 148 ASN CB C 148 39.486 39.486 39.704 -0.218 25259 718 1 1 . 1 1 148 148 ASN H H 148 7.698 7.698 7.514 0.184 25259 719 1 1 . 1 1 149 149 GLU N N 149 122.834 122.834 119.465 3.369 25259 720 1 1 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.487 0.114 25259 721 1 1 . 1 1 149 149 GLU CA C 149 52.219 52.219 55.560 -3.341 25259 722 1 1 . 1 1 149 149 GLU CB C 149 26.810 26.810 30.074 -3.264 25259 723 1 1 . 1 1 149 149 GLU H H 149 8.767 8.767 8.644 0.123 25259 724 1 1 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.857 0.751 25259 725 1 1 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.224 -0.982 25259 726 1 1 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.032 -2.938 25259 727 1 1 . 1 1 151 151 SER N N 151 112.839 112.839 112.359 0.480 25259 728 1 1 . 1 1 151 151 SER HA H 151 3.835 3.835 4.202 -0.367 25259 729 1 1 . 1 1 151 151 SER CA C 151 59.270 59.270 59.033 0.237 25259 730 1 1 . 1 1 151 151 SER CB C 151 59.451 59.451 63.645 -4.194 25259 731 1 1 . 1 1 151 151 SER H H 151 8.519 8.519 7.452 1.067 25259 732 1 1 . 1 1 152 152 LYS N N 152 126.710 126.710 123.053 3.657 25259 733 1 1 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.009 0.239 25259 734 1 1 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.339 -3.574 25259 735 1 1 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.407 -2.150 25259 736 1 1 . 1 1 152 152 LYS H H 152 7.006 7.006 8.120 -1.114 25259 737 1 1 . 1 1 153 153 TYR N N 153 123.239 123.239 115.398 7.841 25259 738 1 1 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.505 -0.247 25259 739 1 1 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.389 0.920 25259 740 1 1 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.854 -1.520 25259 741 1 1 . 1 1 153 153 TYR H H 153 8.058 8.058 7.804 0.254 25259 742 1 1 . 1 1 154 154 ILE N N 154 120.253 120.253 122.170 -1.917 25259 743 1 1 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.100 0.273 25259 744 1 1 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.365 -2.251 25259 745 1 1 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.181 -1.234 25259 746 1 1 . 1 1 154 154 ILE H H 154 8.193 8.193 7.459 0.734 25259 747 1 1 . 1 1 155 155 SER N N 155 117.178 117.178 114.449 2.729 25259 748 1 1 . 1 1 155 155 SER HA H 155 4.091 4.091 4.051 0.040 25259 749 1 1 . 1 1 155 155 SER CA C 155 59.961 59.961 62.324 -2.363 25259 750 1 1 . 1 1 155 155 SER CB C 155 60.148 60.148 62.800 -2.652 25259 751 1 1 . 1 1 155 155 SER H H 155 8.020 8.020 7.731 0.289 25259 752 1 1 . 1 1 156 156 ASP N N 156 125.479 125.479 120.894 4.585 25259 753 1 1 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.415 0.012 25259 754 1 1 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.562 -1.802 25259 755 1 1 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.913 -3.039 25259 756 1 1 . 1 1 156 156 ASP H H 156 8.638 8.638 7.514 1.124 25259 757 1 1 . 1 1 157 157 ARG N N 157 121.542 121.542 119.172 2.370 25259 758 1 1 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.262 -0.151 25259 759 1 1 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.885 -2.957 25259 760 1 1 . 1 1 157 157 ARG CB C 157 27.816 27.816 30.038 -2.222 25259 761 1 1 . 1 1 157 157 ARG H H 157 7.888 7.888 8.018 -0.130 25259 762 1 1 . 1 1 158 158 LEU N N 158 124.257 124.257 119.106 5.151 25259 763 1 1 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.262 0.009 25259 764 1 1 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.021 -2.808 25259 765 1 1 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.634 -2.689 25259 766 1 1 . 1 1 158 158 LEU H H 158 8.442 8.442 7.861 0.581 25259 767 1 1 . 1 1 159 159 ALA N N 159 124.146 124.146 121.377 2.769 25259 768 1 1 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.181 0.151 25259 769 1 1 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.200 -2.768 25259 770 1 1 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.575 -2.668 25259 771 1 1 . 1 1 159 159 ALA H H 159 8.086 8.086 7.941 0.145 25259 772 1 1 . 1 1 160 160 ASN N N 160 118.093 118.093 115.562 2.531 25259 773 1 1 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.778 0.214 25259 774 1 1 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.209 -1.632 25259 775 1 1 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.286 -0.553 25259 776 1 1 . 1 1 160 160 ASN H H 160 7.445 7.445 7.982 -0.537 25259 777 1 1 . 1 1 161 161 GLY N N 161 108.365 108.365 106.003 2.362 25259 778 1 1 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.958 -1.312 25259 779 1 1 . 1 1 161 161 GLY H H 161 7.743 7.743 7.756 -0.013 25259 780 1 1 . 1 1 162 162 ALA N N 162 123.928 123.928 122.410 1.518 25259 781 1 1 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.751 0.122 25259 782 1 1 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.386 -1.860 25259 783 1 1 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.095 -3.035 25259 784 1 1 . 1 1 162 162 ALA H H 162 8.035 8.035 7.769 0.266 25259 785 1 1 . 1 1 163 163 THR N N 163 113.286 113.286 110.720 2.566 25259 786 1 1 . 1 1 163 163 THR HA H 163 4.703 4.703 4.642 0.061 25259 787 1 1 . 1 1 163 163 THR CA C 163 57.791 57.791 61.212 -3.421 25259 788 1 1 . 1 1 163 163 THR CB C 163 68.974 68.974 71.357 -2.383 25259 789 1 1 . 1 1 163 163 THR H H 163 8.451 8.451 8.678 -0.227 25259 790 1 1 . 1 1 164 164 GLU N N 164 125.905 125.905 119.100 6.805 25259 791 1 1 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.631 0.429 25259 792 1 1 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.648 -1.063 25259 793 1 1 . 1 1 164 164 GLU CB C 164 29.211 29.211 33.394 -4.183 25259 794 1 1 . 1 1 164 164 GLU H H 164 8.716 8.716 8.397 0.319 25259 795 1 2 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.103 -0.428 25259 796 1 2 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.749 -2.942 25259 797 1 2 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.267 -3.197 25259 798 1 2 . 1 1 3 3 ALA N N 3 126.741 126.741 122.126 4.615 25259 799 1 2 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.991 -0.497 25259 800 1 2 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.866 -1.664 25259 801 1 2 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.212 -4.394 25259 802 1 2 . 1 1 3 3 ALA H H 3 8.440 8.440 8.807 -0.367 25259 803 1 2 . 1 1 4 4 THR N N 4 116.015 116.015 113.390 2.625 25259 804 1 2 . 1 1 4 4 THR HA H 4 4.393 4.393 4.934 -0.541 25259 805 1 2 . 1 1 4 4 THR CA C 4 59.148 59.148 62.146 -2.998 25259 806 1 2 . 1 1 4 4 THR CB C 4 67.580 67.580 69.844 -2.264 25259 807 1 2 . 1 1 4 4 THR H H 4 8.050 8.050 8.516 -0.466 25259 808 1 2 . 1 1 5 5 LYS N N 5 126.350 126.350 120.290 6.060 25259 809 1 2 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.857 -0.352 25259 810 1 2 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.577 -1.660 25259 811 1 2 . 1 1 5 5 LYS CB C 5 30.684 30.684 35.123 -4.439 25259 812 1 2 . 1 1 5 5 LYS H H 5 8.332 8.332 8.909 -0.577 25259 813 1 2 . 1 1 6 6 THR N N 6 118.124 118.124 112.412 5.712 25259 814 1 2 . 1 1 6 6 THR HA H 6 4.440 4.440 4.705 -0.265 25259 815 1 2 . 1 1 6 6 THR CA C 6 59.282 59.282 61.591 -2.309 25259 816 1 2 . 1 1 6 6 THR CB C 6 67.685 67.685 70.425 -2.740 25259 817 1 2 . 1 1 6 6 THR H H 6 8.283 8.283 8.127 0.156 25259 818 1 2 . 1 1 7 7 GLU N N 7 125.934 125.934 121.131 4.803 25259 819 1 2 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.747 -0.403 25259 820 1 2 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.655 -1.474 25259 821 1 2 . 1 1 7 7 GLU CB C 7 27.816 27.816 31.990 -4.174 25259 822 1 2 . 1 1 7 7 GLU H H 7 8.487 8.487 8.678 -0.191 25259 823 1 2 . 1 1 8 8 LYS N N 8 123.945 123.945 121.538 2.407 25259 824 1 2 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.697 -1.762 25259 825 1 2 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.109 -3.544 25259 826 1 2 . 1 1 8 8 LYS H H 8 8.278 8.278 8.650 -0.372 25259 827 1 2 . 1 1 9 9 ASP N N 9 123.624 123.624 118.594 5.030 25259 828 1 2 . 1 1 9 9 ASP HA H 9 4.339 4.339 5.093 -0.754 25259 829 1 2 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.174 -1.051 25259 830 1 2 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.658 -3.725 25259 831 1 2 . 1 1 9 9 ASP H H 9 8.277 8.277 8.671 -0.394 25259 832 1 2 . 1 1 10 10 THR N N 10 116.812 116.812 112.383 4.429 25259 833 1 2 . 1 1 10 10 THR HA H 10 4.349 4.349 4.543 -0.194 25259 834 1 2 . 1 1 10 10 THR CA C 10 59.634 59.634 61.797 -2.163 25259 835 1 2 . 1 1 10 10 THR CB C 10 67.254 67.254 69.306 -2.052 25259 836 1 2 . 1 1 10 10 THR H H 10 8.049 8.049 8.381 -0.332 25259 837 1 2 . 1 1 11 11 LEU N N 11 126.610 126.610 124.699 1.911 25259 838 1 2 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.426 -0.034 25259 839 1 2 . 1 1 11 11 LEU CA C 11 53.078 53.078 55.482 -2.404 25259 840 1 2 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.643 -3.010 25259 841 1 2 . 1 1 11 11 LEU H H 11 8.191 8.191 8.779 -0.588 25259 842 1 2 . 1 1 12 12 GLN N N 12 123.274 123.274 121.084 2.190 25259 843 1 2 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.853 -0.471 25259 844 1 2 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.993 -1.419 25259 845 1 2 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.834 -5.031 25259 846 1 2 . 1 1 12 12 GLN H H 12 8.280 8.280 8.729 -0.449 25259 847 1 2 . 1 1 13 13 SER N N 13 119.027 119.027 114.347 4.680 25259 848 1 2 . 1 1 13 13 SER HA H 13 4.471 4.471 5.192 -0.721 25259 849 1 2 . 1 1 13 13 SER CA C 13 55.869 55.869 57.838 -1.969 25259 850 1 2 . 1 1 13 13 SER CB C 13 61.424 61.424 64.605 -3.181 25259 851 1 2 . 1 1 13 13 SER H H 13 8.178 8.178 8.747 -0.569 25259 852 1 2 . 1 1 14 14 ALA N N 14 128.314 128.314 123.739 4.575 25259 853 1 2 . 1 1 14 14 ALA HA H 14 4.434 4.434 5.104 -0.670 25259 854 1 2 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.408 -1.712 25259 855 1 2 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.964 -2.883 25259 856 1 2 . 1 1 14 14 ALA H H 14 8.195 8.195 8.665 -0.470 25259 857 1 2 . 1 1 15 15 LEU N N 15 125.175 125.175 120.815 4.360 25259 858 1 2 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.782 -0.142 25259 859 1 2 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.029 -2.425 25259 860 1 2 . 1 1 15 15 LEU CB C 15 39.467 39.467 44.013 -4.546 25259 861 1 2 . 1 1 15 15 LEU H H 15 8.050 8.050 8.820 -0.770 25259 862 1 2 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.646 -0.142 25259 863 1 2 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.813 -2.182 25259 864 1 2 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.569 -2.911 25259 865 1 2 . 1 1 17 17 VAL N N 17 123.223 123.223 117.610 5.613 25259 866 1 2 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.622 -0.488 25259 867 1 2 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.043 -1.216 25259 868 1 2 . 1 1 17 17 VAL CB C 17 30.377 30.377 33.384 -3.007 25259 869 1 2 . 1 1 17 17 VAL H H 17 8.134 8.134 8.336 -0.202 25259 870 1 2 . 1 1 18 18 ILE N N 18 127.777 127.777 120.765 7.012 25259 871 1 2 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.732 -0.489 25259 872 1 2 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.132 -2.810 25259 873 1 2 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.528 -4.274 25259 874 1 2 . 1 1 18 18 ILE H H 18 8.187 8.187 8.947 -0.760 25259 875 1 2 . 1 1 19 19 GLU N N 19 128.148 128.148 121.946 6.202 25259 876 1 2 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.920 -0.583 25259 877 1 2 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.307 -1.216 25259 878 1 2 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.509 -4.333 25259 879 1 2 . 1 1 19 19 GLU H H 19 8.475 8.475 8.709 -0.234 25259 880 1 2 . 1 1 20 20 ASN N N 20 122.788 122.788 117.958 4.830 25259 881 1 2 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.892 -0.197 25259 882 1 2 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.289 -2.467 25259 883 1 2 . 1 1 20 20 ASN CB C 20 36.366 36.366 39.374 -3.008 25259 884 1 2 . 1 1 20 20 ASN H H 20 8.477 8.477 8.493 -0.016 25259 885 1 2 . 1 1 21 21 ALA N N 21 127.253 127.253 123.923 3.330 25259 886 1 2 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.395 -0.074 25259 887 1 2 . 1 1 21 21 ALA CA C 21 50.688 50.688 52.074 -1.386 25259 888 1 2 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.406 -3.493 25259 889 1 2 . 1 1 21 21 ALA H H 21 8.325 8.325 8.127 0.198 25259 890 1 2 . 1 1 22 22 GLU N N 22 122.044 122.044 120.663 1.381 25259 891 1 2 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.333 -0.040 25259 892 1 2 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.650 -2.067 25259 893 1 2 . 1 1 22 22 GLU CB C 22 27.285 27.285 28.779 -1.494 25259 894 1 2 . 1 1 22 22 GLU H H 22 8.415 8.415 8.484 -0.069 25259 895 1 2 . 1 1 23 23 LYS N N 23 123.622 123.622 123.079 0.543 25259 896 1 2 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.588 -0.263 25259 897 1 2 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.198 -0.702 25259 898 1 2 . 1 1 23 23 LYS CB C 23 30.653 30.653 34.323 -3.670 25259 899 1 2 . 1 1 23 23 LYS H H 23 8.127 8.127 8.038 0.089 25259 900 1 2 . 1 1 24 24 ASN N N 24 120.652 120.652 118.862 1.790 25259 901 1 2 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.803 0.038 25259 902 1 2 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.187 -2.524 25259 903 1 2 . 1 1 24 24 ASN CB C 24 36.775 36.775 38.835 -2.060 25259 904 1 2 . 1 1 24 24 ASN H H 24 8.424 8.424 8.459 -0.035 25259 905 1 2 . 1 1 25 25 THR N N 25 117.102 117.102 113.525 3.577 25259 906 1 2 . 1 1 25 25 THR HA H 25 4.367 4.367 4.469 -0.102 25259 907 1 2 . 1 1 25 25 THR CA C 25 59.500 59.500 61.169 -1.669 25259 908 1 2 . 1 1 25 25 THR CB C 25 67.610 67.610 69.876 -2.266 25259 909 1 2 . 1 1 25 25 THR H H 25 7.852 7.852 8.259 -0.407 25259 910 1 2 . 1 1 26 26 VAL N N 26 126.491 126.491 123.574 2.917 25259 911 1 2 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.434 -0.267 25259 912 1 2 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.200 -1.007 25259 913 1 2 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.559 -4.954 25259 914 1 2 . 1 1 26 26 VAL H H 26 8.080 8.080 8.240 -0.160 25259 915 1 2 . 1 1 27 27 VAL N N 27 132.992 132.992 124.856 8.136 25259 916 1 2 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.396 -0.315 25259 917 1 2 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.066 -1.082 25259 918 1 2 . 1 1 27 27 VAL CB C 27 31.540 31.540 32.905 -1.365 25259 919 1 2 . 1 1 27 27 VAL H H 27 8.830 8.830 8.944 -0.114 25259 920 1 2 . 1 1 28 28 THR N N 28 123.576 123.576 114.912 8.664 25259 921 1 2 . 1 1 28 28 THR HA H 28 5.553 5.553 4.887 0.666 25259 922 1 2 . 1 1 28 28 THR CA C 28 58.738 58.738 60.710 -1.972 25259 923 1 2 . 1 1 28 28 THR CB C 28 68.443 68.443 71.161 -2.718 25259 924 1 2 . 1 1 28 28 THR H H 28 8.165 8.165 7.883 0.282 25259 925 1 2 . 1 1 29 29 LYS N N 29 129.099 129.099 124.775 4.324 25259 926 1 2 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.687 0.255 25259 927 1 2 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.295 -3.516 25259 928 1 2 . 1 1 29 29 LYS CB C 29 35.096 35.096 36.341 -1.245 25259 929 1 2 . 1 1 29 29 LYS H H 29 9.273 9.273 8.640 0.633 25259 930 1 2 . 1 1 30 30 THR N N 30 123.510 123.510 122.688 0.822 25259 931 1 2 . 1 1 30 30 THR HA H 30 5.428 5.428 5.179 0.249 25259 932 1 2 . 1 1 30 30 THR CA C 30 59.784 59.784 61.579 -1.795 25259 933 1 2 . 1 1 30 30 THR CB C 30 67.818 67.818 70.519 -2.701 25259 934 1 2 . 1 1 30 30 THR H H 30 8.993 8.993 8.571 0.422 25259 935 1 2 . 1 1 31 31 LEU N N 31 128.293 128.293 129.306 -1.013 25259 936 1 2 . 1 1 31 31 LEU HA H 31 5.220 5.220 5.013 0.207 25259 937 1 2 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.297 -3.242 25259 938 1 2 . 1 1 31 31 LEU CB C 31 43.399 43.399 42.427 0.972 25259 939 1 2 . 1 1 31 31 LEU H H 31 9.557 9.557 9.176 0.381 25259 940 1 2 . 1 1 32 32 VAL N N 32 126.919 126.919 126.872 0.047 25259 941 1 2 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.107 0.344 25259 942 1 2 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.222 -1.558 25259 943 1 2 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.131 -0.682 25259 944 1 2 . 1 1 32 32 VAL H H 32 9.364 9.364 8.843 0.521 25259 945 1 2 . 1 1 33 33 LEU N N 33 133.503 133.503 129.675 3.828 25259 946 1 2 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.502 0.054 25259 947 1 2 . 1 1 33 33 LEU CA C 33 52.004 52.004 52.410 -0.406 25259 948 1 2 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.023 -4.176 25259 949 1 2 . 1 1 33 33 LEU H H 33 8.587 8.587 7.925 0.662 25259 950 1 2 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.432 0.049 25259 951 1 2 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.293 -1.848 25259 952 1 2 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.429 -2.865 25259 953 1 2 . 1 1 35 35 LYS N N 35 127.420 127.420 119.772 7.648 25259 954 1 2 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.413 -0.047 25259 955 1 2 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.783 -1.664 25259 956 1 2 . 1 1 35 35 LYS CB C 35 30.594 30.594 33.051 -2.457 25259 957 1 2 . 1 1 35 35 LYS H H 35 8.666 8.666 8.412 0.254 25259 958 1 2 . 1 1 36 36 SER N N 36 122.222 122.222 122.930 -0.708 25259 959 1 2 . 1 1 36 36 SER HA H 36 4.753 4.753 4.404 0.349 25259 960 1 2 . 1 1 36 36 SER CA C 36 55.328 55.328 59.421 -4.093 25259 961 1 2 . 1 1 36 36 SER CB C 36 61.728 61.728 61.982 -0.254 25259 962 1 2 . 1 1 36 36 SER H H 36 8.771 8.771 8.881 -0.110 25259 963 1 2 . 1 1 37 37 ASP N N 37 126.346 126.346 123.853 2.493 25259 964 1 2 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.323 0.131 25259 965 1 2 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.662 -3.046 25259 966 1 2 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.345 -2.360 25259 967 1 2 . 1 1 37 37 ASP H H 37 8.859 8.859 8.557 0.302 25259 968 1 2 . 1 1 38 38 ASP N N 38 119.171 119.171 119.284 -0.113 25259 969 1 2 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.677 -0.062 25259 970 1 2 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.303 -3.515 25259 971 1 2 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.691 -4.056 25259 972 1 2 . 1 1 38 38 ASP H H 38 7.944 7.944 8.013 -0.069 25259 973 1 2 . 1 1 39 39 GLY N N 39 110.352 110.352 113.614 -3.262 25259 974 1 2 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.264 -2.503 25259 975 1 2 . 1 1 39 39 GLY H H 39 8.145 8.145 8.271 -0.126 25259 976 1 2 . 1 1 40 40 SER N N 40 120.090 120.090 121.951 -1.861 25259 977 1 2 . 1 1 40 40 SER HA H 40 4.877 4.877 4.717 0.160 25259 978 1 2 . 1 1 40 40 SER CA C 40 56.525 56.525 58.600 -2.075 25259 979 1 2 . 1 1 40 40 SER CB C 40 62.245 62.245 63.513 -1.268 25259 980 1 2 . 1 1 40 40 SER H H 40 8.344 8.344 8.287 0.057 25259 981 1 2 . 1 1 41 41 GLN N N 41 122.551 122.551 125.723 -3.172 25259 982 1 2 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.763 0.164 25259 983 1 2 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.566 -1.152 25259 984 1 2 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.453 -3.139 25259 985 1 2 . 1 1 41 41 GLN H H 41 8.627 8.627 8.957 -0.330 25259 986 1 2 . 1 1 42 42 GLN N N 42 131.724 131.724 119.075 12.649 25259 987 1 2 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.692 0.919 25259 988 1 2 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.800 -2.728 25259 989 1 2 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.458 -2.139 25259 990 1 2 . 1 1 42 42 GLN H H 42 9.189 9.189 8.590 0.599 25259 991 1 2 . 1 1 43 43 THR N N 43 122.202 122.202 113.731 8.471 25259 992 1 2 . 1 1 43 43 THR HA H 43 5.380 5.380 5.136 0.244 25259 993 1 2 . 1 1 43 43 THR CA C 43 58.863 58.863 60.962 -2.099 25259 994 1 2 . 1 1 43 43 THR CB C 43 68.893 68.893 72.378 -3.485 25259 995 1 2 . 1 1 43 43 THR H H 43 9.139 9.139 7.953 1.186 25259 996 1 2 . 1 1 44 44 GLN N N 44 127.190 127.190 121.214 5.976 25259 997 1 2 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.090 0.544 25259 998 1 2 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.822 -3.154 25259 999 1 2 . 1 1 44 44 GLN CB C 44 28.910 28.910 33.085 -4.175 25259 1000 1 2 . 1 1 44 44 GLN H H 44 9.760 9.760 8.546 1.214 25259 1001 1 2 . 1 1 45 45 THR N N 45 123.479 123.479 120.517 2.962 25259 1002 1 2 . 1 1 45 45 THR HA H 45 5.421 5.421 5.187 0.234 25259 1003 1 2 . 1 1 45 45 THR CA C 45 60.071 60.071 61.639 -1.568 25259 1004 1 2 . 1 1 45 45 THR CB C 45 67.541 67.541 69.788 -2.247 25259 1005 1 2 . 1 1 45 45 THR H H 45 9.518 9.518 9.153 0.365 25259 1006 1 2 . 1 1 46 46 ILE N N 46 133.908 133.908 127.156 6.752 25259 1007 1 2 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.750 0.253 25259 1008 1 2 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.691 -2.220 25259 1009 1 2 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.398 0.547 25259 1010 1 2 . 1 1 46 46 ILE H H 46 9.830 9.830 9.150 0.680 25259 1011 1 2 . 1 1 47 47 THR N N 47 124.701 124.701 124.285 0.416 25259 1012 1 2 . 1 1 47 47 THR HA H 47 6.048 6.048 4.779 1.269 25259 1013 1 2 . 1 1 47 47 THR CA C 47 58.551 58.551 62.998 -4.447 25259 1014 1 2 . 1 1 47 47 THR CB C 47 67.819 67.819 69.347 -1.528 25259 1015 1 2 . 1 1 47 47 THR H H 47 8.843 8.843 8.556 0.287 25259 1016 1 2 . 1 1 48 48 TYR N N 48 127.369 127.369 122.551 4.818 25259 1017 1 2 . 1 1 48 48 TYR HA H 48 5.278 5.278 4.914 0.364 25259 1018 1 2 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.233 -2.503 25259 1019 1 2 . 1 1 48 48 TYR CB C 48 39.432 39.432 40.825 -1.393 25259 1020 1 2 . 1 1 48 48 TYR H H 48 9.638 9.638 8.457 1.181 25259 1021 1 2 . 1 1 49 49 LYS N N 49 122.138 122.138 116.939 5.199 25259 1022 1 2 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.486 0.170 25259 1023 1 2 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.608 -3.636 25259 1024 1 2 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.251 -0.647 25259 1025 1 2 . 1 1 49 49 LYS H H 49 8.560 8.560 8.859 -0.299 25259 1026 1 2 . 1 1 50 50 ASP N N 50 130.208 130.208 121.692 8.516 25259 1027 1 2 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.757 -0.453 25259 1028 1 2 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.866 -0.106 25259 1029 1 2 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.726 -5.387 25259 1030 1 2 . 1 1 50 50 ASP H H 50 9.597 9.597 8.605 0.992 25259 1031 1 2 . 1 1 51 51 LYS N N 51 124.586 124.586 119.154 5.432 25259 1032 1 2 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.380 0.151 25259 1033 1 2 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.224 -2.490 25259 1034 1 2 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.695 -4.300 25259 1035 1 2 . 1 1 51 51 LYS H H 51 8.450 8.450 8.227 0.223 25259 1036 1 2 . 1 1 52 52 THR N N 52 120.044 120.044 113.746 6.298 25259 1037 1 2 . 1 1 52 52 THR HA H 52 4.717 4.717 4.518 0.199 25259 1038 1 2 . 1 1 52 52 THR CA C 52 59.313 59.313 60.092 -0.779 25259 1039 1 2 . 1 1 52 52 THR CB C 52 68.815 68.815 70.124 -1.309 25259 1040 1 2 . 1 1 52 52 THR H H 52 8.658 8.658 7.651 1.008 25259 1041 1 2 . 1 1 53 53 PHE N N 53 128.987 128.987 121.960 7.027 25259 1042 1 2 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.426 -0.143 25259 1043 1 2 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.604 -0.615 25259 1044 1 2 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.822 0.489 25259 1045 1 2 . 1 1 53 53 PHE H H 53 9.218 9.218 8.807 0.411 25259 1046 1 2 . 1 1 54 54 LEU N N 54 124.874 124.874 123.667 1.207 25259 1047 1 2 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.498 0.431 25259 1048 1 2 . 1 1 54 54 LEU CA C 54 54.241 54.241 55.941 -1.700 25259 1049 1 2 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.448 -1.931 25259 1050 1 2 . 1 1 54 54 LEU H H 54 9.391 9.391 8.167 1.224 25259 1051 1 2 . 1 1 55 55 SER N N 55 115.516 115.516 109.928 5.588 25259 1052 1 2 . 1 1 55 55 SER HA H 55 5.194 5.194 5.422 -0.228 25259 1053 1 2 . 1 1 55 55 SER CA C 55 55.818 55.818 57.654 -1.836 25259 1054 1 2 . 1 1 55 55 SER CB C 55 63.474 63.474 67.109 -3.635 25259 1055 1 2 . 1 1 55 55 SER H H 55 8.736 8.736 7.593 1.143 25259 1056 1 2 . 1 1 56 56 LEU N N 56 124.352 124.352 123.807 0.545 25259 1057 1 2 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.349 0.194 25259 1058 1 2 . 1 1 56 56 LEU CA C 56 51.637 51.637 53.563 -1.926 25259 1059 1 2 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.271 -0.758 25259 1060 1 2 . 1 1 56 56 LEU H H 56 8.328 8.328 9.277 -0.949 25259 1061 1 2 . 1 1 57 57 ALA N N 57 131.450 131.450 128.879 2.571 25259 1062 1 2 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.398 0.107 25259 1063 1 2 . 1 1 57 57 ALA CA C 57 48.202 48.202 51.202 -3.000 25259 1064 1 2 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.562 -2.598 25259 1065 1 2 . 1 1 57 57 ALA H H 57 9.208 9.208 9.088 0.120 25259 1066 1 2 . 1 1 58 58 ILE N N 58 126.248 126.248 126.562 -0.314 25259 1067 1 2 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.388 0.396 25259 1068 1 2 . 1 1 58 58 ILE CA C 58 58.247 58.247 61.771 -3.524 25259 1069 1 2 . 1 1 58 58 ILE CB C 58 38.045 38.045 38.177 -0.132 25259 1070 1 2 . 1 1 58 58 ILE H H 58 9.597 9.597 8.456 1.141 25259 1071 1 2 . 1 1 59 59 GLN N N 59 132.065 132.065 127.351 4.714 25259 1072 1 2 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.615 0.632 25259 1073 1 2 . 1 1 59 59 GLN CA C 59 52.164 52.164 56.444 -4.280 25259 1074 1 2 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.717 -1.056 25259 1075 1 2 . 1 1 59 59 GLN H H 59 9.389 9.389 8.622 0.767 25259 1076 1 2 . 1 1 60 60 GLN N N 60 130.314 130.314 118.425 11.889 25259 1077 1 2 . 1 1 60 60 GLN HA H 60 5.209 5.209 5.064 0.145 25259 1078 1 2 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.611 -2.590 25259 1079 1 2 . 1 1 60 60 GLN CB C 60 29.476 29.476 34.192 -4.716 25259 1080 1 2 . 1 1 60 60 GLN H H 60 9.471 9.471 8.729 0.742 25259 1081 1 2 . 1 1 61 61 LYS N N 61 131.044 131.044 121.473 9.571 25259 1082 1 2 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.114 0.301 25259 1083 1 2 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.247 -3.127 25259 1084 1 2 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.713 -3.296 25259 1085 1 2 . 1 1 61 61 LYS H H 61 8.893 8.893 8.672 0.221 25259 1086 1 2 . 1 1 62 62 ARG N N 62 125.397 125.397 122.128 3.269 25259 1087 1 2 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.329 -0.326 25259 1088 1 2 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.686 -2.595 25259 1089 1 2 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.808 -1.930 25259 1090 1 2 . 1 1 62 62 ARG H H 62 9.120 9.120 8.399 0.721 25259 1091 1 2 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.965 0.010 25259 1092 1 2 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.368 -2.871 25259 1093 1 2 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.428 -2.544 25259 1094 1 2 . 1 1 64 64 VAL N N 64 121.305 121.305 119.380 1.925 25259 1095 1 2 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.557 -0.533 25259 1096 1 2 . 1 1 64 64 VAL CA C 64 59.677 59.677 61.074 -1.397 25259 1097 1 2 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.974 -2.609 25259 1098 1 2 . 1 1 64 64 VAL H H 64 7.520 7.520 8.047 -0.527 25259 1099 1 2 . 1 1 65 65 SER N N 65 123.215 123.215 113.259 9.956 25259 1100 1 2 . 1 1 65 65 SER HA H 65 4.521 4.521 4.748 -0.227 25259 1101 1 2 . 1 1 65 65 SER CA C 65 54.897 54.897 57.070 -2.173 25259 1102 1 2 . 1 1 65 65 SER CB C 65 62.564 62.564 64.657 -2.093 25259 1103 1 2 . 1 1 65 65 SER H H 65 8.080 8.080 8.000 0.080 25259 1104 1 2 . 1 1 66 66 ASP N N 66 123.802 123.802 121.781 2.021 25259 1105 1 2 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.614 -0.185 25259 1106 1 2 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.350 -0.972 25259 1107 1 2 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.026 -2.988 25259 1108 1 2 . 1 1 66 66 ASP H H 66 8.900 8.900 8.652 0.248 25259 1109 1 2 . 1 1 67 67 GLU N N 67 121.943 121.943 120.330 1.613 25259 1110 1 2 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.040 0.149 25259 1111 1 2 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.302 -1.862 25259 1112 1 2 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.474 -2.689 25259 1113 1 2 . 1 1 67 67 GLU H H 67 8.717 8.717 8.473 0.244 25259 1114 1 2 . 1 1 68 68 LEU N N 68 125.458 125.458 120.040 5.418 25259 1115 1 2 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.131 0.212 25259 1116 1 2 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.165 -2.693 25259 1117 1 2 . 1 1 68 68 LEU CB C 68 39.404 39.404 42.011 -2.607 25259 1118 1 2 . 1 1 68 68 LEU H H 68 7.820 7.820 7.931 -0.111 25259 1119 1 2 . 1 1 69 69 LYS N N 69 123.868 123.868 119.200 4.668 25259 1120 1 2 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.028 -0.022 25259 1121 1 2 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.805 -2.188 25259 1122 1 2 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.905 -1.868 25259 1123 1 2 . 1 1 69 69 LYS H H 69 8.690 8.690 7.686 1.004 25259 1124 1 2 . 1 1 70 70 THR N N 70 117.109 117.109 116.166 0.943 25259 1125 1 2 . 1 1 70 70 THR HA H 70 4.088 4.088 4.009 0.079 25259 1126 1 2 . 1 1 70 70 THR CA C 70 63.879 63.879 67.075 -3.196 25259 1127 1 2 . 1 1 70 70 THR CB C 70 66.383 66.383 68.682 -2.299 25259 1128 1 2 . 1 1 70 70 THR H H 70 7.935 7.935 7.825 0.110 25259 1129 1 2 . 1 1 71 71 TYR N N 71 127.006 127.006 123.040 3.966 25259 1130 1 2 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.290 -0.085 25259 1131 1 2 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.987 -1.762 25259 1132 1 2 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.097 -1.552 25259 1133 1 2 . 1 1 71 71 TYR H H 71 7.683 7.683 7.615 0.068 25259 1134 1 2 . 1 1 72 72 ILE N N 72 125.064 125.064 120.704 4.360 25259 1135 1 2 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.700 -0.021 25259 1136 1 2 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.148 -2.253 25259 1137 1 2 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.954 -1.678 25259 1138 1 2 . 1 1 72 72 ILE H H 72 9.083 9.083 7.885 1.198 25259 1139 1 2 . 1 1 73 73 ASP N N 73 124.900 124.900 118.448 6.452 25259 1140 1 2 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.349 0.040 25259 1141 1 2 . 1 1 73 73 ASP CA C 73 55.038 55.038 57.063 -2.025 25259 1142 1 2 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.911 -2.804 25259 1143 1 2 . 1 1 73 73 ASP H H 73 8.751 8.751 8.307 0.444 25259 1144 1 2 . 1 1 74 74 GLN N N 74 117.025 117.025 117.596 -0.571 25259 1145 1 2 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.973 0.165 25259 1146 1 2 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.313 -3.503 25259 1147 1 2 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.032 -1.468 25259 1148 1 2 . 1 1 74 74 GLN H H 74 7.447 7.447 7.726 -0.279 25259 1149 1 2 . 1 1 75 75 HIS N N 75 116.494 116.494 115.618 0.876 25259 1150 1 2 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.451 0.265 25259 1151 1 2 . 1 1 75 75 HIS CA C 75 54.066 54.066 57.194 -3.127 25259 1152 1 2 . 1 1 75 75 HIS CB C 75 28.302 28.302 31.705 -3.403 25259 1153 1 2 . 1 1 75 75 HIS H H 75 8.402 8.402 8.177 0.225 25259 1154 1 2 . 1 1 76 76 GLY N N 76 112.564 112.564 103.703 8.861 25259 1155 1 2 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.932 -3.036 25259 1156 1 2 . 1 1 76 76 GLY H H 76 9.091 9.091 7.552 1.539 25259 1157 1 2 . 1 1 77 77 VAL N N 77 124.763 124.763 120.403 4.360 25259 1158 1 2 . 1 1 77 77 VAL HA H 77 3.565 3.565 4.154 -0.589 25259 1159 1 2 . 1 1 77 77 VAL CA C 77 64.951 64.951 64.699 0.252 25259 1160 1 2 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.242 -2.404 25259 1161 1 2 . 1 1 77 77 VAL H H 77 8.927 8.927 8.445 0.482 25259 1162 1 2 . 1 1 78 78 GLU N N 78 124.388 124.388 120.077 4.311 25259 1163 1 2 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.064 0.084 25259 1164 1 2 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.248 -0.932 25259 1165 1 2 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.857 -2.398 25259 1166 1 2 . 1 1 78 78 GLU H H 78 8.781 8.781 8.525 0.256 25259 1167 1 2 . 1 1 79 79 GLU N N 79 121.887 121.887 119.618 2.269 25259 1168 1 2 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.110 0.078 25259 1169 1 2 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.633 -3.088 25259 1170 1 2 . 1 1 79 79 GLU CB C 79 27.033 27.033 28.981 -1.948 25259 1171 1 2 . 1 1 79 79 GLU H H 79 9.231 9.231 8.609 0.622 25259 1172 1 2 . 1 1 80 80 THR N N 80 120.781 120.781 114.746 6.035 25259 1173 1 2 . 1 1 80 80 THR HA H 80 4.059 4.059 4.135 -0.076 25259 1174 1 2 . 1 1 80 80 THR CA C 80 65.487 65.487 66.154 -0.667 25259 1175 1 2 . 1 1 80 80 THR CB C 80 64.369 64.369 68.335 -3.966 25259 1176 1 2 . 1 1 80 80 THR H H 80 7.858 7.858 7.740 0.118 25259 1177 1 2 . 1 1 81 81 GLN N N 81 125.303 125.303 121.230 4.073 25259 1178 1 2 . 1 1 81 81 GLN HA H 81 4.044 4.044 4.029 0.015 25259 1179 1 2 . 1 1 81 81 GLN CA C 81 56.969 56.969 58.951 -1.982 25259 1180 1 2 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.218 -2.141 25259 1181 1 2 . 1 1 81 81 GLN H H 81 8.765 8.765 7.732 1.033 25259 1182 1 2 . 1 1 82 82 LYS N N 82 120.458 120.458 119.697 0.761 25259 1183 1 2 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.963 0.126 25259 1184 1 2 . 1 1 82 82 LYS CA C 82 57.312 57.312 59.215 -1.903 25259 1185 1 2 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.860 -1.706 25259 1186 1 2 . 1 1 82 82 LYS H H 82 7.521 7.521 7.568 -0.047 25259 1187 1 2 . 1 1 83 83 ALA N N 83 125.234 125.234 120.407 4.827 25259 1188 1 2 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.942 0.275 25259 1189 1 2 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.533 -2.091 25259 1190 1 2 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.854 -2.567 25259 1191 1 2 . 1 1 83 83 ALA H H 83 7.782 7.782 8.081 -0.299 25259 1192 1 2 . 1 1 84 84 LEU N N 84 123.348 123.348 118.605 4.743 25259 1193 1 2 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.905 0.153 25259 1194 1 2 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.466 -1.967 25259 1195 1 2 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.275 -1.967 25259 1196 1 2 . 1 1 84 84 LEU H H 84 8.590 8.590 7.374 1.216 25259 1197 1 2 . 1 1 85 85 LEU N N 85 122.872 122.872 119.213 3.659 25259 1198 1 2 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.971 0.199 25259 1199 1 2 . 1 1 85 85 LEU CA C 85 55.396 55.396 56.647 -1.251 25259 1200 1 2 . 1 1 85 85 LEU CB C 85 38.741 38.741 39.914 -1.173 25259 1201 1 2 . 1 1 85 85 LEU H H 85 7.892 7.892 7.611 0.281 25259 1202 1 2 . 1 1 86 86 GLU N N 86 122.713 122.713 118.852 3.861 25259 1203 1 2 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.081 0.004 25259 1204 1 2 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.270 -2.525 25259 1205 1 2 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.528 -2.625 25259 1206 1 2 . 1 1 86 86 GLU H H 86 8.124 8.124 7.911 0.213 25259 1207 1 2 . 1 1 87 87 ALA N N 87 123.163 123.163 121.459 1.704 25259 1208 1 2 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.078 0.063 25259 1209 1 2 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.814 -2.546 25259 1210 1 2 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.254 -2.622 25259 1211 1 2 . 1 1 87 87 ALA H H 87 7.765 7.765 7.278 0.487 25259 1212 1 2 . 1 1 88 88 GLU N N 88 121.945 121.945 117.358 4.587 25259 1213 1 2 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.082 0.003 25259 1214 1 2 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.331 -1.395 25259 1215 1 2 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.444 -1.417 25259 1216 1 2 . 1 1 88 88 GLU H H 88 7.846 7.846 7.932 -0.086 25259 1217 1 2 . 1 1 89 89 GLU N N 89 117.978 117.978 118.768 -0.790 25259 1218 1 2 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.103 -0.010 25259 1219 1 2 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.471 -3.257 25259 1220 1 2 . 1 1 89 89 GLU CB C 89 27.407 27.407 28.960 -1.553 25259 1221 1 2 . 1 1 89 89 GLU H H 89 7.634 7.634 8.254 -0.620 25259 1222 1 2 . 1 1 90 90 LYS N N 90 117.519 117.519 117.644 -0.125 25259 1223 1 2 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.205 0.226 25259 1224 1 2 . 1 1 90 90 LYS CA C 90 53.018 53.018 57.146 -4.128 25259 1225 1 2 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.726 -1.695 25259 1226 1 2 . 1 1 90 90 LYS H H 90 7.247 7.247 7.478 -0.231 25259 1227 1 2 . 1 1 91 91 ASP N N 91 124.888 124.888 120.911 3.977 25259 1228 1 2 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.585 0.098 25259 1229 1 2 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.875 -2.676 25259 1230 1 2 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.007 -2.426 25259 1231 1 2 . 1 1 91 91 ASP H H 91 7.370 7.370 7.711 -0.341 25259 1232 1 2 . 1 1 92 92 LYS N N 92 129.311 129.311 127.592 1.719 25259 1233 1 2 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.888 0.125 25259 1234 1 2 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.788 -2.571 25259 1235 1 2 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.513 -2.498 25259 1236 1 2 . 1 1 92 92 LYS H H 92 8.795 8.795 8.823 -0.028 25259 1237 1 2 . 1 1 93 93 SER N N 93 118.112 118.112 114.605 3.507 25259 1238 1 2 . 1 1 93 93 SER HA H 93 4.439 4.439 4.188 0.251 25259 1239 1 2 . 1 1 93 93 SER CA C 93 58.945 58.945 61.803 -2.858 25259 1240 1 2 . 1 1 93 93 SER CB C 93 60.278 60.278 63.066 -2.788 25259 1241 1 2 . 1 1 93 93 SER H H 93 8.488 8.488 8.425 0.063 25259 1242 1 2 . 1 1 94 94 ILE N N 94 128.950 128.950 121.670 7.280 25259 1243 1 2 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.701 -0.219 25259 1244 1 2 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.078 -1.728 25259 1245 1 2 . 1 1 94 94 ILE CB C 94 34.753 34.753 38.167 -3.414 25259 1246 1 2 . 1 1 94 94 ILE H H 94 7.722 7.722 7.385 0.337 25259 1247 1 2 . 1 1 95 95 ILE N N 95 123.598 123.598 120.767 2.831 25259 1248 1 2 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.526 0.069 25259 1249 1 2 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.576 -2.829 25259 1250 1 2 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.519 -1.547 25259 1251 1 2 . 1 1 95 95 ILE H H 95 8.378 8.378 8.362 0.016 25259 1252 1 2 . 1 1 96 96 GLU N N 96 118.317 118.317 117.856 0.461 25259 1253 1 2 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.978 0.006 25259 1254 1 2 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.206 -2.711 25259 1255 1 2 . 1 1 96 96 GLU CB C 96 27.173 27.173 28.992 -1.819 25259 1256 1 2 . 1 1 96 96 GLU H H 96 7.680 7.680 7.683 -0.003 25259 1257 1 2 . 1 1 97 97 ALA N N 97 124.797 124.797 122.207 2.590 25259 1258 1 2 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.800 0.025 25259 1259 1 2 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.404 -2.107 25259 1260 1 2 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.247 -2.258 25259 1261 1 2 . 1 1 97 97 ALA H H 97 7.383 7.383 7.532 -0.149 25259 1262 1 2 . 1 1 98 98 ARG N N 98 115.469 115.469 116.560 -1.091 25259 1263 1 2 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.276 0.030 25259 1264 1 2 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.562 -2.072 25259 1265 1 2 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.939 -1.701 25259 1266 1 2 . 1 1 98 98 ARG H H 98 8.229 8.229 7.592 0.637 25259 1267 1 2 . 1 1 99 99 LYS N N 99 120.219 120.219 118.153 2.066 25259 1268 1 2 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.090 0.168 25259 1269 1 2 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.847 -2.606 25259 1270 1 2 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.720 -2.224 25259 1271 1 2 . 1 1 99 99 LYS H H 99 7.270 7.270 7.460 -0.190 25259 1272 1 2 . 1 1 100 100 LEU N N 100 123.800 123.800 119.824 3.976 25259 1273 1 2 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.271 0.070 25259 1274 1 2 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.961 -2.882 25259 1275 1 2 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.343 -3.212 25259 1276 1 2 . 1 1 100 100 LEU H H 100 7.837 7.837 7.713 0.124 25259 1277 1 2 . 1 1 101 101 ALA N N 101 130.512 130.512 126.764 3.748 25259 1278 1 2 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.433 -0.057 25259 1279 1 2 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.132 -2.728 25259 1280 1 2 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.659 -2.863 25259 1281 1 2 . 1 1 101 101 ALA H H 101 8.213 8.213 9.005 -0.792 25259 1282 1 2 . 1 1 102 102 GLY N N 102 110.659 110.659 105.519 5.140 25259 1283 1 2 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.766 -0.873 25259 1284 1 2 . 1 1 102 102 GLY H H 102 8.738 8.738 8.120 0.618 25259 1285 1 2 . 1 1 103 103 PHE N N 103 123.097 123.097 123.274 -0.177 25259 1286 1 2 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.130 0.090 25259 1287 1 2 . 1 1 103 103 PHE CA C 103 53.768 53.768 58.186 -4.418 25259 1288 1 2 . 1 1 103 103 PHE CB C 103 40.574 40.574 40.648 -0.074 25259 1289 1 2 . 1 1 103 103 PHE H H 103 7.514 7.514 7.585 -0.071 25259 1290 1 2 . 1 1 104 104 LYS N N 104 130.652 130.652 125.599 5.053 25259 1291 1 2 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.327 -0.207 25259 1292 1 2 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.519 -1.540 25259 1293 1 2 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.954 -2.717 25259 1294 1 2 . 1 1 104 104 LYS H H 104 7.473 7.473 7.895 -0.422 25259 1295 1 2 . 1 1 105 105 LEU N N 105 127.372 127.372 120.998 6.374 25259 1296 1 2 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.461 0.535 25259 1297 1 2 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.267 -2.531 25259 1298 1 2 . 1 1 105 105 LEU CB C 105 43.964 43.964 44.846 -0.882 25259 1299 1 2 . 1 1 105 105 LEU H H 105 8.393 8.393 8.178 0.215 25259 1300 1 2 . 1 1 106 106 GLU N N 106 129.358 129.358 125.361 3.997 25259 1301 1 2 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.604 0.240 25259 1302 1 2 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.141 -2.351 25259 1303 1 2 . 1 1 106 106 GLU CB C 106 31.628 31.628 32.424 -0.796 25259 1304 1 2 . 1 1 106 106 GLU H H 106 8.849 8.849 8.635 0.214 25259 1305 1 2 . 1 1 107 107 THR N N 107 131.118 131.118 120.590 10.528 25259 1306 1 2 . 1 1 107 107 THR HA H 107 5.110 5.110 4.726 0.384 25259 1307 1 2 . 1 1 107 107 THR CA C 107 59.832 59.832 62.083 -2.251 25259 1308 1 2 . 1 1 107 107 THR CB C 107 66.671 66.671 69.493 -2.822 25259 1309 1 2 . 1 1 107 107 THR H H 107 9.433 9.433 8.365 1.068 25259 1310 1 2 . 1 1 108 108 LYS N N 108 129.114 129.114 124.768 4.346 25259 1311 1 2 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.781 0.043 25259 1312 1 2 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.673 -2.479 25259 1313 1 2 . 1 1 108 108 LYS CB C 108 34.388 34.388 36.776 -2.388 25259 1314 1 2 . 1 1 108 108 LYS H H 108 9.410 9.410 8.973 0.437 25259 1315 1 2 . 1 1 109 109 LEU N N 109 129.323 129.323 126.839 2.484 25259 1316 1 2 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.476 0.228 25259 1317 1 2 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.685 -2.577 25259 1318 1 2 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.425 -2.770 25259 1319 1 2 . 1 1 109 109 LEU H H 109 8.862 8.862 9.143 -0.281 25259 1320 1 2 . 1 1 110 110 LEU N N 110 129.123 129.123 127.952 1.171 25259 1321 1 2 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.141 0.082 25259 1322 1 2 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.912 -3.130 25259 1323 1 2 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.487 -1.826 25259 1324 1 2 . 1 1 110 110 LEU H H 110 8.373 8.373 8.480 -0.107 25259 1325 1 2 . 1 1 111 111 SER N N 111 114.587 114.587 110.836 3.751 25259 1326 1 2 . 1 1 111 111 SER HA H 111 4.557 4.557 4.680 -0.123 25259 1327 1 2 . 1 1 111 111 SER CA C 111 53.889 53.889 57.363 -3.474 25259 1328 1 2 . 1 1 111 111 SER CB C 111 61.830 61.830 65.325 -3.494 25259 1329 1 2 . 1 1 111 111 SER H H 111 8.400 8.400 7.913 0.487 25259 1330 1 2 . 1 1 112 112 ALA N N 112 118.269 118.269 123.751 -5.482 25259 1331 1 2 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.201 0.108 25259 1332 1 2 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.584 -3.370 25259 1333 1 2 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.517 -1.929 25259 1334 1 2 . 1 1 112 112 ALA H H 112 8.556 8.556 8.575 -0.019 25259 1335 1 2 . 1 1 113 113 THR N N 113 102.878 102.878 102.202 0.676 25259 1336 1 2 . 1 1 113 113 THR HA H 113 4.662 4.662 4.389 0.273 25259 1337 1 2 . 1 1 113 113 THR CA C 113 58.689 58.689 61.609 -2.920 25259 1338 1 2 . 1 1 113 113 THR CB C 113 67.905 67.905 69.741 -1.836 25259 1339 1 2 . 1 1 113 113 THR H H 113 8.065 8.065 7.749 0.316 25259 1340 1 2 . 1 1 114 114 GLU N N 114 126.514 126.514 121.162 5.352 25259 1341 1 2 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.046 -0.032 25259 1342 1 2 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.255 -2.248 25259 1343 1 2 . 1 1 114 114 GLU CB C 114 32.913 32.913 33.850 -0.937 25259 1344 1 2 . 1 1 114 114 GLU H H 114 7.357 7.357 7.926 -0.569 25259 1345 1 2 . 1 1 115 115 LEU N N 115 128.058 128.058 121.063 6.995 25259 1346 1 2 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.457 -0.535 25259 1347 1 2 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.488 -1.164 25259 1348 1 2 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.001 -1.862 25259 1349 1 2 . 1 1 115 115 LEU H H 115 8.930 8.930 8.958 -0.028 25259 1350 1 2 . 1 1 116 116 GLN N N 116 126.540 126.540 117.589 8.951 25259 1351 1 2 . 1 1 116 116 GLN HA H 116 5.715 5.715 4.991 0.724 25259 1352 1 2 . 1 1 116 116 GLN CA C 116 51.700 51.700 55.001 -3.301 25259 1353 1 2 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.322 -1.030 25259 1354 1 2 . 1 1 116 116 GLN H H 116 9.221 9.221 9.099 0.122 25259 1355 1 2 . 1 1 117 117 THR N N 117 125.213 125.213 117.695 7.518 25259 1356 1 2 . 1 1 117 117 THR HA H 117 5.353 5.353 5.101 0.252 25259 1357 1 2 . 1 1 117 117 THR CA C 117 58.926 58.926 60.887 -1.961 25259 1358 1 2 . 1 1 117 117 THR CB C 117 68.948 68.948 72.454 -3.506 25259 1359 1 2 . 1 1 117 117 THR H H 117 9.030 9.030 8.932 0.098 25259 1360 1 2 . 1 1 118 118 THR N N 118 127.799 127.799 118.470 9.329 25259 1361 1 2 . 1 1 118 118 THR HA H 118 5.527 5.527 4.848 0.679 25259 1362 1 2 . 1 1 118 118 THR CA C 118 59.201 59.201 61.897 -2.696 25259 1363 1 2 . 1 1 118 118 THR CB C 118 67.721 67.721 70.588 -2.867 25259 1364 1 2 . 1 1 118 118 THR H H 118 9.459 9.459 8.172 1.287 25259 1365 1 2 . 1 1 119 119 THR N N 119 129.258 129.258 122.793 6.465 25259 1366 1 2 . 1 1 119 119 THR HA H 119 4.885 4.885 4.384 0.501 25259 1367 1 2 . 1 1 119 119 THR CA C 119 58.463 58.463 62.544 -4.081 25259 1368 1 2 . 1 1 119 119 THR CB C 119 67.459 67.459 68.888 -1.429 25259 1369 1 2 . 1 1 119 119 THR H H 119 9.147 9.147 8.665 0.482 25259 1370 1 2 . 1 1 120 120 SER N N 120 123.389 123.389 121.399 1.990 25259 1371 1 2 . 1 1 120 120 SER HA H 120 5.328 5.328 4.653 0.675 25259 1372 1 2 . 1 1 120 120 SER CA C 120 54.386 54.386 56.692 -2.306 25259 1373 1 2 . 1 1 120 120 SER CB C 120 63.031 63.031 64.750 -1.719 25259 1374 1 2 . 1 1 120 120 SER H H 120 8.786 8.786 8.153 0.633 25259 1375 1 2 . 1 1 121 121 PHE N N 121 121.245 121.245 125.782 -4.537 25259 1376 1 2 . 1 1 121 121 PHE HA H 121 5.112 5.112 5.156 -0.044 25259 1377 1 2 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.597 -3.405 25259 1378 1 2 . 1 1 121 121 PHE CB C 121 40.265 40.265 41.476 -1.211 25259 1379 1 2 . 1 1 121 121 PHE H H 121 8.831 8.831 9.371 -0.540 25259 1380 1 2 . 1 1 122 122 ASP N N 122 124.765 124.765 126.645 -1.880 25259 1381 1 2 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.970 -0.130 25259 1382 1 2 . 1 1 122 122 ASP CA C 122 49.837 49.837 54.255 -4.418 25259 1383 1 2 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.238 -1.753 25259 1384 1 2 . 1 1 122 122 ASP H H 122 8.819 8.819 9.070 -0.251 25259 1385 1 2 . 1 1 123 123 PHE N N 123 124.303 124.303 122.929 1.374 25259 1386 1 2 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.278 0.396 25259 1387 1 2 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.406 -2.608 25259 1388 1 2 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.839 -3.299 25259 1389 1 2 . 1 1 123 123 PHE H H 123 8.262 8.262 8.380 -0.118 25259 1390 1 2 . 1 1 124 124 GLN N N 124 120.792 120.792 116.754 4.038 25259 1391 1 2 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.170 0.264 25259 1392 1 2 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.230 -2.147 25259 1393 1 2 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.982 -1.853 25259 1394 1 2 . 1 1 124 124 GLN H H 124 8.954 8.954 8.026 0.928 25259 1395 1 2 . 1 1 125 125 VAL N N 125 114.091 114.091 110.070 4.021 25259 1396 1 2 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.321 0.088 25259 1397 1 2 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.041 -2.743 25259 1398 1 2 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.832 -1.260 25259 1399 1 2 . 1 1 125 125 VAL H H 125 7.026 7.026 7.797 -0.771 25259 1400 1 2 . 1 1 126 126 LEU N N 126 125.158 125.158 123.921 1.237 25259 1401 1 2 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.276 0.199 25259 1402 1 2 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.494 -2.319 25259 1403 1 2 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.975 -0.921 25259 1404 1 2 . 1 1 126 126 LEU H H 126 8.106 8.106 7.887 0.219 25259 1405 1 2 . 1 1 127 127 ASP N N 127 130.026 130.026 128.504 1.522 25259 1406 1 2 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.590 0.251 25259 1407 1 2 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.957 -3.759 25259 1408 1 2 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.949 -2.260 25259 1409 1 2 . 1 1 127 127 ASP H H 127 9.129 9.129 8.641 0.488 25259 1410 1 2 . 1 1 128 128 VAL N N 128 128.833 128.833 124.506 4.327 25259 1411 1 2 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.374 0.150 25259 1412 1 2 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.801 -3.133 25259 1413 1 2 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.426 -1.931 25259 1414 1 2 . 1 1 128 128 VAL H H 128 8.288 8.288 7.776 0.512 25259 1415 1 2 . 1 1 129 129 LYS N N 129 123.914 123.914 117.900 6.014 25259 1416 1 2 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.916 0.127 25259 1417 1 2 . 1 1 129 129 LYS CA C 129 56.789 56.789 59.138 -2.349 25259 1418 1 2 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.803 -2.866 25259 1419 1 2 . 1 1 129 129 LYS H H 129 8.226 8.226 8.359 -0.133 25259 1420 1 2 . 1 1 130 130 LYS N N 130 121.888 121.888 116.970 4.918 25259 1421 1 2 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.221 -0.136 25259 1422 1 2 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.314 -1.168 25259 1423 1 2 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.523 -2.183 25259 1424 1 2 . 1 1 130 130 LYS H H 130 7.590 7.590 7.577 0.013 25259 1425 1 2 . 1 1 131 131 ALA N N 131 123.088 123.088 122.557 0.531 25259 1426 1 2 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.153 -0.226 25259 1427 1 2 . 1 1 131 131 ALA CA C 131 52.402 52.402 54.917 -2.515 25259 1428 1 2 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.778 -2.331 25259 1429 1 2 . 1 1 131 131 ALA H H 131 8.506 8.506 8.142 0.364 25259 1430 1 2 . 1 1 132 132 SER N N 132 110.456 110.456 112.237 -1.781 25259 1431 1 2 . 1 1 132 132 SER HA H 132 4.117 4.117 4.032 0.085 25259 1432 1 2 . 1 1 132 132 SER CA C 132 58.289 58.289 60.473 -2.184 25259 1433 1 2 . 1 1 132 132 SER CB C 132 61.034 61.034 63.303 -2.269 25259 1434 1 2 . 1 1 132 132 SER H H 132 7.986 7.986 8.088 -0.102 25259 1435 1 2 . 1 1 133 133 GLN N N 133 119.034 119.034 117.693 1.341 25259 1436 1 2 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.374 0.028 25259 1437 1 2 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.999 -2.474 25259 1438 1 2 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.788 -1.554 25259 1439 1 2 . 1 1 133 133 GLN H H 133 7.233 7.233 7.542 -0.309 25259 1440 1 2 . 1 1 134 134 LEU N N 134 123.291 123.291 122.150 1.141 25259 1441 1 2 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.401 -0.008 25259 1442 1 2 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.777 -1.461 25259 1443 1 2 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.645 -3.798 25259 1444 1 2 . 1 1 134 134 LEU H H 134 7.411 7.411 7.571 -0.160 25259 1445 1 2 . 1 1 135 135 GLU N N 135 128.446 128.446 122.158 6.288 25259 1446 1 2 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.937 0.009 25259 1447 1 2 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.302 -1.918 25259 1448 1 2 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.614 -2.318 25259 1449 1 2 . 1 1 135 135 GLU H H 135 8.986 8.986 8.868 0.118 25259 1450 1 2 . 1 1 136 136 HIS N N 136 117.593 117.593 118.472 -0.879 25259 1451 1 2 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.418 -0.035 25259 1452 1 2 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.557 -1.872 25259 1453 1 2 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.959 -1.546 25259 1454 1 2 . 1 1 136 136 HIS H H 136 9.226 9.226 8.335 0.891 25259 1455 1 2 . 1 1 137 137 LEU N N 137 115.463 115.463 117.828 -2.365 25259 1456 1 2 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.249 0.258 25259 1457 1 2 . 1 1 137 137 LEU CA C 137 51.948 51.948 55.467 -3.519 25259 1458 1 2 . 1 1 137 137 LEU CB C 137 39.807 39.807 41.538 -1.730 25259 1459 1 2 . 1 1 137 137 LEU H H 137 7.090 7.090 8.214 -1.124 25259 1460 1 2 . 1 1 138 138 LYS N N 138 124.686 124.686 119.959 4.727 25259 1461 1 2 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.183 -0.014 25259 1462 1 2 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.892 -1.734 25259 1463 1 2 . 1 1 138 138 LYS CB C 138 30.088 30.088 31.789 -1.701 25259 1464 1 2 . 1 1 138 138 LYS H H 138 7.698 7.698 8.088 -0.390 25259 1465 1 2 . 1 1 139 139 ASN N N 139 118.077 118.077 116.397 1.680 25259 1466 1 2 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.548 0.125 25259 1467 1 2 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.050 -2.268 25259 1468 1 2 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.588 -2.771 25259 1469 1 2 . 1 1 139 139 ASN H H 139 8.485 8.485 8.098 0.387 25259 1470 1 2 . 1 1 140 140 ILE N N 140 120.880 120.880 119.955 0.925 25259 1471 1 2 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.219 -0.189 25259 1472 1 2 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.956 -1.390 25259 1473 1 2 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.447 -2.673 25259 1474 1 2 . 1 1 140 140 ILE H H 140 7.549 7.549 7.567 -0.018 25259 1475 1 2 . 1 1 141 141 GLY N N 141 110.676 110.676 115.287 -4.611 25259 1476 1 2 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.555 0.109 25259 1477 1 2 . 1 1 141 141 GLY H H 141 7.663 7.663 8.694 -1.031 25259 1478 1 2 . 1 1 142 142 LEU N N 142 123.857 123.857 123.569 0.288 25259 1479 1 2 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.754 -0.061 25259 1480 1 2 . 1 1 142 142 LEU CA C 142 55.193 55.193 58.203 -3.010 25259 1481 1 2 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.564 -0.955 25259 1482 1 2 . 1 1 142 142 LEU H H 142 8.496 8.496 7.675 0.821 25259 1483 1 2 . 1 1 143 143 GLU N N 143 118.407 118.407 115.503 2.904 25259 1484 1 2 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.986 -0.200 25259 1485 1 2 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.439 -1.217 25259 1486 1 2 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.758 -2.244 25259 1487 1 2 . 1 1 143 143 GLU H H 143 8.672 8.672 8.626 0.046 25259 1488 1 2 . 1 1 144 144 ASN N N 144 118.477 118.477 116.758 1.719 25259 1489 1 2 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.590 -0.148 25259 1490 1 2 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.685 -1.973 25259 1491 1 2 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.587 -2.632 25259 1492 1 2 . 1 1 144 144 ASN H H 144 7.656 7.656 7.300 0.356 25259 1493 1 2 . 1 1 145 145 LEU N N 145 125.354 125.354 121.217 4.137 25259 1494 1 2 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.803 -0.006 25259 1495 1 2 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.339 -1.016 25259 1496 1 2 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.091 -2.518 25259 1497 1 2 . 1 1 145 145 LEU H H 145 7.758 7.758 7.961 -0.203 25259 1498 1 2 . 1 1 146 146 LEU N N 146 116.372 116.372 119.452 -3.080 25259 1499 1 2 . 1 1 146 146 LEU HA H 146 3.876 3.876 4.310 -0.434 25259 1500 1 2 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.307 -2.064 25259 1501 1 2 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.662 -1.765 25259 1502 1 2 . 1 1 146 146 LEU H H 146 7.242 7.242 7.590 -0.348 25259 1503 1 2 . 1 1 147 147 LYS N N 147 120.054 120.054 119.614 0.440 25259 1504 1 2 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.472 -0.160 25259 1505 1 2 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.885 -1.262 25259 1506 1 2 . 1 1 147 147 LYS CB C 147 30.260 30.260 33.791 -3.531 25259 1507 1 2 . 1 1 147 147 LYS H H 147 7.185 7.185 8.376 -1.191 25259 1508 1 2 . 1 1 148 148 ASN N N 148 119.498 119.498 117.549 1.949 25259 1509 1 2 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.907 0.055 25259 1510 1 2 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.005 -2.231 25259 1511 1 2 . 1 1 148 148 ASN CB C 148 39.486 39.486 39.967 -0.481 25259 1512 1 2 . 1 1 148 148 ASN H H 148 7.698 7.698 7.743 -0.045 25259 1513 1 2 . 1 1 149 149 GLU N N 149 122.834 122.834 117.768 5.066 25259 1514 1 2 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.588 0.013 25259 1515 1 2 . 1 1 149 149 GLU CA C 149 52.219 52.219 55.038 -2.819 25259 1516 1 2 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.400 -2.590 25259 1517 1 2 . 1 1 149 149 GLU H H 149 8.767 8.767 8.628 0.139 25259 1518 1 2 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.495 1.113 25259 1519 1 2 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.498 -1.256 25259 1520 1 2 . 1 1 150 150 PRO CB C 150 28.095 28.095 30.581 -2.486 25259 1521 1 2 . 1 1 151 151 SER N N 151 112.839 112.839 111.453 1.386 25259 1522 1 2 . 1 1 151 151 SER HA H 151 3.835 3.835 4.127 -0.292 25259 1523 1 2 . 1 1 151 151 SER CA C 151 59.270 59.270 59.549 -0.279 25259 1524 1 2 . 1 1 151 151 SER CB C 151 59.451 59.451 62.406 -2.955 25259 1525 1 2 . 1 1 151 151 SER H H 151 8.519 8.519 7.949 0.570 25259 1526 1 2 . 1 1 152 152 LYS N N 152 126.710 126.710 122.790 3.920 25259 1527 1 2 . 1 1 152 152 LYS HA H 152 4.248 4.248 3.960 0.288 25259 1528 1 2 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.646 -3.881 25259 1529 1 2 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.355 -2.099 25259 1530 1 2 . 1 1 152 152 LYS H H 152 7.006 7.006 7.609 -0.603 25259 1531 1 2 . 1 1 153 153 TYR N N 153 123.239 123.239 114.946 8.293 25259 1532 1 2 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.456 -0.198 25259 1533 1 2 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.239 1.070 25259 1534 1 2 . 1 1 153 153 TYR CB C 153 36.334 36.334 38.059 -1.725 25259 1535 1 2 . 1 1 153 153 TYR H H 153 8.058 8.058 7.940 0.118 25259 1536 1 2 . 1 1 154 154 ILE N N 154 120.253 120.253 121.420 -1.167 25259 1537 1 2 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.189 0.183 25259 1538 1 2 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.019 -1.905 25259 1539 1 2 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.298 -1.350 25259 1540 1 2 . 1 1 154 154 ILE H H 154 8.193 8.193 7.464 0.729 25259 1541 1 2 . 1 1 155 155 SER N N 155 117.178 117.178 112.768 4.410 25259 1542 1 2 . 1 1 155 155 SER HA H 155 4.091 4.091 4.191 -0.100 25259 1543 1 2 . 1 1 155 155 SER CA C 155 59.961 59.961 60.741 -0.780 25259 1544 1 2 . 1 1 155 155 SER CB C 155 60.148 60.148 62.988 -2.840 25259 1545 1 2 . 1 1 155 155 SER H H 155 8.020 8.020 8.035 -0.015 25259 1546 1 2 . 1 1 156 156 ASP N N 156 125.479 125.479 121.216 4.263 25259 1547 1 2 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.623 -0.196 25259 1548 1 2 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.239 -1.478 25259 1549 1 2 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.229 -3.356 25259 1550 1 2 . 1 1 156 156 ASP H H 156 8.638 8.638 7.717 0.921 25259 1551 1 2 . 1 1 157 157 ARG N N 157 121.542 121.542 120.314 1.228 25259 1552 1 2 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.204 -0.093 25259 1553 1 2 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.594 -2.666 25259 1554 1 2 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.466 -1.651 25259 1555 1 2 . 1 1 157 157 ARG H H 157 7.888 7.888 7.216 0.672 25259 1556 1 2 . 1 1 158 158 LEU N N 158 124.257 124.257 118.804 5.453 25259 1557 1 2 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.299 -0.028 25259 1558 1 2 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.752 -2.539 25259 1559 1 2 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.291 -1.346 25259 1560 1 2 . 1 1 158 158 LEU H H 158 8.442 8.442 7.588 0.854 25259 1561 1 2 . 1 1 159 159 ALA N N 159 124.146 124.146 121.603 2.543 25259 1562 1 2 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.058 0.274 25259 1563 1 2 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.395 -2.963 25259 1564 1 2 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.488 -2.581 25259 1565 1 2 . 1 1 159 159 ALA H H 159 8.086 8.086 8.156 -0.070 25259 1566 1 2 . 1 1 160 160 ASN N N 160 118.093 118.093 115.935 2.158 25259 1567 1 2 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.554 0.438 25259 1568 1 2 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.731 -3.154 25259 1569 1 2 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.714 -0.981 25259 1570 1 2 . 1 1 160 160 ASN H H 160 7.445 7.445 8.158 -0.713 25259 1571 1 2 . 1 1 161 161 GLY N N 161 108.365 108.365 105.718 2.647 25259 1572 1 2 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.180 -1.534 25259 1573 1 2 . 1 1 161 161 GLY H H 161 7.743 7.743 7.822 -0.079 25259 1574 1 2 . 1 1 162 162 ALA N N 162 123.928 123.928 122.094 1.834 25259 1575 1 2 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.624 0.249 25259 1576 1 2 . 1 1 162 162 ALA CA C 162 49.526 49.526 52.054 -2.528 25259 1577 1 2 . 1 1 162 162 ALA CB C 162 18.060 18.060 20.397 -2.337 25259 1578 1 2 . 1 1 162 162 ALA H H 162 8.035 8.035 7.742 0.293 25259 1579 1 2 . 1 1 163 163 THR N N 163 113.286 113.286 112.556 0.730 25259 1580 1 2 . 1 1 163 163 THR HA H 163 4.703 4.703 4.622 0.081 25259 1581 1 2 . 1 1 163 163 THR CA C 163 57.791 57.791 60.306 -2.515 25259 1582 1 2 . 1 1 163 163 THR CB C 163 68.974 68.974 71.523 -2.549 25259 1583 1 2 . 1 1 163 163 THR H H 163 8.451 8.451 8.233 0.218 25259 1584 1 2 . 1 1 164 164 GLU N N 164 125.905 125.905 121.246 4.659 25259 1585 1 2 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.926 0.134 25259 1586 1 2 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.938 -2.353 25259 1587 1 2 . 1 1 164 164 GLU CB C 164 29.211 29.211 31.141 -1.930 25259 1588 1 2 . 1 1 164 164 GLU H H 164 8.716 8.716 8.639 0.077 25259 1589 1 3 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.207 -0.532 25259 1590 1 3 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.612 -1.804 25259 1591 1 3 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.813 -3.743 25259 1592 1 3 . 1 1 3 3 ALA N N 3 126.741 126.741 124.331 2.410 25259 1593 1 3 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.964 -0.470 25259 1594 1 3 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.569 -1.367 25259 1595 1 3 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.118 -4.300 25259 1596 1 3 . 1 1 3 3 ALA H H 3 8.440 8.440 8.826 -0.386 25259 1597 1 3 . 1 1 4 4 THR N N 4 116.015 116.015 114.138 1.877 25259 1598 1 3 . 1 1 4 4 THR HA H 4 4.393 4.393 4.863 -0.470 25259 1599 1 3 . 1 1 4 4 THR CA C 4 59.148 59.148 61.468 -2.320 25259 1600 1 3 . 1 1 4 4 THR CB C 4 67.580 67.580 70.857 -3.277 25259 1601 1 3 . 1 1 4 4 THR H H 4 8.050 8.050 8.207 -0.157 25259 1602 1 3 . 1 1 5 5 LYS N N 5 126.350 126.350 123.337 3.013 25259 1603 1 3 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.653 -0.148 25259 1604 1 3 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.809 -1.892 25259 1605 1 3 . 1 1 5 5 LYS CB C 5 30.684 30.684 33.476 -2.792 25259 1606 1 3 . 1 1 5 5 LYS H H 5 8.332 8.332 8.528 -0.196 25259 1607 1 3 . 1 1 6 6 THR N N 6 118.124 118.124 113.145 4.979 25259 1608 1 3 . 1 1 6 6 THR HA H 6 4.440 4.440 4.611 -0.171 25259 1609 1 3 . 1 1 6 6 THR CA C 6 59.282 59.282 61.348 -2.066 25259 1610 1 3 . 1 1 6 6 THR CB C 6 67.685 67.685 70.402 -2.717 25259 1611 1 3 . 1 1 6 6 THR H H 6 8.283 8.283 8.195 0.088 25259 1612 1 3 . 1 1 7 7 GLU N N 7 125.934 125.934 123.500 2.434 25259 1613 1 3 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.685 -0.341 25259 1614 1 3 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.950 -1.769 25259 1615 1 3 . 1 1 7 7 GLU CB C 7 27.816 27.816 31.938 -4.122 25259 1616 1 3 . 1 1 7 7 GLU H H 7 8.487 8.487 8.665 -0.178 25259 1617 1 3 . 1 1 8 8 LYS N N 8 123.945 123.945 120.214 3.731 25259 1618 1 3 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.863 -1.928 25259 1619 1 3 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.743 -3.178 25259 1620 1 3 . 1 1 8 8 LYS H H 8 8.278 8.278 8.514 -0.236 25259 1621 1 3 . 1 1 9 9 ASP N N 9 123.624 123.624 118.789 4.835 25259 1622 1 3 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.758 -0.419 25259 1623 1 3 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.659 -1.536 25259 1624 1 3 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.009 -3.076 25259 1625 1 3 . 1 1 9 9 ASP H H 9 8.277 8.277 8.478 -0.201 25259 1626 1 3 . 1 1 10 10 THR N N 10 116.812 116.812 114.145 2.667 25259 1627 1 3 . 1 1 10 10 THR HA H 10 4.349 4.349 4.559 -0.210 25259 1628 1 3 . 1 1 10 10 THR CA C 10 59.634 59.634 61.612 -1.978 25259 1629 1 3 . 1 1 10 10 THR CB C 10 67.254 67.254 69.072 -1.818 25259 1630 1 3 . 1 1 10 10 THR H H 10 8.049 8.049 8.394 -0.345 25259 1631 1 3 . 1 1 11 11 LEU N N 11 126.610 126.610 123.207 3.403 25259 1632 1 3 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.482 -0.090 25259 1633 1 3 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.913 -1.835 25259 1634 1 3 . 1 1 11 11 LEU CB C 11 39.633 39.633 43.058 -3.425 25259 1635 1 3 . 1 1 11 11 LEU H H 11 8.191 8.191 8.638 -0.447 25259 1636 1 3 . 1 1 12 12 GLN N N 12 123.274 123.274 118.668 4.606 25259 1637 1 3 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.626 -0.244 25259 1638 1 3 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.310 -1.736 25259 1639 1 3 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.675 -4.872 25259 1640 1 3 . 1 1 12 12 GLN H H 12 8.280 8.280 8.148 0.132 25259 1641 1 3 . 1 1 13 13 SER N N 13 119.027 119.027 114.992 4.035 25259 1642 1 3 . 1 1 13 13 SER HA H 13 4.471 4.471 4.782 -0.311 25259 1643 1 3 . 1 1 13 13 SER CA C 13 55.869 55.869 57.479 -1.610 25259 1644 1 3 . 1 1 13 13 SER CB C 13 61.424 61.424 64.518 -3.094 25259 1645 1 3 . 1 1 13 13 SER H H 13 8.178 8.178 8.591 -0.413 25259 1646 1 3 . 1 1 14 14 ALA N N 14 128.314 128.314 123.197 5.117 25259 1647 1 3 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.635 -0.201 25259 1648 1 3 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.720 -2.024 25259 1649 1 3 . 1 1 14 14 ALA CB C 14 17.081 17.081 20.001 -2.920 25259 1650 1 3 . 1 1 14 14 ALA H H 14 8.195 8.195 8.250 -0.055 25259 1651 1 3 . 1 1 15 15 LEU N N 15 125.175 125.175 120.964 4.211 25259 1652 1 3 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.784 -0.144 25259 1653 1 3 . 1 1 15 15 LEU CA C 15 50.604 50.604 52.893 -2.289 25259 1654 1 3 . 1 1 15 15 LEU CB C 15 39.467 39.467 41.666 -2.199 25259 1655 1 3 . 1 1 15 15 LEU H H 15 8.050 8.050 8.302 -0.252 25259 1656 1 3 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.541 -0.037 25259 1657 1 3 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.533 -1.902 25259 1658 1 3 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.842 -3.184 25259 1659 1 3 . 1 1 17 17 VAL N N 17 123.223 123.223 119.466 3.757 25259 1660 1 3 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.246 -0.112 25259 1661 1 3 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.426 -1.599 25259 1662 1 3 . 1 1 17 17 VAL CB C 17 30.377 30.377 33.732 -3.355 25259 1663 1 3 . 1 1 17 17 VAL H H 17 8.134 8.134 8.139 -0.005 25259 1664 1 3 . 1 1 18 18 ILE N N 18 127.777 127.777 123.575 4.202 25259 1665 1 3 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.105 0.138 25259 1666 1 3 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.860 -3.538 25259 1667 1 3 . 1 1 18 18 ILE CB C 18 36.254 36.254 38.202 -1.948 25259 1668 1 3 . 1 1 18 18 ILE H H 18 8.187 8.187 8.295 -0.108 25259 1669 1 3 . 1 1 19 19 GLU N N 19 128.148 128.148 127.516 0.632 25259 1670 1 3 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.488 -0.151 25259 1671 1 3 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.661 -1.570 25259 1672 1 3 . 1 1 19 19 GLU CB C 19 28.176 28.176 33.348 -5.172 25259 1673 1 3 . 1 1 19 19 GLU H H 19 8.475 8.475 8.649 -0.174 25259 1674 1 3 . 1 1 20 20 ASN N N 20 122.788 122.788 117.194 5.594 25259 1675 1 3 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.732 -0.037 25259 1676 1 3 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.958 -3.136 25259 1677 1 3 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.251 -3.885 25259 1678 1 3 . 1 1 20 20 ASN H H 20 8.477 8.477 8.655 -0.178 25259 1679 1 3 . 1 1 21 21 ALA N N 21 127.253 127.253 125.591 1.662 25259 1680 1 3 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.386 -0.065 25259 1681 1 3 . 1 1 21 21 ALA CA C 21 50.688 50.688 52.261 -1.573 25259 1682 1 3 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.258 -3.345 25259 1683 1 3 . 1 1 21 21 ALA H H 21 8.325 8.325 8.546 -0.221 25259 1684 1 3 . 1 1 22 22 GLU N N 22 122.044 122.044 120.033 2.011 25259 1685 1 3 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.214 0.079 25259 1686 1 3 . 1 1 22 22 GLU CA C 22 54.583 54.583 57.367 -2.784 25259 1687 1 3 . 1 1 22 22 GLU CB C 22 27.285 27.285 28.320 -1.036 25259 1688 1 3 . 1 1 22 22 GLU H H 22 8.415 8.415 8.552 -0.137 25259 1689 1 3 . 1 1 23 23 LYS N N 23 123.622 123.622 117.842 5.780 25259 1690 1 3 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.486 -0.161 25259 1691 1 3 . 1 1 23 23 LYS CA C 23 54.496 54.496 54.664 -0.168 25259 1692 1 3 . 1 1 23 23 LYS CB C 23 30.653 30.653 33.723 -3.070 25259 1693 1 3 . 1 1 23 23 LYS H H 23 8.127 8.127 7.726 0.401 25259 1694 1 3 . 1 1 24 24 ASN N N 24 120.652 120.652 121.536 -0.884 25259 1695 1 3 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.597 0.244 25259 1696 1 3 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.378 -2.715 25259 1697 1 3 . 1 1 24 24 ASN CB C 24 36.775 36.775 36.551 0.224 25259 1698 1 3 . 1 1 24 24 ASN H H 24 8.424 8.424 8.733 -0.309 25259 1699 1 3 . 1 1 25 25 THR N N 25 117.102 117.102 113.137 3.965 25259 1700 1 3 . 1 1 25 25 THR HA H 25 4.367 4.367 4.626 -0.259 25259 1701 1 3 . 1 1 25 25 THR CA C 25 59.500 59.500 60.466 -0.966 25259 1702 1 3 . 1 1 25 25 THR CB C 25 67.610 67.610 71.278 -3.667 25259 1703 1 3 . 1 1 25 25 THR H H 25 7.852 7.852 7.714 0.138 25259 1704 1 3 . 1 1 26 26 VAL N N 26 126.491 126.491 126.607 -0.116 25259 1705 1 3 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.137 0.030 25259 1706 1 3 . 1 1 26 26 VAL CA C 26 60.193 60.193 63.737 -3.544 25259 1707 1 3 . 1 1 26 26 VAL CB C 26 29.605 29.605 30.973 -1.368 25259 1708 1 3 . 1 1 26 26 VAL H H 26 8.080 8.080 8.583 -0.503 25259 1709 1 3 . 1 1 27 27 VAL N N 27 132.992 132.992 120.344 12.648 25259 1710 1 3 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.566 -0.485 25259 1711 1 3 . 1 1 27 27 VAL CA C 27 58.984 58.984 58.453 0.531 25259 1712 1 3 . 1 1 27 27 VAL CB C 27 31.540 31.540 34.050 -2.510 25259 1713 1 3 . 1 1 27 27 VAL H H 27 8.830 8.830 8.335 0.495 25259 1714 1 3 . 1 1 28 28 THR N N 28 123.576 123.576 115.860 7.716 25259 1715 1 3 . 1 1 28 28 THR HA H 28 5.553 5.553 4.729 0.824 25259 1716 1 3 . 1 1 28 28 THR CA C 28 58.738 58.738 62.245 -3.507 25259 1717 1 3 . 1 1 28 28 THR CB C 28 68.443 68.443 69.747 -1.304 25259 1718 1 3 . 1 1 28 28 THR H H 28 8.165 8.165 8.476 -0.311 25259 1719 1 3 . 1 1 29 29 LYS N N 29 129.099 129.099 127.789 1.310 25259 1720 1 3 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.490 0.452 25259 1721 1 3 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.822 -4.043 25259 1722 1 3 . 1 1 29 29 LYS CB C 29 35.096 35.096 33.598 1.498 25259 1723 1 3 . 1 1 29 29 LYS H H 29 9.273 9.273 8.949 0.324 25259 1724 1 3 . 1 1 30 30 THR N N 30 123.510 123.510 120.570 2.940 25259 1725 1 3 . 1 1 30 30 THR HA H 30 5.428 5.428 4.856 0.572 25259 1726 1 3 . 1 1 30 30 THR CA C 30 59.784 59.784 62.196 -2.412 25259 1727 1 3 . 1 1 30 30 THR CB C 30 67.818 67.818 69.459 -1.641 25259 1728 1 3 . 1 1 30 30 THR H H 30 8.993 8.993 8.717 0.276 25259 1729 1 3 . 1 1 31 31 LEU N N 31 128.293 128.293 129.590 -1.297 25259 1730 1 3 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.927 0.293 25259 1731 1 3 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.642 -3.587 25259 1732 1 3 . 1 1 31 31 LEU CB C 31 43.399 43.399 44.028 -0.629 25259 1733 1 3 . 1 1 31 31 LEU H H 31 9.557 9.557 9.187 0.370 25259 1734 1 3 . 1 1 32 32 VAL N N 32 126.919 126.919 126.230 0.689 25259 1735 1 3 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.044 0.407 25259 1736 1 3 . 1 1 32 32 VAL CA C 32 59.664 59.664 62.371 -2.707 25259 1737 1 3 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.684 -1.235 25259 1738 1 3 . 1 1 32 32 VAL H H 32 9.364 9.364 8.744 0.620 25259 1739 1 3 . 1 1 33 33 LEU N N 33 133.503 133.503 128.853 4.650 25259 1740 1 3 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.395 0.161 25259 1741 1 3 . 1 1 33 33 LEU CA C 33 52.004 52.004 53.843 -1.839 25259 1742 1 3 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.340 -4.493 25259 1743 1 3 . 1 1 33 33 LEU H H 33 8.587 8.587 7.844 0.743 25259 1744 1 3 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.454 0.027 25259 1745 1 3 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.227 -1.782 25259 1746 1 3 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.218 -2.653 25259 1747 1 3 . 1 1 35 35 LYS N N 35 127.420 127.420 120.296 7.124 25259 1748 1 3 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.235 0.131 25259 1749 1 3 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.430 -2.311 25259 1750 1 3 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.512 -1.918 25259 1751 1 3 . 1 1 35 35 LYS H H 35 8.666 8.666 8.406 0.260 25259 1752 1 3 . 1 1 36 36 SER N N 36 122.222 122.222 118.473 3.749 25259 1753 1 3 . 1 1 36 36 SER HA H 36 4.753 4.753 4.463 0.290 25259 1754 1 3 . 1 1 36 36 SER CA C 36 55.328 55.328 58.358 -3.030 25259 1755 1 3 . 1 1 36 36 SER CB C 36 61.728 61.728 63.882 -2.154 25259 1756 1 3 . 1 1 36 36 SER H H 36 8.771 8.771 8.548 0.223 25259 1757 1 3 . 1 1 37 37 ASP N N 37 126.346 126.346 119.355 6.991 25259 1758 1 3 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.860 -0.406 25259 1759 1 3 . 1 1 37 37 ASP CA C 37 54.616 54.616 55.065 -0.449 25259 1760 1 3 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.674 -2.689 25259 1761 1 3 . 1 1 37 37 ASP H H 37 8.859 8.859 8.615 0.244 25259 1762 1 3 . 1 1 38 38 ASP N N 38 119.171 119.171 118.393 0.778 25259 1763 1 3 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.749 -0.134 25259 1764 1 3 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.900 -4.112 25259 1765 1 3 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.784 -4.149 25259 1766 1 3 . 1 1 38 38 ASP H H 38 7.944 7.944 7.935 0.009 25259 1767 1 3 . 1 1 39 39 GLY N N 39 110.352 110.352 108.678 1.674 25259 1768 1 3 . 1 1 39 39 GLY CA C 39 42.761 42.761 44.735 -1.974 25259 1769 1 3 . 1 1 39 39 GLY H H 39 8.145 8.145 8.178 -0.033 25259 1770 1 3 . 1 1 40 40 SER N N 40 120.090 120.090 115.809 4.281 25259 1771 1 3 . 1 1 40 40 SER HA H 40 4.877 4.877 4.624 0.253 25259 1772 1 3 . 1 1 40 40 SER CA C 40 56.525 56.525 58.974 -2.449 25259 1773 1 3 . 1 1 40 40 SER CB C 40 62.245 62.245 64.797 -2.552 25259 1774 1 3 . 1 1 40 40 SER H H 40 8.344 8.344 7.832 0.512 25259 1775 1 3 . 1 1 41 41 GLN N N 41 122.551 122.551 122.155 0.396 25259 1776 1 3 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.559 0.368 25259 1777 1 3 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.362 -1.948 25259 1778 1 3 . 1 1 41 41 GLN CB C 41 30.314 30.314 32.577 -2.263 25259 1779 1 3 . 1 1 41 41 GLN H H 41 8.627 8.627 8.660 -0.033 25259 1780 1 3 . 1 1 42 42 GLN N N 42 131.724 131.724 123.274 8.450 25259 1781 1 3 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.703 0.908 25259 1782 1 3 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.449 -2.377 25259 1783 1 3 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.551 -2.232 25259 1784 1 3 . 1 1 42 42 GLN H H 42 9.189 9.189 8.629 0.560 25259 1785 1 3 . 1 1 43 43 THR N N 43 122.202 122.202 116.409 5.793 25259 1786 1 3 . 1 1 43 43 THR HA H 43 5.380 5.380 5.016 0.364 25259 1787 1 3 . 1 1 43 43 THR CA C 43 58.863 58.863 61.367 -2.503 25259 1788 1 3 . 1 1 43 43 THR CB C 43 68.893 68.893 72.371 -3.478 25259 1789 1 3 . 1 1 43 43 THR H H 43 9.139 9.139 8.375 0.764 25259 1790 1 3 . 1 1 44 44 GLN N N 44 127.190 127.190 120.642 6.548 25259 1791 1 3 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.358 0.276 25259 1792 1 3 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.148 -2.480 25259 1793 1 3 . 1 1 44 44 GLN CB C 44 28.910 28.910 33.623 -4.713 25259 1794 1 3 . 1 1 44 44 GLN H H 44 9.760 9.760 9.155 0.605 25259 1795 1 3 . 1 1 45 45 THR N N 45 123.479 123.479 117.018 6.461 25259 1796 1 3 . 1 1 45 45 THR HA H 45 5.421 5.421 5.453 -0.032 25259 1797 1 3 . 1 1 45 45 THR CA C 45 60.071 60.071 61.197 -1.126 25259 1798 1 3 . 1 1 45 45 THR CB C 45 67.541 67.541 71.149 -3.608 25259 1799 1 3 . 1 1 45 45 THR H H 45 9.518 9.518 9.156 0.362 25259 1800 1 3 . 1 1 46 46 ILE N N 46 133.908 133.908 127.934 5.974 25259 1801 1 3 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.741 0.262 25259 1802 1 3 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.697 -2.226 25259 1803 1 3 . 1 1 46 46 ILE CB C 46 39.945 39.945 40.433 -0.488 25259 1804 1 3 . 1 1 46 46 ILE H H 46 9.830 9.830 9.408 0.422 25259 1805 1 3 . 1 1 47 47 THR N N 47 124.701 124.701 124.974 -0.273 25259 1806 1 3 . 1 1 47 47 THR HA H 47 6.048 6.048 5.424 0.624 25259 1807 1 3 . 1 1 47 47 THR CA C 47 58.551 58.551 61.025 -2.474 25259 1808 1 3 . 1 1 47 47 THR CB C 47 67.819 67.819 69.796 -1.977 25259 1809 1 3 . 1 1 47 47 THR H H 47 8.843 8.843 8.772 0.071 25259 1810 1 3 . 1 1 48 48 TYR N N 48 127.369 127.369 121.961 5.408 25259 1811 1 3 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.093 0.185 25259 1812 1 3 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.413 -2.684 25259 1813 1 3 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.033 -1.601 25259 1814 1 3 . 1 1 48 48 TYR H H 48 9.638 9.638 7.786 1.852 25259 1815 1 3 . 1 1 49 49 LYS N N 49 122.138 122.138 116.550 5.588 25259 1816 1 3 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.752 -0.096 25259 1817 1 3 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.059 -3.087 25259 1818 1 3 . 1 1 49 49 LYS CB C 49 33.603 33.603 35.031 -1.428 25259 1819 1 3 . 1 1 49 49 LYS H H 49 8.560 8.560 8.688 -0.128 25259 1820 1 3 . 1 1 50 50 ASP N N 50 130.208 130.208 121.464 8.744 25259 1821 1 3 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.824 -0.520 25259 1822 1 3 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.997 -0.237 25259 1823 1 3 . 1 1 50 50 ASP CB C 50 37.339 37.339 43.727 -6.388 25259 1824 1 3 . 1 1 50 50 ASP H H 50 9.597 9.597 8.541 1.056 25259 1825 1 3 . 1 1 51 51 LYS N N 51 124.586 124.586 119.827 4.759 25259 1826 1 3 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.504 0.027 25259 1827 1 3 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.164 -2.430 25259 1828 1 3 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.374 -3.979 25259 1829 1 3 . 1 1 51 51 LYS H H 51 8.450 8.450 8.167 0.283 25259 1830 1 3 . 1 1 52 52 THR N N 52 120.044 120.044 114.336 5.708 25259 1831 1 3 . 1 1 52 52 THR HA H 52 4.717 4.717 4.512 0.205 25259 1832 1 3 . 1 1 52 52 THR CA C 52 59.313 59.313 61.447 -2.134 25259 1833 1 3 . 1 1 52 52 THR CB C 52 68.815 68.815 70.969 -2.154 25259 1834 1 3 . 1 1 52 52 THR H H 52 8.658 8.658 7.695 0.963 25259 1835 1 3 . 1 1 53 53 PHE N N 53 128.987 128.987 124.759 4.228 25259 1836 1 3 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.507 -0.224 25259 1837 1 3 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.964 -0.975 25259 1838 1 3 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.699 0.612 25259 1839 1 3 . 1 1 53 53 PHE H H 53 9.218 9.218 8.675 0.543 25259 1840 1 3 . 1 1 54 54 LEU N N 54 124.874 124.874 124.755 0.119 25259 1841 1 3 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.365 0.564 25259 1842 1 3 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.985 -2.744 25259 1843 1 3 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.782 -2.265 25259 1844 1 3 . 1 1 54 54 LEU H H 54 9.391 9.391 8.849 0.542 25259 1845 1 3 . 1 1 55 55 SER N N 55 115.516 115.516 109.352 6.164 25259 1846 1 3 . 1 1 55 55 SER HA H 55 5.194 5.194 5.520 -0.326 25259 1847 1 3 . 1 1 55 55 SER CA C 55 55.818 55.818 57.474 -1.656 25259 1848 1 3 . 1 1 55 55 SER CB C 55 63.474 63.474 66.728 -3.254 25259 1849 1 3 . 1 1 55 55 SER H H 55 8.736 8.736 7.975 0.761 25259 1850 1 3 . 1 1 56 56 LEU N N 56 124.352 124.352 122.563 1.789 25259 1851 1 3 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.434 0.109 25259 1852 1 3 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.516 -2.879 25259 1853 1 3 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.114 -0.601 25259 1854 1 3 . 1 1 56 56 LEU H H 56 8.328 8.328 8.733 -0.405 25259 1855 1 3 . 1 1 57 57 ALA N N 57 131.450 131.450 130.418 1.032 25259 1856 1 3 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.026 0.479 25259 1857 1 3 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.095 -1.893 25259 1858 1 3 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.173 -2.209 25259 1859 1 3 . 1 1 57 57 ALA H H 57 9.208 9.208 9.096 0.112 25259 1860 1 3 . 1 1 58 58 ILE N N 58 126.248 126.248 125.318 0.930 25259 1861 1 3 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.622 0.162 25259 1862 1 3 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.231 -1.984 25259 1863 1 3 . 1 1 58 58 ILE CB C 58 38.045 38.045 39.150 -1.105 25259 1864 1 3 . 1 1 58 58 ILE H H 58 9.597 9.597 9.143 0.454 25259 1865 1 3 . 1 1 59 59 GLN N N 59 132.065 132.065 127.466 4.599 25259 1866 1 3 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.361 0.886 25259 1867 1 3 . 1 1 59 59 GLN CA C 59 52.164 52.164 57.010 -4.846 25259 1868 1 3 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.013 -0.352 25259 1869 1 3 . 1 1 59 59 GLN H H 59 9.389 9.389 8.483 0.906 25259 1870 1 3 . 1 1 60 60 GLN N N 60 130.314 130.314 118.047 12.267 25259 1871 1 3 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.655 0.554 25259 1872 1 3 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.053 -3.032 25259 1873 1 3 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.722 -4.246 25259 1874 1 3 . 1 1 60 60 GLN H H 60 9.471 9.471 8.727 0.744 25259 1875 1 3 . 1 1 61 61 LYS N N 61 131.044 131.044 123.379 7.665 25259 1876 1 3 . 1 1 61 61 LYS HA H 61 5.415 5.415 4.862 0.553 25259 1877 1 3 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.845 -2.725 25259 1878 1 3 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.277 -3.860 25259 1879 1 3 . 1 1 61 61 LYS H H 61 8.893 8.893 8.579 0.314 25259 1880 1 3 . 1 1 62 62 ARG N N 62 125.397 125.397 123.373 2.024 25259 1881 1 3 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.017 -0.014 25259 1882 1 3 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.215 -2.124 25259 1883 1 3 . 1 1 62 62 ARG CB C 62 29.878 29.878 33.894 -4.016 25259 1884 1 3 . 1 1 62 62 ARG H H 62 9.120 9.120 8.269 0.851 25259 1885 1 3 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.634 0.341 25259 1886 1 3 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.452 -2.955 25259 1887 1 3 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.411 -2.527 25259 1888 1 3 . 1 1 64 64 VAL N N 64 121.305 121.305 115.021 6.284 25259 1889 1 3 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.580 -0.556 25259 1890 1 3 . 1 1 64 64 VAL CA C 64 59.677 59.677 60.647 -0.970 25259 1891 1 3 . 1 1 64 64 VAL CB C 64 30.365 30.365 34.516 -4.151 25259 1892 1 3 . 1 1 64 64 VAL H H 64 7.520 7.520 7.615 -0.095 25259 1893 1 3 . 1 1 65 65 SER N N 65 123.215 123.215 115.722 7.493 25259 1894 1 3 . 1 1 65 65 SER HA H 65 4.521 4.521 4.701 -0.180 25259 1895 1 3 . 1 1 65 65 SER CA C 65 54.897 54.897 58.869 -3.972 25259 1896 1 3 . 1 1 65 65 SER CB C 65 62.564 62.564 63.826 -1.262 25259 1897 1 3 . 1 1 65 65 SER H H 65 8.080 8.080 8.754 -0.674 25259 1898 1 3 . 1 1 66 66 ASP N N 66 123.802 123.802 121.096 2.706 25259 1899 1 3 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.715 -0.286 25259 1900 1 3 . 1 1 66 66 ASP CA C 66 55.378 55.378 55.003 0.375 25259 1901 1 3 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.190 -3.152 25259 1902 1 3 . 1 1 66 66 ASP H H 66 8.900 8.900 8.110 0.790 25259 1903 1 3 . 1 1 67 67 GLU N N 67 121.943 121.943 120.893 1.050 25259 1904 1 3 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.094 0.095 25259 1905 1 3 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.089 -1.649 25259 1906 1 3 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.533 -2.748 25259 1907 1 3 . 1 1 67 67 GLU H H 67 8.717 8.717 8.418 0.299 25259 1908 1 3 . 1 1 68 68 LEU N N 68 125.458 125.458 121.197 4.261 25259 1909 1 3 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.297 0.046 25259 1910 1 3 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.336 -2.864 25259 1911 1 3 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.643 -2.239 25259 1912 1 3 . 1 1 68 68 LEU H H 68 7.820 7.820 7.926 -0.106 25259 1913 1 3 . 1 1 69 69 LYS N N 69 123.868 123.868 117.629 6.239 25259 1914 1 3 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.097 -0.091 25259 1915 1 3 . 1 1 69 69 LYS CA C 69 57.617 57.617 58.731 -1.114 25259 1916 1 3 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.621 -1.584 25259 1917 1 3 . 1 1 69 69 LYS H H 69 8.690 8.690 8.585 0.105 25259 1918 1 3 . 1 1 70 70 THR N N 70 117.109 117.109 115.270 1.839 25259 1919 1 3 . 1 1 70 70 THR HA H 70 4.088 4.088 4.237 -0.149 25259 1920 1 3 . 1 1 70 70 THR CA C 70 63.879 63.879 66.073 -2.194 25259 1921 1 3 . 1 1 70 70 THR CB C 70 66.383 66.383 69.201 -2.818 25259 1922 1 3 . 1 1 70 70 THR H H 70 7.935 7.935 7.702 0.233 25259 1923 1 3 . 1 1 71 71 TYR N N 71 127.006 127.006 123.531 3.475 25259 1924 1 3 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.234 -0.029 25259 1925 1 3 . 1 1 71 71 TYR CA C 71 60.225 60.225 62.044 -1.819 25259 1926 1 3 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.303 -1.758 25259 1927 1 3 . 1 1 71 71 TYR H H 71 7.683 7.683 7.567 0.116 25259 1928 1 3 . 1 1 72 72 ILE N N 72 125.064 125.064 118.421 6.643 25259 1929 1 3 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.859 -0.180 25259 1930 1 3 . 1 1 72 72 ILE CA C 72 62.895 62.895 64.632 -1.737 25259 1931 1 3 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.671 -1.395 25259 1932 1 3 . 1 1 72 72 ILE H H 72 9.083 9.083 8.657 0.426 25259 1933 1 3 . 1 1 73 73 ASP N N 73 124.900 124.900 120.057 4.843 25259 1934 1 3 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.544 -0.155 25259 1935 1 3 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.663 -1.625 25259 1936 1 3 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.926 -2.819 25259 1937 1 3 . 1 1 73 73 ASP H H 73 8.751 8.751 7.695 1.056 25259 1938 1 3 . 1 1 74 74 GLN N N 74 117.025 117.025 117.194 -0.169 25259 1939 1 3 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.025 0.113 25259 1940 1 3 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.847 -3.037 25259 1941 1 3 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.320 -1.756 25259 1942 1 3 . 1 1 74 74 GLN H H 74 7.447 7.447 8.103 -0.656 25259 1943 1 3 . 1 1 75 75 HIS N N 75 116.494 116.494 114.196 2.298 25259 1944 1 3 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.582 0.134 25259 1945 1 3 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.179 -2.113 25259 1946 1 3 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.539 -5.237 25259 1947 1 3 . 1 1 75 75 HIS H H 75 8.402 8.402 8.046 0.356 25259 1948 1 3 . 1 1 76 76 GLY N N 76 112.564 112.564 106.044 6.520 25259 1949 1 3 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.846 -2.950 25259 1950 1 3 . 1 1 76 76 GLY H H 76 9.091 9.091 7.712 1.379 25259 1951 1 3 . 1 1 77 77 VAL N N 77 124.763 124.763 121.487 3.276 25259 1952 1 3 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.726 -0.161 25259 1953 1 3 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.100 -0.149 25259 1954 1 3 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.050 -2.212 25259 1955 1 3 . 1 1 77 77 VAL H H 77 8.927 8.927 8.826 0.101 25259 1956 1 3 . 1 1 78 78 GLU N N 78 124.388 124.388 118.832 5.556 25259 1957 1 3 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.019 0.129 25259 1958 1 3 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.827 -1.511 25259 1959 1 3 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.781 -2.322 25259 1960 1 3 . 1 1 78 78 GLU H H 78 8.781 8.781 8.539 0.242 25259 1961 1 3 . 1 1 79 79 GLU N N 79 121.887 121.887 118.065 3.822 25259 1962 1 3 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.142 0.046 25259 1963 1 3 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.971 -2.426 25259 1964 1 3 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.120 -2.087 25259 1965 1 3 . 1 1 79 79 GLU H H 79 9.231 9.231 8.287 0.944 25259 1966 1 3 . 1 1 80 80 THR N N 80 120.781 120.781 116.629 4.152 25259 1967 1 3 . 1 1 80 80 THR HA H 80 4.059 4.059 3.768 0.291 25259 1968 1 3 . 1 1 80 80 THR CA C 80 65.487 65.487 66.121 -0.634 25259 1969 1 3 . 1 1 80 80 THR CB C 80 64.369 64.369 68.583 -4.214 25259 1970 1 3 . 1 1 80 80 THR H H 80 7.858 7.858 7.929 -0.071 25259 1971 1 3 . 1 1 81 81 GLN N N 81 125.303 125.303 121.020 4.283 25259 1972 1 3 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.913 0.131 25259 1973 1 3 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.320 -2.351 25259 1974 1 3 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.456 -2.380 25259 1975 1 3 . 1 1 81 81 GLN H H 81 8.765 8.765 7.595 1.171 25259 1976 1 3 . 1 1 82 82 LYS N N 82 120.458 120.458 118.865 1.593 25259 1977 1 3 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.866 0.223 25259 1978 1 3 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.812 -1.500 25259 1979 1 3 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.757 -1.603 25259 1980 1 3 . 1 1 82 82 LYS H H 82 7.521 7.521 7.475 0.046 25259 1981 1 3 . 1 1 83 83 ALA N N 83 125.234 125.234 120.544 4.690 25259 1982 1 3 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.769 0.448 25259 1983 1 3 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.757 -2.315 25259 1984 1 3 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.330 -2.043 25259 1985 1 3 . 1 1 83 83 ALA H H 83 7.782 7.782 7.673 0.109 25259 1986 1 3 . 1 1 84 84 LEU N N 84 123.348 123.348 118.518 4.830 25259 1987 1 3 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.865 0.193 25259 1988 1 3 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.210 -1.711 25259 1989 1 3 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.377 -2.069 25259 1990 1 3 . 1 1 84 84 LEU H H 84 8.590 8.590 7.239 1.351 25259 1991 1 3 . 1 1 85 85 LEU N N 85 122.872 122.872 119.157 3.715 25259 1992 1 3 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.920 0.250 25259 1993 1 3 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.299 -1.903 25259 1994 1 3 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.399 -1.658 25259 1995 1 3 . 1 1 85 85 LEU H H 85 7.892 7.892 7.710 0.182 25259 1996 1 3 . 1 1 86 86 GLU N N 86 122.713 122.713 118.646 4.067 25259 1997 1 3 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.824 0.261 25259 1998 1 3 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.510 -2.765 25259 1999 1 3 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.626 -2.723 25259 2000 1 3 . 1 1 86 86 GLU H H 86 8.124 8.124 8.301 -0.177 25259 2001 1 3 . 1 1 87 87 ALA N N 87 123.163 123.163 120.763 2.400 25259 2002 1 3 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.047 0.094 25259 2003 1 3 . 1 1 87 87 ALA CA C 87 52.268 52.268 55.372 -3.104 25259 2004 1 3 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.161 -2.529 25259 2005 1 3 . 1 1 87 87 ALA H H 87 7.765 7.765 7.577 0.188 25259 2006 1 3 . 1 1 88 88 GLU N N 88 121.945 121.945 116.538 5.407 25259 2007 1 3 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.107 -0.023 25259 2008 1 3 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.592 -1.657 25259 2009 1 3 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.014 -0.987 25259 2010 1 3 . 1 1 88 88 GLU H H 88 7.846 7.846 7.955 -0.109 25259 2011 1 3 . 1 1 89 89 GLU N N 89 117.978 117.978 119.074 -1.096 25259 2012 1 3 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.062 0.031 25259 2013 1 3 . 1 1 89 89 GLU CA C 89 55.214 55.214 59.361 -4.147 25259 2014 1 3 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.234 -1.827 25259 2015 1 3 . 1 1 89 89 GLU H H 89 7.634 7.634 7.577 0.057 25259 2016 1 3 . 1 1 90 90 LYS N N 90 117.519 117.519 117.762 -0.243 25259 2017 1 3 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.341 0.090 25259 2018 1 3 . 1 1 90 90 LYS CA C 90 53.018 53.018 56.059 -3.041 25259 2019 1 3 . 1 1 90 90 LYS CB C 90 31.031 31.031 33.148 -2.118 25259 2020 1 3 . 1 1 90 90 LYS H H 90 7.247 7.247 7.412 -0.165 25259 2021 1 3 . 1 1 91 91 ASP N N 91 124.888 124.888 123.674 1.214 25259 2022 1 3 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.526 0.157 25259 2023 1 3 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.712 -3.513 25259 2024 1 3 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.335 -2.754 25259 2025 1 3 . 1 1 91 91 ASP H H 91 7.370 7.370 8.055 -0.685 25259 2026 1 3 . 1 1 92 92 LYS N N 92 129.311 129.311 126.786 2.525 25259 2027 1 3 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.961 0.052 25259 2028 1 3 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.102 -1.886 25259 2029 1 3 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.236 -2.221 25259 2030 1 3 . 1 1 92 92 LYS H H 92 8.795 8.795 8.648 0.147 25259 2031 1 3 . 1 1 93 93 SER N N 93 118.112 118.112 116.739 1.373 25259 2032 1 3 . 1 1 93 93 SER HA H 93 4.439 4.439 4.073 0.366 25259 2033 1 3 . 1 1 93 93 SER CA C 93 58.945 58.945 60.709 -1.764 25259 2034 1 3 . 1 1 93 93 SER CB C 93 60.278 60.278 63.192 -2.914 25259 2035 1 3 . 1 1 93 93 SER H H 93 8.488 8.488 7.942 0.546 25259 2036 1 3 . 1 1 94 94 ILE N N 94 128.950 128.950 123.015 5.935 25259 2037 1 3 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.408 0.074 25259 2038 1 3 . 1 1 94 94 ILE CA C 94 62.349 62.349 65.250 -2.901 25259 2039 1 3 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.736 -2.983 25259 2040 1 3 . 1 1 94 94 ILE H H 94 7.722 7.722 8.336 -0.614 25259 2041 1 3 . 1 1 95 95 ILE N N 95 123.598 123.598 119.721 3.877 25259 2042 1 3 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.524 0.071 25259 2043 1 3 . 1 1 95 95 ILE CA C 95 62.747 62.747 66.129 -3.382 25259 2044 1 3 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.377 -1.405 25259 2045 1 3 . 1 1 95 95 ILE H H 95 8.378 8.378 8.336 0.042 25259 2046 1 3 . 1 1 96 96 GLU N N 96 118.317 118.317 118.806 -0.489 25259 2047 1 3 . 1 1 96 96 GLU HA H 96 3.984 3.984 4.014 -0.030 25259 2048 1 3 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.320 -2.825 25259 2049 1 3 . 1 1 96 96 GLU CB C 96 27.173 27.173 28.868 -1.695 25259 2050 1 3 . 1 1 96 96 GLU H H 96 7.680 7.680 7.888 -0.208 25259 2051 1 3 . 1 1 97 97 ALA N N 97 124.797 124.797 121.853 2.944 25259 2052 1 3 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.893 -0.068 25259 2053 1 3 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.541 -2.244 25259 2054 1 3 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.688 -2.699 25259 2055 1 3 . 1 1 97 97 ALA H H 97 7.383 7.383 7.687 -0.304 25259 2056 1 3 . 1 1 98 98 ARG N N 98 115.469 115.469 114.989 0.480 25259 2057 1 3 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.308 -0.002 25259 2058 1 3 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.125 -0.635 25259 2059 1 3 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.915 -1.677 25259 2060 1 3 . 1 1 98 98 ARG H H 98 8.229 8.229 7.463 0.766 25259 2061 1 3 . 1 1 99 99 LYS N N 99 120.219 120.219 118.023 2.196 25259 2062 1 3 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.105 0.153 25259 2063 1 3 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.490 -2.249 25259 2064 1 3 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.303 -1.807 25259 2065 1 3 . 1 1 99 99 LYS H H 99 7.270 7.270 7.376 -0.106 25259 2066 1 3 . 1 1 100 100 LEU N N 100 123.800 123.800 119.980 3.820 25259 2067 1 3 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.610 -0.269 25259 2068 1 3 . 1 1 100 100 LEU CA C 100 52.079 52.079 53.634 -1.555 25259 2069 1 3 . 1 1 100 100 LEU CB C 100 39.131 39.131 43.169 -4.038 25259 2070 1 3 . 1 1 100 100 LEU H H 100 7.837 7.837 7.647 0.190 25259 2071 1 3 . 1 1 101 101 ALA N N 101 130.512 130.512 125.087 5.425 25259 2072 1 3 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.451 -0.075 25259 2073 1 3 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.889 -2.486 25259 2074 1 3 . 1 1 101 101 ALA CB C 101 15.796 15.796 19.019 -3.223 25259 2075 1 3 . 1 1 101 101 ALA H H 101 8.213 8.213 8.894 -0.681 25259 2076 1 3 . 1 1 102 102 GLY N N 102 110.659 110.659 104.626 6.033 25259 2077 1 3 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.945 -1.052 25259 2078 1 3 . 1 1 102 102 GLY H H 102 8.738 8.738 8.373 0.365 25259 2079 1 3 . 1 1 103 103 PHE N N 103 123.097 123.097 121.793 1.304 25259 2080 1 3 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.339 -0.119 25259 2081 1 3 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.753 -2.985 25259 2082 1 3 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.486 -1.912 25259 2083 1 3 . 1 1 103 103 PHE H H 103 7.514 7.514 7.545 -0.031 25259 2084 1 3 . 1 1 104 104 LYS N N 104 130.652 130.652 125.769 4.883 25259 2085 1 3 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.379 -0.259 25259 2086 1 3 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.629 -1.650 25259 2087 1 3 . 1 1 104 104 LYS CB C 104 34.237 34.237 37.000 -2.763 25259 2088 1 3 . 1 1 104 104 LYS H H 104 7.473 7.473 7.997 -0.524 25259 2089 1 3 . 1 1 105 105 LEU N N 105 127.372 127.372 122.718 4.654 25259 2090 1 3 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.701 0.295 25259 2091 1 3 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.079 -2.343 25259 2092 1 3 . 1 1 105 105 LEU CB C 105 43.964 43.964 44.605 -0.641 25259 2093 1 3 . 1 1 105 105 LEU H H 105 8.393 8.393 8.252 0.141 25259 2094 1 3 . 1 1 106 106 GLU N N 106 129.358 129.358 126.260 3.098 25259 2095 1 3 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.760 0.084 25259 2096 1 3 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.756 -1.966 25259 2097 1 3 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.087 -1.459 25259 2098 1 3 . 1 1 106 106 GLU H H 106 8.849 8.849 8.878 -0.029 25259 2099 1 3 . 1 1 107 107 THR N N 107 131.118 131.118 115.530 15.588 25259 2100 1 3 . 1 1 107 107 THR HA H 107 5.110 5.110 4.967 0.143 25259 2101 1 3 . 1 1 107 107 THR CA C 107 59.832 59.832 60.762 -0.930 25259 2102 1 3 . 1 1 107 107 THR CB C 107 66.671 66.671 71.395 -4.724 25259 2103 1 3 . 1 1 107 107 THR H H 107 9.433 9.433 8.318 1.115 25259 2104 1 3 . 1 1 108 108 LYS N N 108 129.114 129.114 123.163 5.951 25259 2105 1 3 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.580 0.244 25259 2106 1 3 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.529 -3.334 25259 2107 1 3 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.992 -1.604 25259 2108 1 3 . 1 1 108 108 LYS H H 108 9.410 9.410 9.061 0.349 25259 2109 1 3 . 1 1 109 109 LEU N N 109 129.323 129.323 126.014 3.309 25259 2110 1 3 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.464 0.240 25259 2111 1 3 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.973 -2.865 25259 2112 1 3 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.656 -3.001 25259 2113 1 3 . 1 1 109 109 LEU H H 109 8.862 8.862 8.679 0.183 25259 2114 1 3 . 1 1 110 110 LEU N N 110 129.123 129.123 127.692 1.431 25259 2115 1 3 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.380 -0.157 25259 2116 1 3 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.134 -2.352 25259 2117 1 3 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.868 -2.207 25259 2118 1 3 . 1 1 110 110 LEU H H 110 8.373 8.373 8.995 -0.622 25259 2119 1 3 . 1 1 111 111 SER N N 111 114.587 114.587 112.579 2.008 25259 2120 1 3 . 1 1 111 111 SER HA H 111 4.557 4.557 4.636 -0.079 25259 2121 1 3 . 1 1 111 111 SER CA C 111 53.889 53.889 57.480 -3.591 25259 2122 1 3 . 1 1 111 111 SER CB C 111 61.830 61.830 65.091 -3.261 25259 2123 1 3 . 1 1 111 111 SER H H 111 8.400 8.400 7.756 0.644 25259 2124 1 3 . 1 1 112 112 ALA N N 112 118.269 118.269 122.602 -4.333 25259 2125 1 3 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.322 -0.013 25259 2126 1 3 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.279 -3.065 25259 2127 1 3 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.419 -1.831 25259 2128 1 3 . 1 1 112 112 ALA H H 112 8.556 8.556 8.635 -0.079 25259 2129 1 3 . 1 1 113 113 THR N N 113 102.878 102.878 102.285 0.593 25259 2130 1 3 . 1 1 113 113 THR HA H 113 4.662 4.662 4.419 0.243 25259 2131 1 3 . 1 1 113 113 THR CA C 113 58.689 58.689 61.670 -2.981 25259 2132 1 3 . 1 1 113 113 THR CB C 113 67.905 67.905 70.551 -2.646 25259 2133 1 3 . 1 1 113 113 THR H H 113 8.065 8.065 7.656 0.409 25259 2134 1 3 . 1 1 114 114 GLU N N 114 126.514 126.514 120.851 5.663 25259 2135 1 3 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.775 0.239 25259 2136 1 3 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.092 -2.085 25259 2137 1 3 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.028 -1.115 25259 2138 1 3 . 1 1 114 114 GLU H H 114 7.357 7.357 7.546 -0.189 25259 2139 1 3 . 1 1 115 115 LEU N N 115 128.058 128.058 121.059 6.999 25259 2140 1 3 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.212 -0.290 25259 2141 1 3 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.596 -1.272 25259 2142 1 3 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.941 -1.802 25259 2143 1 3 . 1 1 115 115 LEU H H 115 8.930 8.930 8.044 0.886 25259 2144 1 3 . 1 1 116 116 GLN N N 116 126.540 126.540 118.316 8.224 25259 2145 1 3 . 1 1 116 116 GLN HA H 116 5.715 5.715 4.980 0.735 25259 2146 1 3 . 1 1 116 116 GLN CA C 116 51.700 51.700 55.045 -3.345 25259 2147 1 3 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.734 -1.442 25259 2148 1 3 . 1 1 116 116 GLN H H 116 9.221 9.221 9.040 0.181 25259 2149 1 3 . 1 1 117 117 THR N N 117 125.213 125.213 120.003 5.210 25259 2150 1 3 . 1 1 117 117 THR HA H 117 5.353 5.353 5.194 0.159 25259 2151 1 3 . 1 1 117 117 THR CA C 117 58.926 58.926 61.714 -2.788 25259 2152 1 3 . 1 1 117 117 THR CB C 117 68.948 68.948 72.657 -3.709 25259 2153 1 3 . 1 1 117 117 THR H H 117 9.030 9.030 8.947 0.083 25259 2154 1 3 . 1 1 118 118 THR N N 118 127.799 127.799 119.976 7.823 25259 2155 1 3 . 1 1 118 118 THR HA H 118 5.527 5.527 4.920 0.607 25259 2156 1 3 . 1 1 118 118 THR CA C 118 59.201 59.201 61.712 -2.511 25259 2157 1 3 . 1 1 118 118 THR CB C 118 67.721 67.721 70.974 -3.253 25259 2158 1 3 . 1 1 118 118 THR H H 118 9.459 9.459 8.913 0.546 25259 2159 1 3 . 1 1 119 119 THR N N 119 129.258 129.258 124.104 5.154 25259 2160 1 3 . 1 1 119 119 THR HA H 119 4.885 4.885 4.472 0.413 25259 2161 1 3 . 1 1 119 119 THR CA C 119 58.463 58.463 62.070 -3.607 25259 2162 1 3 . 1 1 119 119 THR CB C 119 67.459 67.459 69.065 -1.606 25259 2163 1 3 . 1 1 119 119 THR H H 119 9.147 9.147 8.792 0.355 25259 2164 1 3 . 1 1 120 120 SER N N 120 123.389 123.389 122.075 1.314 25259 2165 1 3 . 1 1 120 120 SER HA H 120 5.328 5.328 4.776 0.552 25259 2166 1 3 . 1 1 120 120 SER CA C 120 54.386 54.386 57.231 -2.845 25259 2167 1 3 . 1 1 120 120 SER CB C 120 63.031 63.031 65.019 -1.988 25259 2168 1 3 . 1 1 120 120 SER H H 120 8.786 8.786 8.335 0.451 25259 2169 1 3 . 1 1 121 121 PHE N N 121 121.245 121.245 123.999 -2.754 25259 2170 1 3 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.798 0.314 25259 2171 1 3 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.023 -2.831 25259 2172 1 3 . 1 1 121 121 PHE CB C 121 40.265 40.265 39.535 0.730 25259 2173 1 3 . 1 1 121 121 PHE H H 121 8.831 8.831 9.049 -0.218 25259 2174 1 3 . 1 1 122 122 ASP N N 122 124.765 124.765 126.717 -1.952 25259 2175 1 3 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.821 0.019 25259 2176 1 3 . 1 1 122 122 ASP CA C 122 49.837 49.837 54.303 -4.465 25259 2177 1 3 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.510 -2.025 25259 2178 1 3 . 1 1 122 122 ASP H H 122 8.819 8.819 8.611 0.208 25259 2179 1 3 . 1 1 123 123 PHE N N 123 124.303 124.303 122.390 1.913 25259 2180 1 3 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.109 0.565 25259 2181 1 3 . 1 1 123 123 PHE CA C 123 57.798 57.798 61.156 -3.358 25259 2182 1 3 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.842 -3.301 25259 2183 1 3 . 1 1 123 123 PHE H H 123 8.262 8.262 8.035 0.227 25259 2184 1 3 . 1 1 124 124 GLN N N 124 120.792 120.792 117.215 3.577 25259 2185 1 3 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.124 0.310 25259 2186 1 3 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.463 -2.380 25259 2187 1 3 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.900 -1.771 25259 2188 1 3 . 1 1 124 124 GLN H H 124 8.954 8.954 7.793 1.161 25259 2189 1 3 . 1 1 125 125 VAL N N 125 114.091 114.091 117.154 -3.063 25259 2190 1 3 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.129 0.280 25259 2191 1 3 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.069 -2.772 25259 2192 1 3 . 1 1 125 125 VAL CB C 125 32.572 32.572 32.759 -0.187 25259 2193 1 3 . 1 1 125 125 VAL H H 125 7.026 7.026 7.670 -0.644 25259 2194 1 3 . 1 1 126 126 LEU N N 126 125.158 125.158 122.313 2.845 25259 2195 1 3 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.342 0.133 25259 2196 1 3 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.027 -1.852 25259 2197 1 3 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.524 -0.470 25259 2198 1 3 . 1 1 126 126 LEU H H 126 8.106 8.106 7.587 0.519 25259 2199 1 3 . 1 1 127 127 ASP N N 127 130.026 130.026 129.641 0.385 25259 2200 1 3 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.631 0.210 25259 2201 1 3 . 1 1 127 127 ASP CA C 127 50.198 50.198 54.929 -4.731 25259 2202 1 3 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.819 -2.130 25259 2203 1 3 . 1 1 127 127 ASP H H 127 9.129 9.129 8.926 0.203 25259 2204 1 3 . 1 1 128 128 VAL N N 128 128.833 128.833 123.588 5.245 25259 2205 1 3 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.577 -0.053 25259 2206 1 3 . 1 1 128 128 VAL CA C 128 63.668 63.668 67.178 -3.510 25259 2207 1 3 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.755 -2.260 25259 2208 1 3 . 1 1 128 128 VAL H H 128 8.288 8.288 8.090 0.198 25259 2209 1 3 . 1 1 129 129 LYS N N 129 123.914 123.914 117.502 6.412 25259 2210 1 3 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.954 0.089 25259 2211 1 3 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.893 -2.104 25259 2212 1 3 . 1 1 129 129 LYS CB C 129 28.937 28.937 32.057 -3.120 25259 2213 1 3 . 1 1 129 129 LYS H H 129 8.226 8.226 8.354 -0.128 25259 2214 1 3 . 1 1 130 130 LYS N N 130 121.888 121.888 116.611 5.277 25259 2215 1 3 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.226 -0.141 25259 2216 1 3 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.121 -0.975 25259 2217 1 3 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.747 -2.407 25259 2218 1 3 . 1 1 130 130 LYS H H 130 7.590 7.590 7.526 0.064 25259 2219 1 3 . 1 1 131 131 ALA N N 131 123.088 123.088 122.896 0.192 25259 2220 1 3 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.028 -0.101 25259 2221 1 3 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.185 -2.784 25259 2222 1 3 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.938 -2.491 25259 2223 1 3 . 1 1 131 131 ALA H H 131 8.506 8.506 8.396 0.110 25259 2224 1 3 . 1 1 132 132 SER N N 132 110.456 110.456 113.339 -2.883 25259 2225 1 3 . 1 1 132 132 SER HA H 132 4.117 4.117 4.013 0.104 25259 2226 1 3 . 1 1 132 132 SER CA C 132 58.289 58.289 61.175 -2.886 25259 2227 1 3 . 1 1 132 132 SER CB C 132 61.034 61.034 63.037 -2.003 25259 2228 1 3 . 1 1 132 132 SER H H 132 7.986 7.986 8.388 -0.402 25259 2229 1 3 . 1 1 133 133 GLN N N 133 119.034 119.034 118.141 0.893 25259 2230 1 3 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.205 0.197 25259 2231 1 3 . 1 1 133 133 GLN CA C 133 52.525 52.525 55.767 -3.242 25259 2232 1 3 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.430 -1.196 25259 2233 1 3 . 1 1 133 133 GLN H H 133 7.233 7.233 8.096 -0.863 25259 2234 1 3 . 1 1 134 134 LEU N N 134 123.291 123.291 121.893 1.398 25259 2235 1 3 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.252 0.141 25259 2236 1 3 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.659 -1.343 25259 2237 1 3 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.051 -3.204 25259 2238 1 3 . 1 1 134 134 LEU H H 134 7.411 7.411 7.588 -0.177 25259 2239 1 3 . 1 1 135 135 GLU N N 135 128.446 128.446 125.762 2.684 25259 2240 1 3 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.931 0.015 25259 2241 1 3 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.135 -1.751 25259 2242 1 3 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.777 -2.481 25259 2243 1 3 . 1 1 135 135 GLU H H 135 8.986 8.986 9.074 -0.088 25259 2244 1 3 . 1 1 136 136 HIS N N 136 117.593 117.593 112.998 4.595 25259 2245 1 3 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.450 -0.067 25259 2246 1 3 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.052 -1.367 25259 2247 1 3 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.432 -1.019 25259 2248 1 3 . 1 1 136 136 HIS H H 136 9.226 9.226 8.217 1.009 25259 2249 1 3 . 1 1 137 137 LEU N N 137 115.463 115.463 118.726 -3.263 25259 2250 1 3 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.595 -0.088 25259 2251 1 3 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.938 -2.990 25259 2252 1 3 . 1 1 137 137 LEU CB C 137 39.807 39.807 43.209 -3.402 25259 2253 1 3 . 1 1 137 137 LEU H H 137 7.090 7.090 7.971 -0.881 25259 2254 1 3 . 1 1 138 138 LYS N N 138 124.686 124.686 122.239 2.447 25259 2255 1 3 . 1 1 138 138 LYS HA H 138 4.169 4.169 3.863 0.306 25259 2256 1 3 . 1 1 138 138 LYS CA C 138 57.158 57.158 59.814 -2.656 25259 2257 1 3 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.251 -2.163 25259 2258 1 3 . 1 1 138 138 LYS H H 138 7.698 7.698 8.183 -0.485 25259 2259 1 3 . 1 1 139 139 ASN N N 139 118.077 118.077 116.419 1.658 25259 2260 1 3 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.606 0.067 25259 2261 1 3 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.825 -3.043 25259 2262 1 3 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.302 -2.485 25259 2263 1 3 . 1 1 139 139 ASN H H 139 8.485 8.485 8.460 0.025 25259 2264 1 3 . 1 1 140 140 ILE N N 140 120.880 120.880 118.374 2.506 25259 2265 1 3 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.191 -0.161 25259 2266 1 3 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.416 -1.850 25259 2267 1 3 . 1 1 140 140 ILE CB C 140 35.774 35.774 37.305 -1.531 25259 2268 1 3 . 1 1 140 140 ILE H H 140 7.549 7.549 7.430 0.119 25259 2269 1 3 . 1 1 141 141 GLY N N 141 110.676 110.676 109.167 1.509 25259 2270 1 3 . 1 1 141 141 GLY CA C 141 44.664 44.664 45.855 -1.191 25259 2271 1 3 . 1 1 141 141 GLY H H 141 7.663 7.663 7.576 0.087 25259 2272 1 3 . 1 1 142 142 LEU N N 142 123.857 123.857 120.178 3.679 25259 2273 1 3 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.803 -0.110 25259 2274 1 3 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.986 -2.792 25259 2275 1 3 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.388 -0.779 25259 2276 1 3 . 1 1 142 142 LEU H H 142 8.496 8.496 7.862 0.634 25259 2277 1 3 . 1 1 143 143 GLU N N 143 118.407 118.407 118.275 0.132 25259 2278 1 3 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.978 -0.192 25259 2279 1 3 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.965 -1.743 25259 2280 1 3 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.988 -2.475 25259 2281 1 3 . 1 1 143 143 GLU H H 143 8.672 8.672 8.488 0.184 25259 2282 1 3 . 1 1 144 144 ASN N N 144 118.477 118.477 117.970 0.507 25259 2283 1 3 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.447 -0.005 25259 2284 1 3 . 1 1 144 144 ASN CA C 144 52.712 52.712 55.321 -2.609 25259 2285 1 3 . 1 1 144 144 ASN CB C 144 35.955 35.955 37.870 -1.915 25259 2286 1 3 . 1 1 144 144 ASN H H 144 7.656 7.656 7.834 -0.178 25259 2287 1 3 . 1 1 145 145 LEU N N 145 125.354 125.354 122.091 3.263 25259 2288 1 3 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.718 0.079 25259 2289 1 3 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.659 -1.336 25259 2290 1 3 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.934 -2.361 25259 2291 1 3 . 1 1 145 145 LEU H H 145 7.758 7.758 8.113 -0.355 25259 2292 1 3 . 1 1 146 146 LEU N N 146 116.372 116.372 116.304 0.068 25259 2293 1 3 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.893 -0.017 25259 2294 1 3 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.627 -2.384 25259 2295 1 3 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.218 -2.321 25259 2296 1 3 . 1 1 146 146 LEU H H 146 7.242 7.242 7.140 0.102 25259 2297 1 3 . 1 1 147 147 LYS N N 147 120.054 120.054 119.263 0.791 25259 2298 1 3 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.536 -0.224 25259 2299 1 3 . 1 1 147 147 LYS CA C 147 54.623 54.623 54.994 -0.371 25259 2300 1 3 . 1 1 147 147 LYS CB C 147 30.260 30.260 31.521 -1.261 25259 2301 1 3 . 1 1 147 147 LYS H H 147 7.185 7.185 7.401 -0.216 25259 2302 1 3 . 1 1 148 148 ASN N N 148 119.498 119.498 117.150 2.348 25259 2303 1 3 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.788 0.174 25259 2304 1 3 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.410 -2.636 25259 2305 1 3 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.300 -0.814 25259 2306 1 3 . 1 1 148 148 ASN H H 148 7.698 7.698 7.647 0.051 25259 2307 1 3 . 1 1 149 149 GLU N N 149 122.834 122.834 117.868 4.966 25259 2308 1 3 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.495 0.106 25259 2309 1 3 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.038 -1.819 25259 2310 1 3 . 1 1 149 149 GLU CB C 149 26.810 26.810 28.816 -2.006 25259 2311 1 3 . 1 1 149 149 GLU H H 149 8.767 8.767 8.705 0.062 25259 2312 1 3 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.701 0.906 25259 2313 1 3 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.073 -0.831 25259 2314 1 3 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.188 -3.093 25259 2315 1 3 . 1 1 151 151 SER N N 151 112.839 112.839 110.975 1.864 25259 2316 1 3 . 1 1 151 151 SER HA H 151 3.835 3.835 4.502 -0.667 25259 2317 1 3 . 1 1 151 151 SER CA C 151 59.270 59.270 57.546 1.724 25259 2318 1 3 . 1 1 151 151 SER CB C 151 59.451 59.451 63.234 -3.783 25259 2319 1 3 . 1 1 151 151 SER H H 151 8.519 8.519 7.570 0.949 25259 2320 1 3 . 1 1 152 152 LYS N N 152 126.710 126.710 123.731 2.979 25259 2321 1 3 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.087 0.161 25259 2322 1 3 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.487 -3.722 25259 2323 1 3 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.636 -2.379 25259 2324 1 3 . 1 1 152 152 LYS H H 152 7.006 7.006 7.892 -0.886 25259 2325 1 3 . 1 1 153 153 TYR N N 153 123.239 123.239 117.594 5.645 25259 2326 1 3 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.434 -0.176 25259 2327 1 3 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.381 0.928 25259 2328 1 3 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.556 -1.222 25259 2329 1 3 . 1 1 153 153 TYR H H 153 8.058 8.058 8.795 -0.737 25259 2330 1 3 . 1 1 154 154 ILE N N 154 120.253 120.253 121.225 -0.972 25259 2331 1 3 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.129 0.244 25259 2332 1 3 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.181 -2.067 25259 2333 1 3 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.296 -1.348 25259 2334 1 3 . 1 1 154 154 ILE H H 154 8.193 8.193 7.900 0.293 25259 2335 1 3 . 1 1 155 155 SER N N 155 117.178 117.178 114.520 2.658 25259 2336 1 3 . 1 1 155 155 SER HA H 155 4.091 4.091 4.057 0.034 25259 2337 1 3 . 1 1 155 155 SER CA C 155 59.961 59.961 61.493 -1.532 25259 2338 1 3 . 1 1 155 155 SER CB C 155 60.148 60.148 62.953 -2.805 25259 2339 1 3 . 1 1 155 155 SER H H 155 8.020 8.020 8.000 0.020 25259 2340 1 3 . 1 1 156 156 ASP N N 156 125.479 125.479 121.853 3.626 25259 2341 1 3 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.398 0.029 25259 2342 1 3 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.911 -2.151 25259 2343 1 3 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.930 -3.057 25259 2344 1 3 . 1 1 156 156 ASP H H 156 8.638 8.638 7.755 0.883 25259 2345 1 3 . 1 1 157 157 ARG N N 157 121.542 121.542 118.626 2.916 25259 2346 1 3 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.049 0.062 25259 2347 1 3 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.443 -2.515 25259 2348 1 3 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.725 -1.909 25259 2349 1 3 . 1 1 157 157 ARG H H 157 7.888 7.888 7.832 0.056 25259 2350 1 3 . 1 1 158 158 LEU N N 158 124.257 124.257 120.699 3.558 25259 2351 1 3 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.247 0.024 25259 2352 1 3 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.278 -3.065 25259 2353 1 3 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.579 -2.634 25259 2354 1 3 . 1 1 158 158 LEU H H 158 8.442 8.442 7.605 0.837 25259 2355 1 3 . 1 1 159 159 ALA N N 159 124.146 124.146 120.334 3.812 25259 2356 1 3 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.142 0.190 25259 2357 1 3 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.337 -2.905 25259 2358 1 3 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.139 -2.232 25259 2359 1 3 . 1 1 159 159 ALA H H 159 8.086 8.086 7.984 0.102 25259 2360 1 3 . 1 1 160 160 ASN N N 160 118.093 118.093 115.314 2.779 25259 2361 1 3 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.841 0.151 25259 2362 1 3 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.689 -2.112 25259 2363 1 3 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.609 -1.876 25259 2364 1 3 . 1 1 160 160 ASN H H 160 7.445 7.445 7.572 -0.127 25259 2365 1 3 . 1 1 161 161 GLY N N 161 108.365 108.365 107.356 1.009 25259 2366 1 3 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.211 -1.565 25259 2367 1 3 . 1 1 161 161 GLY H H 161 7.743 7.743 7.981 -0.238 25259 2368 1 3 . 1 1 162 162 ALA N N 162 123.928 123.928 122.584 1.344 25259 2369 1 3 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.934 -0.061 25259 2370 1 3 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.486 -1.960 25259 2371 1 3 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.039 -2.979 25259 2372 1 3 . 1 1 162 162 ALA H H 162 8.035 8.035 7.727 0.308 25259 2373 1 3 . 1 1 163 163 THR N N 163 113.286 113.286 110.364 2.922 25259 2374 1 3 . 1 1 163 163 THR HA H 163 4.703 4.703 4.670 0.033 25259 2375 1 3 . 1 1 163 163 THR CA C 163 57.791 57.791 60.513 -2.722 25259 2376 1 3 . 1 1 163 163 THR CB C 163 68.974 68.974 71.464 -2.490 25259 2377 1 3 . 1 1 163 163 THR H H 163 8.451 8.451 8.607 -0.156 25259 2378 1 3 . 1 1 164 164 GLU N N 164 125.905 125.905 120.225 5.680 25259 2379 1 3 . 1 1 164 164 GLU HA H 164 5.060 5.060 5.088 -0.028 25259 2380 1 3 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.075 -1.490 25259 2381 1 3 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.202 -2.990 25259 2382 1 3 . 1 1 164 164 GLU H H 164 8.716 8.716 8.587 0.129 25259 2383 1 4 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.039 -0.364 25259 2384 1 4 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.207 -2.399 25259 2385 1 4 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.095 -3.025 25259 2386 1 4 . 1 1 3 3 ALA N N 3 126.741 126.741 123.070 3.671 25259 2387 1 4 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.403 0.091 25259 2388 1 4 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.463 -1.261 25259 2389 1 4 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.294 -3.476 25259 2390 1 4 . 1 1 3 3 ALA H H 3 8.440 8.440 8.190 0.250 25259 2391 1 4 . 1 1 4 4 THR N N 4 116.015 116.015 119.824 -3.809 25259 2392 1 4 . 1 1 4 4 THR HA H 4 4.393 4.393 4.348 0.045 25259 2393 1 4 . 1 1 4 4 THR CA C 4 59.148 59.148 62.866 -3.718 25259 2394 1 4 . 1 1 4 4 THR CB C 4 67.580 67.580 68.017 -0.437 25259 2395 1 4 . 1 1 4 4 THR H H 4 8.050 8.050 8.313 -0.263 25259 2396 1 4 . 1 1 5 5 LYS N N 5 126.350 126.350 126.368 -0.018 25259 2397 1 4 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.407 0.098 25259 2398 1 4 . 1 1 5 5 LYS CA C 5 53.917 53.917 56.102 -2.185 25259 2399 1 4 . 1 1 5 5 LYS CB C 5 30.684 30.684 33.702 -3.018 25259 2400 1 4 . 1 1 5 5 LYS H H 5 8.332 8.332 8.395 -0.063 25259 2401 1 4 . 1 1 6 6 THR N N 6 118.124 118.124 113.660 4.464 25259 2402 1 4 . 1 1 6 6 THR HA H 6 4.440 4.440 4.598 -0.158 25259 2403 1 4 . 1 1 6 6 THR CA C 6 59.282 59.282 61.782 -2.500 25259 2404 1 4 . 1 1 6 6 THR CB C 6 67.685 67.685 70.440 -2.755 25259 2405 1 4 . 1 1 6 6 THR H H 6 8.283 8.283 8.525 -0.242 25259 2406 1 4 . 1 1 7 7 GLU N N 7 125.934 125.934 120.933 5.001 25259 2407 1 4 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.888 -0.544 25259 2408 1 4 . 1 1 7 7 GLU CA C 7 54.181 54.181 56.026 -1.845 25259 2409 1 4 . 1 1 7 7 GLU CB C 7 27.816 27.816 32.255 -4.439 25259 2410 1 4 . 1 1 7 7 GLU H H 7 8.487 8.487 8.687 -0.200 25259 2411 1 4 . 1 1 8 8 LYS N N 8 123.945 123.945 119.721 4.224 25259 2412 1 4 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.688 -1.752 25259 2413 1 4 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.665 -3.100 25259 2414 1 4 . 1 1 8 8 LYS H H 8 8.278 8.278 8.211 0.067 25259 2415 1 4 . 1 1 9 9 ASP N N 9 123.624 123.624 119.532 4.092 25259 2416 1 4 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.847 -0.508 25259 2417 1 4 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.017 -0.895 25259 2418 1 4 . 1 1 9 9 ASP CB C 9 38.933 38.933 43.711 -4.778 25259 2419 1 4 . 1 1 9 9 ASP H H 9 8.277 8.277 8.970 -0.693 25259 2420 1 4 . 1 1 10 10 THR N N 10 116.812 116.812 113.880 2.932 25259 2421 1 4 . 1 1 10 10 THR HA H 10 4.349 4.349 4.323 0.026 25259 2422 1 4 . 1 1 10 10 THR CA C 10 59.634 59.634 61.888 -2.254 25259 2423 1 4 . 1 1 10 10 THR CB C 10 67.254 67.254 69.346 -2.092 25259 2424 1 4 . 1 1 10 10 THR H H 10 8.049 8.049 8.005 0.044 25259 2425 1 4 . 1 1 11 11 LEU N N 11 126.610 126.610 122.981 3.629 25259 2426 1 4 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.645 -0.253 25259 2427 1 4 . 1 1 11 11 LEU CA C 11 53.078 53.078 55.840 -2.761 25259 2428 1 4 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.971 -3.338 25259 2429 1 4 . 1 1 11 11 LEU H H 11 8.191 8.191 9.171 -0.980 25259 2430 1 4 . 1 1 12 12 GLN N N 12 123.274 123.274 118.959 4.315 25259 2431 1 4 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.733 -0.351 25259 2432 1 4 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.381 -1.807 25259 2433 1 4 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.779 -4.976 25259 2434 1 4 . 1 1 12 12 GLN H H 12 8.280 8.280 8.665 -0.385 25259 2435 1 4 . 1 1 13 13 SER N N 13 119.027 119.027 114.745 4.282 25259 2436 1 4 . 1 1 13 13 SER HA H 13 4.471 4.471 5.296 -0.826 25259 2437 1 4 . 1 1 13 13 SER CA C 13 55.869 55.869 57.867 -1.998 25259 2438 1 4 . 1 1 13 13 SER CB C 13 61.424 61.424 65.025 -3.601 25259 2439 1 4 . 1 1 13 13 SER H H 13 8.178 8.178 8.735 -0.557 25259 2440 1 4 . 1 1 14 14 ALA N N 14 128.314 128.314 122.605 5.709 25259 2441 1 4 . 1 1 14 14 ALA HA H 14 4.434 4.434 5.131 -0.697 25259 2442 1 4 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.605 -1.909 25259 2443 1 4 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.867 -2.786 25259 2444 1 4 . 1 1 14 14 ALA H H 14 8.195 8.195 8.479 -0.284 25259 2445 1 4 . 1 1 15 15 LEU N N 15 125.175 125.175 118.465 6.710 25259 2446 1 4 . 1 1 15 15 LEU HA H 15 4.640 4.640 5.131 -0.491 25259 2447 1 4 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.023 -2.419 25259 2448 1 4 . 1 1 15 15 LEU CB C 15 39.467 39.467 41.685 -2.219 25259 2449 1 4 . 1 1 15 15 LEU H H 15 8.050 8.050 8.658 -0.608 25259 2450 1 4 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.723 -0.219 25259 2451 1 4 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.489 -1.858 25259 2452 1 4 . 1 1 16 16 PRO CB C 16 29.658 29.658 33.375 -3.717 25259 2453 1 4 . 1 1 17 17 VAL N N 17 123.223 123.223 119.911 3.312 25259 2454 1 4 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.094 0.040 25259 2455 1 4 . 1 1 17 17 VAL CA C 17 59.827 59.827 62.601 -2.774 25259 2456 1 4 . 1 1 17 17 VAL CB C 17 30.377 30.377 32.421 -2.044 25259 2457 1 4 . 1 1 17 17 VAL H H 17 8.134 8.134 8.238 -0.104 25259 2458 1 4 . 1 1 18 18 ILE N N 18 127.777 127.777 125.967 1.810 25259 2459 1 4 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.580 -0.337 25259 2460 1 4 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.246 -2.924 25259 2461 1 4 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.208 -3.954 25259 2462 1 4 . 1 1 18 18 ILE H H 18 8.187 8.187 8.688 -0.501 25259 2463 1 4 . 1 1 19 19 GLU N N 19 128.148 128.148 125.827 2.321 25259 2464 1 4 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.838 -0.501 25259 2465 1 4 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.637 -1.546 25259 2466 1 4 . 1 1 19 19 GLU CB C 19 28.176 28.176 33.415 -5.239 25259 2467 1 4 . 1 1 19 19 GLU H H 19 8.475 8.475 8.643 -0.168 25259 2468 1 4 . 1 1 20 20 ASN N N 20 122.788 122.788 116.844 5.944 25259 2469 1 4 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.810 -0.115 25259 2470 1 4 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.669 -1.847 25259 2471 1 4 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.741 -4.375 25259 2472 1 4 . 1 1 20 20 ASN H H 20 8.477 8.477 8.469 0.008 25259 2473 1 4 . 1 1 21 21 ALA N N 21 127.253 127.253 124.239 3.014 25259 2474 1 4 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.405 -0.084 25259 2475 1 4 . 1 1 21 21 ALA CA C 21 50.688 50.688 52.141 -1.453 25259 2476 1 4 . 1 1 21 21 ALA CB C 21 16.913 16.913 17.800 -0.887 25259 2477 1 4 . 1 1 21 21 ALA H H 21 8.325 8.325 8.623 -0.298 25259 2478 1 4 . 1 1 22 22 GLU N N 22 122.044 122.044 124.066 -2.022 25259 2479 1 4 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.272 0.021 25259 2480 1 4 . 1 1 22 22 GLU CA C 22 54.583 54.583 55.732 -1.149 25259 2481 1 4 . 1 1 22 22 GLU CB C 22 27.285 27.285 29.657 -2.372 25259 2482 1 4 . 1 1 22 22 GLU H H 22 8.415 8.415 8.135 0.280 25259 2483 1 4 . 1 1 23 23 LYS N N 23 123.622 123.622 125.917 -2.295 25259 2484 1 4 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.135 0.190 25259 2485 1 4 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.953 -1.458 25259 2486 1 4 . 1 1 23 23 LYS CB C 23 30.653 30.653 31.915 -1.262 25259 2487 1 4 . 1 1 23 23 LYS H H 23 8.127 8.127 8.016 0.111 25259 2488 1 4 . 1 1 24 24 ASN N N 24 120.652 120.652 123.447 -2.795 25259 2489 1 4 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.847 -0.006 25259 2490 1 4 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.105 -2.442 25259 2491 1 4 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.779 -3.004 25259 2492 1 4 . 1 1 24 24 ASN H H 24 8.424 8.424 8.324 0.100 25259 2493 1 4 . 1 1 25 25 THR N N 25 117.102 117.102 112.629 4.473 25259 2494 1 4 . 1 1 25 25 THR HA H 25 4.367 4.367 4.527 -0.160 25259 2495 1 4 . 1 1 25 25 THR CA C 25 59.500 59.500 61.175 -1.675 25259 2496 1 4 . 1 1 25 25 THR CB C 25 67.610 67.610 71.636 -4.026 25259 2497 1 4 . 1 1 25 25 THR H H 25 7.852 7.852 8.235 -0.383 25259 2498 1 4 . 1 1 26 26 VAL N N 26 126.491 126.491 124.594 1.897 25259 2499 1 4 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.180 -0.013 25259 2500 1 4 . 1 1 26 26 VAL CA C 26 60.193 60.193 62.528 -2.335 25259 2501 1 4 . 1 1 26 26 VAL CB C 26 29.605 29.605 31.127 -1.522 25259 2502 1 4 . 1 1 26 26 VAL H H 26 8.080 8.080 8.405 -0.325 25259 2503 1 4 . 1 1 27 27 VAL N N 27 132.992 132.992 127.778 5.214 25259 2504 1 4 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.351 -0.270 25259 2505 1 4 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.673 -1.689 25259 2506 1 4 . 1 1 27 27 VAL CB C 27 31.540 31.540 32.594 -1.054 25259 2507 1 4 . 1 1 27 27 VAL H H 27 8.830 8.830 8.591 0.239 25259 2508 1 4 . 1 1 28 28 THR N N 28 123.576 123.576 117.681 5.895 25259 2509 1 4 . 1 1 28 28 THR HA H 28 5.553 5.553 4.704 0.849 25259 2510 1 4 . 1 1 28 28 THR CA C 28 58.738 58.738 61.769 -3.031 25259 2511 1 4 . 1 1 28 28 THR CB C 28 68.443 68.443 69.209 -0.766 25259 2512 1 4 . 1 1 28 28 THR H H 28 8.165 8.165 8.061 0.104 25259 2513 1 4 . 1 1 29 29 LYS N N 29 129.099 129.099 127.792 1.307 25259 2514 1 4 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.334 0.608 25259 2515 1 4 . 1 1 29 29 LYS CA C 29 51.779 51.779 56.383 -4.604 25259 2516 1 4 . 1 1 29 29 LYS CB C 29 35.096 35.096 33.716 1.380 25259 2517 1 4 . 1 1 29 29 LYS H H 29 9.273 9.273 8.798 0.475 25259 2518 1 4 . 1 1 30 30 THR N N 30 123.510 123.510 117.292 6.218 25259 2519 1 4 . 1 1 30 30 THR HA H 30 5.428 5.428 5.243 0.185 25259 2520 1 4 . 1 1 30 30 THR CA C 30 59.784 59.784 61.901 -2.117 25259 2521 1 4 . 1 1 30 30 THR CB C 30 67.818 67.818 71.756 -3.938 25259 2522 1 4 . 1 1 30 30 THR H H 30 8.993 8.993 8.205 0.788 25259 2523 1 4 . 1 1 31 31 LEU N N 31 128.293 128.293 123.715 4.578 25259 2524 1 4 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.874 0.346 25259 2525 1 4 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.550 -3.495 25259 2526 1 4 . 1 1 31 31 LEU CB C 31 43.399 43.399 46.285 -2.886 25259 2527 1 4 . 1 1 31 31 LEU H H 31 9.557 9.557 8.951 0.606 25259 2528 1 4 . 1 1 32 32 VAL N N 32 126.919 126.919 122.928 3.991 25259 2529 1 4 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.226 0.225 25259 2530 1 4 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.693 -2.029 25259 2531 1 4 . 1 1 32 32 VAL CB C 32 29.449 29.449 31.041 -1.591 25259 2532 1 4 . 1 1 32 32 VAL H H 32 9.364 9.364 8.659 0.705 25259 2533 1 4 . 1 1 33 33 LEU N N 33 133.503 133.503 129.942 3.561 25259 2534 1 4 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.692 -0.136 25259 2535 1 4 . 1 1 33 33 LEU CA C 33 52.004 52.004 51.845 0.159 25259 2536 1 4 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.915 -4.068 25259 2537 1 4 . 1 1 33 33 LEU H H 33 8.587 8.587 7.962 0.625 25259 2538 1 4 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.471 0.010 25259 2539 1 4 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.113 -1.668 25259 2540 1 4 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.329 -2.764 25259 2541 1 4 . 1 1 35 35 LYS N N 35 127.420 127.420 118.455 8.965 25259 2542 1 4 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.452 -0.086 25259 2543 1 4 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.367 -1.248 25259 2544 1 4 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.577 -1.983 25259 2545 1 4 . 1 1 35 35 LYS H H 35 8.666 8.666 8.257 0.409 25259 2546 1 4 . 1 1 36 36 SER N N 36 122.222 122.222 115.263 6.959 25259 2547 1 4 . 1 1 36 36 SER HA H 36 4.753 4.753 4.596 0.157 25259 2548 1 4 . 1 1 36 36 SER CA C 36 55.328 55.328 56.990 -1.662 25259 2549 1 4 . 1 1 36 36 SER CB C 36 61.728 61.728 63.004 -1.276 25259 2550 1 4 . 1 1 36 36 SER H H 36 8.771 8.771 8.477 0.294 25259 2551 1 4 . 1 1 37 37 ASP N N 37 126.346 126.346 121.779 4.567 25259 2552 1 4 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.258 0.196 25259 2553 1 4 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.042 -2.426 25259 2554 1 4 . 1 1 37 37 ASP CB C 37 37.985 37.985 39.072 -1.087 25259 2555 1 4 . 1 1 37 37 ASP H H 37 8.859 8.859 8.605 0.254 25259 2556 1 4 . 1 1 38 38 ASP N N 38 119.171 119.171 122.166 -2.995 25259 2557 1 4 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.601 0.014 25259 2558 1 4 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.764 -3.975 25259 2559 1 4 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.438 -3.803 25259 2560 1 4 . 1 1 38 38 ASP H H 38 7.944 7.944 8.128 -0.184 25259 2561 1 4 . 1 1 39 39 GLY N N 39 110.352 110.352 107.259 3.093 25259 2562 1 4 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.134 -2.373 25259 2563 1 4 . 1 1 39 39 GLY H H 39 8.145 8.145 7.907 0.238 25259 2564 1 4 . 1 1 40 40 SER N N 40 120.090 120.090 114.355 5.735 25259 2565 1 4 . 1 1 40 40 SER HA H 40 4.877 4.877 5.085 -0.208 25259 2566 1 4 . 1 1 40 40 SER CA C 40 56.525 56.525 57.347 -0.822 25259 2567 1 4 . 1 1 40 40 SER CB C 40 62.245 62.245 65.842 -3.597 25259 2568 1 4 . 1 1 40 40 SER H H 40 8.344 8.344 7.744 0.600 25259 2569 1 4 . 1 1 41 41 GLN N N 41 122.551 122.551 121.513 1.038 25259 2570 1 4 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.727 0.200 25259 2571 1 4 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.825 -1.411 25259 2572 1 4 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.390 -3.076 25259 2573 1 4 . 1 1 41 41 GLN H H 41 8.627 8.627 9.174 -0.547 25259 2574 1 4 . 1 1 42 42 GLN N N 42 131.724 131.724 120.266 11.458 25259 2575 1 4 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.924 0.687 25259 2576 1 4 . 1 1 42 42 GLN CA C 42 52.072 52.072 53.936 -1.864 25259 2577 1 4 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.872 -2.553 25259 2578 1 4 . 1 1 42 42 GLN H H 42 9.189 9.189 8.782 0.407 25259 2579 1 4 . 1 1 43 43 THR N N 43 122.202 122.202 117.382 4.820 25259 2580 1 4 . 1 1 43 43 THR HA H 43 5.380 5.380 5.190 0.190 25259 2581 1 4 . 1 1 43 43 THR CA C 43 58.863 58.863 61.051 -2.188 25259 2582 1 4 . 1 1 43 43 THR CB C 43 68.893 68.893 71.020 -2.127 25259 2583 1 4 . 1 1 43 43 THR H H 43 9.139 9.139 8.104 1.035 25259 2584 1 4 . 1 1 44 44 GLN N N 44 127.190 127.190 122.439 4.751 25259 2585 1 4 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.214 0.420 25259 2586 1 4 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.716 -3.048 25259 2587 1 4 . 1 1 44 44 GLN CB C 44 28.910 28.910 33.100 -4.190 25259 2588 1 4 . 1 1 44 44 GLN H H 44 9.760 9.760 8.623 1.137 25259 2589 1 4 . 1 1 45 45 THR N N 45 123.479 123.479 118.550 4.929 25259 2590 1 4 . 1 1 45 45 THR HA H 45 5.421 5.421 5.203 0.218 25259 2591 1 4 . 1 1 45 45 THR CA C 45 60.071 60.071 61.164 -1.093 25259 2592 1 4 . 1 1 45 45 THR CB C 45 67.541 67.541 70.892 -3.351 25259 2593 1 4 . 1 1 45 45 THR H H 45 9.518 9.518 9.147 0.371 25259 2594 1 4 . 1 1 46 46 ILE N N 46 133.908 133.908 128.017 5.891 25259 2595 1 4 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.821 0.182 25259 2596 1 4 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.404 -1.933 25259 2597 1 4 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.746 0.199 25259 2598 1 4 . 1 1 46 46 ILE H H 46 9.830 9.830 9.366 0.464 25259 2599 1 4 . 1 1 47 47 THR N N 47 124.701 124.701 124.051 0.650 25259 2600 1 4 . 1 1 47 47 THR HA H 47 6.048 6.048 4.940 1.108 25259 2601 1 4 . 1 1 47 47 THR CA C 47 58.551 58.551 62.157 -3.606 25259 2602 1 4 . 1 1 47 47 THR CB C 47 67.819 67.819 69.023 -1.204 25259 2603 1 4 . 1 1 47 47 THR H H 47 8.843 8.843 8.335 0.508 25259 2604 1 4 . 1 1 48 48 TYR N N 48 127.369 127.369 122.723 4.646 25259 2605 1 4 . 1 1 48 48 TYR HA H 48 5.278 5.278 4.977 0.301 25259 2606 1 4 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.281 -2.551 25259 2607 1 4 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.738 -2.306 25259 2608 1 4 . 1 1 48 48 TYR H H 48 9.638 9.638 8.081 1.557 25259 2609 1 4 . 1 1 49 49 LYS N N 49 122.138 122.138 118.313 3.825 25259 2610 1 4 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.755 -0.099 25259 2611 1 4 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.999 -3.027 25259 2612 1 4 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.283 -0.680 25259 2613 1 4 . 1 1 49 49 LYS H H 49 8.560 8.560 8.867 -0.307 25259 2614 1 4 . 1 1 50 50 ASP N N 50 130.208 130.208 120.765 9.443 25259 2615 1 4 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.759 -0.455 25259 2616 1 4 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.522 0.238 25259 2617 1 4 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.676 -5.337 25259 2618 1 4 . 1 1 50 50 ASP H H 50 9.597 9.597 8.260 1.337 25259 2619 1 4 . 1 1 51 51 LYS N N 51 124.586 124.586 119.088 5.498 25259 2620 1 4 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.447 0.084 25259 2621 1 4 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.521 -2.787 25259 2622 1 4 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.368 -3.974 25259 2623 1 4 . 1 1 51 51 LYS H H 51 8.450 8.450 8.244 0.206 25259 2624 1 4 . 1 1 52 52 THR N N 52 120.044 120.044 113.385 6.659 25259 2625 1 4 . 1 1 52 52 THR HA H 52 4.717 4.717 4.446 0.271 25259 2626 1 4 . 1 1 52 52 THR CA C 52 59.313 59.313 60.089 -0.776 25259 2627 1 4 . 1 1 52 52 THR CB C 52 68.815 68.815 70.235 -1.420 25259 2628 1 4 . 1 1 52 52 THR H H 52 8.658 8.658 7.605 1.053 25259 2629 1 4 . 1 1 53 53 PHE N N 53 128.987 128.987 122.271 6.716 25259 2630 1 4 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.544 -0.261 25259 2631 1 4 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.734 -0.745 25259 2632 1 4 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.990 0.321 25259 2633 1 4 . 1 1 53 53 PHE H H 53 9.218 9.218 8.680 0.538 25259 2634 1 4 . 1 1 54 54 LEU N N 54 124.874 124.874 125.442 -0.568 25259 2635 1 4 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.365 0.564 25259 2636 1 4 . 1 1 54 54 LEU CA C 54 54.241 54.241 55.944 -1.703 25259 2637 1 4 . 1 1 54 54 LEU CB C 54 40.517 40.517 41.961 -1.444 25259 2638 1 4 . 1 1 54 54 LEU H H 54 9.391 9.391 8.248 1.143 25259 2639 1 4 . 1 1 55 55 SER N N 55 115.516 115.516 110.233 5.283 25259 2640 1 4 . 1 1 55 55 SER HA H 55 5.194 5.194 5.538 -0.344 25259 2641 1 4 . 1 1 55 55 SER CA C 55 55.818 55.818 57.736 -1.919 25259 2642 1 4 . 1 1 55 55 SER CB C 55 63.474 63.474 67.060 -3.586 25259 2643 1 4 . 1 1 55 55 SER H H 55 8.736 8.736 7.777 0.959 25259 2644 1 4 . 1 1 56 56 LEU N N 56 124.352 124.352 122.706 1.646 25259 2645 1 4 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.608 -0.065 25259 2646 1 4 . 1 1 56 56 LEU CA C 56 51.637 51.637 53.540 -1.903 25259 2647 1 4 . 1 1 56 56 LEU CB C 56 45.513 45.513 47.006 -1.493 25259 2648 1 4 . 1 1 56 56 LEU H H 56 8.328 8.328 8.942 -0.614 25259 2649 1 4 . 1 1 57 57 ALA N N 57 131.450 131.450 126.188 5.262 25259 2650 1 4 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.172 0.333 25259 2651 1 4 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.441 -2.239 25259 2652 1 4 . 1 1 57 57 ALA CB C 57 18.964 18.964 22.814 -3.850 25259 2653 1 4 . 1 1 57 57 ALA H H 57 9.208 9.208 9.182 0.026 25259 2654 1 4 . 1 1 58 58 ILE N N 58 126.248 126.248 120.298 5.950 25259 2655 1 4 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.788 -0.004 25259 2656 1 4 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.565 -2.318 25259 2657 1 4 . 1 1 58 58 ILE CB C 58 38.045 38.045 41.130 -3.085 25259 2658 1 4 . 1 1 58 58 ILE H H 58 9.597 9.597 8.859 0.738 25259 2659 1 4 . 1 1 59 59 GLN N N 59 132.065 132.065 126.250 5.815 25259 2660 1 4 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.549 0.698 25259 2661 1 4 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.963 -3.799 25259 2662 1 4 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.403 -0.742 25259 2663 1 4 . 1 1 59 59 GLN H H 59 9.389 9.389 8.610 0.779 25259 2664 1 4 . 1 1 60 60 GLN N N 60 130.314 130.314 118.948 11.366 25259 2665 1 4 . 1 1 60 60 GLN HA H 60 5.209 5.209 5.107 0.102 25259 2666 1 4 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.573 -2.552 25259 2667 1 4 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.742 -4.266 25259 2668 1 4 . 1 1 60 60 GLN H H 60 9.471 9.471 8.872 0.599 25259 2669 1 4 . 1 1 61 61 LYS N N 61 131.044 131.044 123.365 7.679 25259 2670 1 4 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.206 0.209 25259 2671 1 4 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.226 -3.106 25259 2672 1 4 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.482 -4.065 25259 2673 1 4 . 1 1 61 61 LYS H H 61 8.893 8.893 8.976 -0.083 25259 2674 1 4 . 1 1 62 62 ARG N N 62 125.397 125.397 121.226 4.171 25259 2675 1 4 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.099 -0.096 25259 2676 1 4 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.877 -2.786 25259 2677 1 4 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.623 -1.745 25259 2678 1 4 . 1 1 62 62 ARG H H 62 9.120 9.120 8.325 0.795 25259 2679 1 4 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.757 0.218 25259 2680 1 4 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.705 -3.208 25259 2681 1 4 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.164 -2.280 25259 2682 1 4 . 1 1 64 64 VAL N N 64 121.305 121.305 118.523 2.782 25259 2683 1 4 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.175 -0.151 25259 2684 1 4 . 1 1 64 64 VAL CA C 64 59.677 59.677 61.303 -1.627 25259 2685 1 4 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.703 -2.338 25259 2686 1 4 . 1 1 64 64 VAL H H 64 7.520 7.520 8.280 -0.760 25259 2687 1 4 . 1 1 65 65 SER N N 65 123.215 123.215 113.288 9.927 25259 2688 1 4 . 1 1 65 65 SER HA H 65 4.521 4.521 4.627 -0.106 25259 2689 1 4 . 1 1 65 65 SER CA C 65 54.897 54.897 56.592 -1.695 25259 2690 1 4 . 1 1 65 65 SER CB C 65 62.564 62.564 64.840 -2.276 25259 2691 1 4 . 1 1 65 65 SER H H 65 8.080 8.080 7.814 0.266 25259 2692 1 4 . 1 1 66 66 ASP N N 66 123.802 123.802 122.713 1.089 25259 2693 1 4 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.718 -0.289 25259 2694 1 4 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.639 -1.260 25259 2695 1 4 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.024 -2.986 25259 2696 1 4 . 1 1 66 66 ASP H H 66 8.900 8.900 8.637 0.263 25259 2697 1 4 . 1 1 67 67 GLU N N 67 121.943 121.943 121.010 0.933 25259 2698 1 4 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.127 0.062 25259 2699 1 4 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.149 -1.709 25259 2700 1 4 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.493 -2.708 25259 2701 1 4 . 1 1 67 67 GLU H H 67 8.717 8.717 8.844 -0.127 25259 2702 1 4 . 1 1 68 68 LEU N N 68 125.458 125.458 116.646 8.812 25259 2703 1 4 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.407 -0.064 25259 2704 1 4 . 1 1 68 68 LEU CA C 68 54.472 54.472 55.087 -0.615 25259 2705 1 4 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.502 -2.098 25259 2706 1 4 . 1 1 68 68 LEU H H 68 7.820 7.820 7.771 0.049 25259 2707 1 4 . 1 1 69 69 LYS N N 69 123.868 123.868 120.849 3.019 25259 2708 1 4 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.113 -0.107 25259 2709 1 4 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.615 -1.998 25259 2710 1 4 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.369 -2.332 25259 2711 1 4 . 1 1 69 69 LYS H H 69 8.690 8.690 7.402 1.288 25259 2712 1 4 . 1 1 70 70 THR N N 70 117.109 117.109 117.279 -0.170 25259 2713 1 4 . 1 1 70 70 THR HA H 70 4.088 4.088 3.967 0.121 25259 2714 1 4 . 1 1 70 70 THR CA C 70 63.879 63.879 66.391 -2.512 25259 2715 1 4 . 1 1 70 70 THR CB C 70 66.383 66.383 68.987 -2.604 25259 2716 1 4 . 1 1 70 70 THR H H 70 7.935 7.935 8.201 -0.266 25259 2717 1 4 . 1 1 71 71 TYR N N 71 127.006 127.006 122.074 4.932 25259 2718 1 4 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.194 0.011 25259 2719 1 4 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.819 -1.593 25259 2720 1 4 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.465 -1.920 25259 2721 1 4 . 1 1 71 71 TYR H H 71 7.683 7.683 7.923 -0.240 25259 2722 1 4 . 1 1 72 72 ILE N N 72 125.064 125.064 119.481 5.583 25259 2723 1 4 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.736 -0.057 25259 2724 1 4 . 1 1 72 72 ILE CA C 72 62.895 62.895 64.608 -1.713 25259 2725 1 4 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.762 -1.486 25259 2726 1 4 . 1 1 72 72 ILE H H 72 9.083 9.083 7.789 1.294 25259 2727 1 4 . 1 1 73 73 ASP N N 73 124.900 124.900 118.662 6.238 25259 2728 1 4 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.433 -0.044 25259 2729 1 4 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.717 -1.679 25259 2730 1 4 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.867 -2.760 25259 2731 1 4 . 1 1 73 73 ASP H H 73 8.751 8.751 7.879 0.872 25259 2732 1 4 . 1 1 74 74 GLN N N 74 117.025 117.025 116.131 0.894 25259 2733 1 4 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.266 -0.128 25259 2734 1 4 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.095 -2.285 25259 2735 1 4 . 1 1 74 74 GLN CB C 74 27.564 27.564 30.791 -3.228 25259 2736 1 4 . 1 1 74 74 GLN H H 74 7.447 7.447 7.618 -0.171 25259 2737 1 4 . 1 1 75 75 HIS N N 75 116.494 116.494 116.928 -0.434 25259 2738 1 4 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.614 0.102 25259 2739 1 4 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.795 -2.729 25259 2740 1 4 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.580 -4.278 25259 2741 1 4 . 1 1 75 75 HIS H H 75 8.402 8.402 7.943 0.459 25259 2742 1 4 . 1 1 76 76 GLY N N 76 112.564 112.564 104.839 7.725 25259 2743 1 4 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.651 -2.755 25259 2744 1 4 . 1 1 76 76 GLY H H 76 9.091 9.091 7.736 1.355 25259 2745 1 4 . 1 1 77 77 VAL N N 77 124.763 124.763 120.866 3.897 25259 2746 1 4 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.866 -0.301 25259 2747 1 4 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.067 -0.116 25259 2748 1 4 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.463 -2.625 25259 2749 1 4 . 1 1 77 77 VAL H H 77 8.927 8.927 8.565 0.362 25259 2750 1 4 . 1 1 78 78 GLU N N 78 124.388 124.388 118.449 5.939 25259 2751 1 4 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.103 0.045 25259 2752 1 4 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.544 -1.228 25259 2753 1 4 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.333 -2.874 25259 2754 1 4 . 1 1 78 78 GLU H H 78 8.781 8.781 8.344 0.437 25259 2755 1 4 . 1 1 79 79 GLU N N 79 121.887 121.887 117.254 4.633 25259 2756 1 4 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.153 0.035 25259 2757 1 4 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.471 -2.926 25259 2758 1 4 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.089 -2.056 25259 2759 1 4 . 1 1 79 79 GLU H H 79 9.231 9.231 8.609 0.622 25259 2760 1 4 . 1 1 80 80 THR N N 80 120.781 120.781 114.958 5.823 25259 2761 1 4 . 1 1 80 80 THR HA H 80 4.059 4.059 3.953 0.106 25259 2762 1 4 . 1 1 80 80 THR CA C 80 65.487 65.487 66.439 -0.952 25259 2763 1 4 . 1 1 80 80 THR CB C 80 64.369 64.369 68.164 -3.795 25259 2764 1 4 . 1 1 80 80 THR H H 80 7.858 7.858 7.755 0.103 25259 2765 1 4 . 1 1 81 81 GLN N N 81 125.303 125.303 122.027 3.276 25259 2766 1 4 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.937 0.107 25259 2767 1 4 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.405 -2.436 25259 2768 1 4 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.195 -2.118 25259 2769 1 4 . 1 1 81 81 GLN H H 81 8.765 8.765 7.921 0.844 25259 2770 1 4 . 1 1 82 82 LYS N N 82 120.458 120.458 118.915 1.543 25259 2771 1 4 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.934 0.155 25259 2772 1 4 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.809 -1.497 25259 2773 1 4 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.840 -1.686 25259 2774 1 4 . 1 1 82 82 LYS H H 82 7.521 7.521 7.357 0.164 25259 2775 1 4 . 1 1 83 83 ALA N N 83 125.234 125.234 122.367 2.867 25259 2776 1 4 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.932 0.285 25259 2777 1 4 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.781 -2.339 25259 2778 1 4 . 1 1 83 83 ALA CB C 83 15.287 15.287 18.032 -2.745 25259 2779 1 4 . 1 1 83 83 ALA H H 83 7.782 7.782 7.824 -0.042 25259 2780 1 4 . 1 1 84 84 LEU N N 84 123.348 123.348 117.542 5.806 25259 2781 1 4 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.949 0.109 25259 2782 1 4 . 1 1 84 84 LEU CA C 84 55.499 55.499 58.042 -2.543 25259 2783 1 4 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.605 -2.297 25259 2784 1 4 . 1 1 84 84 LEU H H 84 8.590 8.590 7.786 0.804 25259 2785 1 4 . 1 1 85 85 LEU N N 85 122.872 122.872 117.657 5.215 25259 2786 1 4 . 1 1 85 85 LEU HA H 85 4.170 4.170 4.113 0.057 25259 2787 1 4 . 1 1 85 85 LEU CA C 85 55.396 55.396 56.769 -1.373 25259 2788 1 4 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.419 -2.678 25259 2789 1 4 . 1 1 85 85 LEU H H 85 7.892 7.892 7.468 0.424 25259 2790 1 4 . 1 1 86 86 GLU N N 86 122.713 122.713 119.904 2.809 25259 2791 1 4 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.054 0.031 25259 2792 1 4 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.836 -2.091 25259 2793 1 4 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.549 -2.646 25259 2794 1 4 . 1 1 86 86 GLU H H 86 8.124 8.124 8.560 -0.436 25259 2795 1 4 . 1 1 87 87 ALA N N 87 123.163 123.163 119.610 3.553 25259 2796 1 4 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.206 -0.065 25259 2797 1 4 . 1 1 87 87 ALA CA C 87 52.268 52.268 53.804 -1.536 25259 2798 1 4 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.718 -3.086 25259 2799 1 4 . 1 1 87 87 ALA H H 87 7.765 7.765 7.536 0.229 25259 2800 1 4 . 1 1 88 88 GLU N N 88 121.945 121.945 118.032 3.913 25259 2801 1 4 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.276 -0.192 25259 2802 1 4 . 1 1 88 88 GLU CA C 88 56.935 56.935 57.726 -0.791 25259 2803 1 4 . 1 1 88 88 GLU CB C 88 28.027 28.027 30.354 -2.327 25259 2804 1 4 . 1 1 88 88 GLU H H 88 7.846 7.846 8.006 -0.160 25259 2805 1 4 . 1 1 89 89 GLU N N 89 117.978 117.978 120.144 -2.166 25259 2806 1 4 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.091 0.002 25259 2807 1 4 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.671 -3.457 25259 2808 1 4 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.230 -1.823 25259 2809 1 4 . 1 1 89 89 GLU H H 89 7.634 7.634 7.758 -0.124 25259 2810 1 4 . 1 1 90 90 LYS N N 90 117.519 117.519 116.140 1.379 25259 2811 1 4 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.360 0.071 25259 2812 1 4 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.894 -2.876 25259 2813 1 4 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.345 -1.314 25259 2814 1 4 . 1 1 90 90 LYS H H 90 7.247 7.247 7.777 -0.530 25259 2815 1 4 . 1 1 91 91 ASP N N 91 124.888 124.888 122.270 2.618 25259 2816 1 4 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.685 -0.002 25259 2817 1 4 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.881 -2.682 25259 2818 1 4 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.405 -2.824 25259 2819 1 4 . 1 1 91 91 ASP H H 91 7.370 7.370 7.569 -0.199 25259 2820 1 4 . 1 1 92 92 LYS N N 92 129.311 129.311 127.207 2.104 25259 2821 1 4 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.969 0.044 25259 2822 1 4 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.366 -2.150 25259 2823 1 4 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.530 -2.515 25259 2824 1 4 . 1 1 92 92 LYS H H 92 8.795 8.795 8.881 -0.086 25259 2825 1 4 . 1 1 93 93 SER N N 93 118.112 118.112 113.948 4.164 25259 2826 1 4 . 1 1 93 93 SER HA H 93 4.439 4.439 4.485 -0.046 25259 2827 1 4 . 1 1 93 93 SER CA C 93 58.945 58.945 60.468 -1.523 25259 2828 1 4 . 1 1 93 93 SER CB C 93 60.278 60.278 63.364 -3.086 25259 2829 1 4 . 1 1 93 93 SER H H 93 8.488 8.488 8.182 0.306 25259 2830 1 4 . 1 1 94 94 ILE N N 94 128.950 128.950 121.552 7.398 25259 2831 1 4 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.739 -0.257 25259 2832 1 4 . 1 1 94 94 ILE CA C 94 62.349 62.349 63.607 -1.258 25259 2833 1 4 . 1 1 94 94 ILE CB C 94 34.753 34.753 38.645 -3.892 25259 2834 1 4 . 1 1 94 94 ILE H H 94 7.722 7.722 7.607 0.115 25259 2835 1 4 . 1 1 95 95 ILE N N 95 123.598 123.598 120.965 2.633 25259 2836 1 4 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.533 0.062 25259 2837 1 4 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.921 -3.175 25259 2838 1 4 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.673 -1.701 25259 2839 1 4 . 1 1 95 95 ILE H H 95 8.378 8.378 8.490 -0.112 25259 2840 1 4 . 1 1 96 96 GLU N N 96 118.317 118.317 117.413 0.904 25259 2841 1 4 . 1 1 96 96 GLU HA H 96 3.984 3.984 4.038 -0.054 25259 2842 1 4 . 1 1 96 96 GLU CA C 96 56.495 56.495 58.742 -2.247 25259 2843 1 4 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.368 -2.195 25259 2844 1 4 . 1 1 96 96 GLU H H 96 7.680 7.680 7.658 0.022 25259 2845 1 4 . 1 1 97 97 ALA N N 97 124.797 124.797 123.337 1.460 25259 2846 1 4 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.835 -0.010 25259 2847 1 4 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.146 -1.849 25259 2848 1 4 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.390 -2.401 25259 2849 1 4 . 1 1 97 97 ALA H H 97 7.383 7.383 7.261 0.122 25259 2850 1 4 . 1 1 98 98 ARG N N 98 115.469 115.469 114.993 0.476 25259 2851 1 4 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.327 -0.021 25259 2852 1 4 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.716 -1.226 25259 2853 1 4 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.548 -1.310 25259 2854 1 4 . 1 1 98 98 ARG H H 98 8.229 8.229 8.105 0.124 25259 2855 1 4 . 1 1 99 99 LYS N N 99 120.219 120.219 117.087 3.132 25259 2856 1 4 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.236 0.022 25259 2857 1 4 . 1 1 99 99 LYS CA C 99 55.241 55.241 56.784 -1.543 25259 2858 1 4 . 1 1 99 99 LYS CB C 99 30.496 30.496 33.183 -2.687 25259 2859 1 4 . 1 1 99 99 LYS H H 99 7.270 7.270 7.398 -0.128 25259 2860 1 4 . 1 1 100 100 LEU N N 100 123.800 123.800 120.219 3.581 25259 2861 1 4 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.295 0.046 25259 2862 1 4 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.634 -2.555 25259 2863 1 4 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.395 -3.264 25259 2864 1 4 . 1 1 100 100 LEU H H 100 7.837 7.837 7.604 0.233 25259 2865 1 4 . 1 1 101 101 ALA N N 101 130.512 130.512 125.130 5.382 25259 2866 1 4 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.414 -0.038 25259 2867 1 4 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.242 -2.838 25259 2868 1 4 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.752 -2.956 25259 2869 1 4 . 1 1 101 101 ALA H H 101 8.213 8.213 8.981 -0.768 25259 2870 1 4 . 1 1 102 102 GLY N N 102 110.659 110.659 105.134 5.525 25259 2871 1 4 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.763 -0.870 25259 2872 1 4 . 1 1 102 102 GLY H H 102 8.738 8.738 8.190 0.548 25259 2873 1 4 . 1 1 103 103 PHE N N 103 123.097 123.097 121.627 1.470 25259 2874 1 4 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.641 -0.421 25259 2875 1 4 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.323 -2.555 25259 2876 1 4 . 1 1 103 103 PHE CB C 103 40.574 40.574 43.057 -2.483 25259 2877 1 4 . 1 1 103 103 PHE H H 103 7.514 7.514 7.417 0.097 25259 2878 1 4 . 1 1 104 104 LYS N N 104 130.652 130.652 123.701 6.951 25259 2879 1 4 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.257 -0.137 25259 2880 1 4 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.684 -1.705 25259 2881 1 4 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.293 -2.056 25259 2882 1 4 . 1 1 104 104 LYS H H 104 7.473 7.473 7.865 -0.392 25259 2883 1 4 . 1 1 105 105 LEU N N 105 127.372 127.372 124.118 3.254 25259 2884 1 4 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.015 -0.019 25259 2885 1 4 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.582 -1.846 25259 2886 1 4 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.000 -1.036 25259 2887 1 4 . 1 1 105 105 LEU H H 105 8.393 8.393 8.201 0.192 25259 2888 1 4 . 1 1 106 106 GLU N N 106 129.358 129.358 124.405 4.953 25259 2889 1 4 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.625 0.219 25259 2890 1 4 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.026 -2.236 25259 2891 1 4 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.772 -2.144 25259 2892 1 4 . 1 1 106 106 GLU H H 106 8.849 8.849 9.190 -0.341 25259 2893 1 4 . 1 1 107 107 THR N N 107 131.118 131.118 115.710 15.408 25259 2894 1 4 . 1 1 107 107 THR HA H 107 5.110 5.110 5.057 0.053 25259 2895 1 4 . 1 1 107 107 THR CA C 107 59.832 59.832 61.276 -1.444 25259 2896 1 4 . 1 1 107 107 THR CB C 107 66.671 66.671 71.239 -4.568 25259 2897 1 4 . 1 1 107 107 THR H H 107 9.433 9.433 8.249 1.184 25259 2898 1 4 . 1 1 108 108 LYS N N 108 129.114 129.114 125.044 4.070 25259 2899 1 4 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.654 0.170 25259 2900 1 4 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.866 -2.672 25259 2901 1 4 . 1 1 108 108 LYS CB C 108 34.388 34.388 36.333 -1.945 25259 2902 1 4 . 1 1 108 108 LYS H H 108 9.410 9.410 9.257 0.153 25259 2903 1 4 . 1 1 109 109 LEU N N 109 129.323 129.323 126.326 2.997 25259 2904 1 4 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.434 0.270 25259 2905 1 4 . 1 1 109 109 LEU CA C 109 52.108 52.108 55.139 -3.031 25259 2906 1 4 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.750 -3.095 25259 2907 1 4 . 1 1 109 109 LEU H H 109 8.862 8.862 8.687 0.175 25259 2908 1 4 . 1 1 110 110 LEU N N 110 129.123 129.123 126.501 2.622 25259 2909 1 4 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.569 -0.346 25259 2910 1 4 . 1 1 110 110 LEU CA C 110 53.782 53.782 55.379 -1.597 25259 2911 1 4 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.853 -2.192 25259 2912 1 4 . 1 1 110 110 LEU H H 110 8.373 8.373 8.645 -0.272 25259 2913 1 4 . 1 1 111 111 SER N N 111 114.587 114.587 112.257 2.330 25259 2914 1 4 . 1 1 111 111 SER HA H 111 4.557 4.557 4.607 -0.050 25259 2915 1 4 . 1 1 111 111 SER CA C 111 53.889 53.889 57.356 -3.467 25259 2916 1 4 . 1 1 111 111 SER CB C 111 61.830 61.830 65.326 -3.496 25259 2917 1 4 . 1 1 111 111 SER H H 111 8.400 8.400 7.624 0.776 25259 2918 1 4 . 1 1 112 112 ALA N N 112 118.269 118.269 124.041 -5.772 25259 2919 1 4 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.215 0.094 25259 2920 1 4 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.727 -3.513 25259 2921 1 4 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.658 -2.070 25259 2922 1 4 . 1 1 112 112 ALA H H 112 8.556 8.556 8.620 -0.064 25259 2923 1 4 . 1 1 113 113 THR N N 113 102.878 102.878 103.663 -0.785 25259 2924 1 4 . 1 1 113 113 THR HA H 113 4.662 4.662 4.370 0.292 25259 2925 1 4 . 1 1 113 113 THR CA C 113 58.689 58.689 61.653 -2.964 25259 2926 1 4 . 1 1 113 113 THR CB C 113 67.905 67.905 69.293 -1.388 25259 2927 1 4 . 1 1 113 113 THR H H 113 8.065 8.065 7.852 0.213 25259 2928 1 4 . 1 1 114 114 GLU N N 114 126.514 126.514 120.737 5.777 25259 2929 1 4 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.123 -0.109 25259 2930 1 4 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.406 -1.399 25259 2931 1 4 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.525 -1.612 25259 2932 1 4 . 1 1 114 114 GLU H H 114 7.357 7.357 7.658 -0.301 25259 2933 1 4 . 1 1 115 115 LEU N N 115 128.058 128.058 118.767 9.291 25259 2934 1 4 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.265 -0.343 25259 2935 1 4 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.812 -1.488 25259 2936 1 4 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.474 -2.335 25259 2937 1 4 . 1 1 115 115 LEU H H 115 8.930 8.930 8.741 0.189 25259 2938 1 4 . 1 1 116 116 GLN N N 116 126.540 126.540 118.526 8.014 25259 2939 1 4 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.203 0.512 25259 2940 1 4 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.762 -3.062 25259 2941 1 4 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.562 -1.270 25259 2942 1 4 . 1 1 116 116 GLN H H 116 9.221 9.221 9.134 0.087 25259 2943 1 4 . 1 1 117 117 THR N N 117 125.213 125.213 120.776 4.437 25259 2944 1 4 . 1 1 117 117 THR HA H 117 5.353 5.353 5.381 -0.028 25259 2945 1 4 . 1 1 117 117 THR CA C 117 58.926 58.926 61.039 -2.113 25259 2946 1 4 . 1 1 117 117 THR CB C 117 68.948 68.948 72.489 -3.541 25259 2947 1 4 . 1 1 117 117 THR H H 117 9.030 9.030 8.904 0.126 25259 2948 1 4 . 1 1 118 118 THR N N 118 127.799 127.799 117.488 10.311 25259 2949 1 4 . 1 1 118 118 THR HA H 118 5.527 5.527 5.014 0.513 25259 2950 1 4 . 1 1 118 118 THR CA C 118 59.201 59.201 61.765 -2.564 25259 2951 1 4 . 1 1 118 118 THR CB C 118 67.721 67.721 72.411 -4.690 25259 2952 1 4 . 1 1 118 118 THR H H 118 9.459 9.459 8.785 0.674 25259 2953 1 4 . 1 1 119 119 THR N N 119 129.258 129.258 120.443 8.815 25259 2954 1 4 . 1 1 119 119 THR HA H 119 4.885 4.885 4.768 0.117 25259 2955 1 4 . 1 1 119 119 THR CA C 119 58.463 58.463 60.953 -2.490 25259 2956 1 4 . 1 1 119 119 THR CB C 119 67.459 67.459 71.196 -3.737 25259 2957 1 4 . 1 1 119 119 THR H H 119 9.147 9.147 8.718 0.429 25259 2958 1 4 . 1 1 120 120 SER N N 120 123.389 123.389 117.911 5.478 25259 2959 1 4 . 1 1 120 120 SER HA H 120 5.328 5.328 4.834 0.494 25259 2960 1 4 . 1 1 120 120 SER CA C 120 54.386 54.386 56.024 -1.638 25259 2961 1 4 . 1 1 120 120 SER CB C 120 63.031 63.031 64.929 -1.898 25259 2962 1 4 . 1 1 120 120 SER H H 120 8.786 8.786 8.408 0.378 25259 2963 1 4 . 1 1 121 121 PHE N N 121 121.245 121.245 122.717 -1.472 25259 2964 1 4 . 1 1 121 121 PHE HA H 121 5.112 5.112 5.061 0.050 25259 2965 1 4 . 1 1 121 121 PHE CA C 121 53.192 53.192 55.371 -2.179 25259 2966 1 4 . 1 1 121 121 PHE CB C 121 40.265 40.265 39.545 0.720 25259 2967 1 4 . 1 1 121 121 PHE H H 121 8.831 8.831 9.206 -0.375 25259 2968 1 4 . 1 1 122 122 ASP N N 122 124.765 124.765 126.216 -1.451 25259 2969 1 4 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.754 0.086 25259 2970 1 4 . 1 1 122 122 ASP CA C 122 49.837 49.837 54.401 -4.564 25259 2971 1 4 . 1 1 122 122 ASP CB C 122 38.485 38.485 39.939 -1.454 25259 2972 1 4 . 1 1 122 122 ASP H H 122 8.819 8.819 8.910 -0.091 25259 2973 1 4 . 1 1 123 123 PHE N N 123 124.303 124.303 123.509 0.794 25259 2974 1 4 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.115 0.559 25259 2975 1 4 . 1 1 123 123 PHE CA C 123 57.798 57.798 61.971 -4.173 25259 2976 1 4 . 1 1 123 123 PHE CB C 123 35.540 35.540 39.035 -3.495 25259 2977 1 4 . 1 1 123 123 PHE H H 123 8.262 8.262 8.434 -0.172 25259 2978 1 4 . 1 1 124 124 GLN N N 124 120.792 120.792 118.267 2.525 25259 2979 1 4 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.167 0.267 25259 2980 1 4 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.777 -2.694 25259 2981 1 4 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.916 -1.787 25259 2982 1 4 . 1 1 124 124 GLN H H 124 8.954 8.954 8.106 0.848 25259 2983 1 4 . 1 1 125 125 VAL N N 125 114.091 114.091 114.894 -0.803 25259 2984 1 4 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.288 0.121 25259 2985 1 4 . 1 1 125 125 VAL CA C 125 59.298 59.298 60.980 -1.682 25259 2986 1 4 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.418 -0.846 25259 2987 1 4 . 1 1 125 125 VAL H H 125 7.026 7.026 7.970 -0.944 25259 2988 1 4 . 1 1 126 126 LEU N N 126 125.158 125.158 122.930 2.228 25259 2989 1 4 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.527 -0.052 25259 2990 1 4 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.466 -1.291 25259 2991 1 4 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.241 -1.187 25259 2992 1 4 . 1 1 126 126 LEU H H 126 8.106 8.106 7.459 0.647 25259 2993 1 4 . 1 1 127 127 ASP N N 127 130.026 130.026 129.011 1.015 25259 2994 1 4 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.731 0.110 25259 2995 1 4 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.489 -3.291 25259 2996 1 4 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.222 -1.533 25259 2997 1 4 . 1 1 127 127 ASP H H 127 9.129 9.129 9.000 0.129 25259 2998 1 4 . 1 1 128 128 VAL N N 128 128.833 128.833 123.228 5.605 25259 2999 1 4 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.555 -0.031 25259 3000 1 4 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.466 -2.798 25259 3001 1 4 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.776 -2.280 25259 3002 1 4 . 1 1 128 128 VAL H H 128 8.288 8.288 7.844 0.444 25259 3003 1 4 . 1 1 129 129 LYS N N 129 123.914 123.914 118.931 4.983 25259 3004 1 4 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.026 0.017 25259 3005 1 4 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.837 -2.048 25259 3006 1 4 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.831 -2.894 25259 3007 1 4 . 1 1 129 129 LYS H H 129 8.226 8.226 8.161 0.065 25259 3008 1 4 . 1 1 130 130 LYS N N 130 121.888 121.888 117.116 4.772 25259 3009 1 4 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.240 -0.155 25259 3010 1 4 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.450 -1.304 25259 3011 1 4 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.967 -2.627 25259 3012 1 4 . 1 1 130 130 LYS H H 130 7.590 7.590 7.779 -0.189 25259 3013 1 4 . 1 1 131 131 ALA N N 131 123.088 123.088 122.431 0.657 25259 3014 1 4 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.172 -0.245 25259 3015 1 4 . 1 1 131 131 ALA CA C 131 52.402 52.402 54.825 -2.423 25259 3016 1 4 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.386 -1.939 25259 3017 1 4 . 1 1 131 131 ALA H H 131 8.506 8.506 8.381 0.125 25259 3018 1 4 . 1 1 132 132 SER N N 132 110.456 110.456 111.218 -0.762 25259 3019 1 4 . 1 1 132 132 SER HA H 132 4.117 4.117 4.209 -0.092 25259 3020 1 4 . 1 1 132 132 SER CA C 132 58.289 58.289 59.690 -1.401 25259 3021 1 4 . 1 1 132 132 SER CB C 132 61.034 61.034 63.362 -2.328 25259 3022 1 4 . 1 1 132 132 SER H H 132 7.986 7.986 7.760 0.226 25259 3023 1 4 . 1 1 133 133 GLN N N 133 119.034 119.034 118.402 0.632 25259 3024 1 4 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.605 -0.203 25259 3025 1 4 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.459 -1.934 25259 3026 1 4 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.332 -2.098 25259 3027 1 4 . 1 1 133 133 GLN H H 133 7.233 7.233 7.476 -0.243 25259 3028 1 4 . 1 1 134 134 LEU N N 134 123.291 123.291 120.199 3.092 25259 3029 1 4 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.576 -0.183 25259 3030 1 4 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.415 -1.099 25259 3031 1 4 . 1 1 134 134 LEU CB C 134 38.847 38.847 43.254 -4.407 25259 3032 1 4 . 1 1 134 134 LEU H H 134 7.411 7.411 7.186 0.225 25259 3033 1 4 . 1 1 135 135 GLU N N 135 128.446 128.446 121.211 7.235 25259 3034 1 4 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.972 -0.026 25259 3035 1 4 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.633 -2.248 25259 3036 1 4 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.994 -2.698 25259 3037 1 4 . 1 1 135 135 GLU H H 135 8.986 8.986 9.225 -0.239 25259 3038 1 4 . 1 1 136 136 HIS N N 136 117.593 117.593 118.971 -1.378 25259 3039 1 4 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.345 0.038 25259 3040 1 4 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.624 -1.940 25259 3041 1 4 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.772 -1.359 25259 3042 1 4 . 1 1 136 136 HIS H H 136 9.226 9.226 8.080 1.146 25259 3043 1 4 . 1 1 137 137 LEU N N 137 115.463 115.463 113.674 1.789 25259 3044 1 4 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.516 -0.009 25259 3045 1 4 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.649 -2.701 25259 3046 1 4 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.135 -2.328 25259 3047 1 4 . 1 1 137 137 LEU H H 137 7.090 7.090 8.214 -1.124 25259 3048 1 4 . 1 1 138 138 LYS N N 138 124.686 124.686 121.809 2.877 25259 3049 1 4 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.039 0.130 25259 3050 1 4 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.399 -1.241 25259 3051 1 4 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.330 -2.242 25259 3052 1 4 . 1 1 138 138 LYS H H 138 7.698 7.698 7.750 -0.052 25259 3053 1 4 . 1 1 139 139 ASN N N 139 118.077 118.077 114.988 3.089 25259 3054 1 4 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.623 0.050 25259 3055 1 4 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.696 -1.914 25259 3056 1 4 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.162 -2.345 25259 3057 1 4 . 1 1 139 139 ASN H H 139 8.485 8.485 7.905 0.580 25259 3058 1 4 . 1 1 140 140 ILE N N 140 120.880 120.880 119.807 1.073 25259 3059 1 4 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.302 -0.272 25259 3060 1 4 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.571 -1.005 25259 3061 1 4 . 1 1 140 140 ILE CB C 140 35.774 35.774 39.468 -3.694 25259 3062 1 4 . 1 1 140 140 ILE H H 140 7.549 7.549 7.269 0.280 25259 3063 1 4 . 1 1 141 141 GLY N N 141 110.676 110.676 114.383 -3.707 25259 3064 1 4 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.791 -0.127 25259 3065 1 4 . 1 1 141 141 GLY H H 141 7.663 7.663 8.722 -1.059 25259 3066 1 4 . 1 1 142 142 LEU N N 142 123.857 123.857 121.949 1.908 25259 3067 1 4 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.855 -0.162 25259 3068 1 4 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.070 -1.877 25259 3069 1 4 . 1 1 142 142 LEU CB C 142 40.609 40.609 42.029 -1.420 25259 3070 1 4 . 1 1 142 142 LEU H H 142 8.496 8.496 7.380 1.116 25259 3071 1 4 . 1 1 143 143 GLU N N 143 118.407 118.407 120.139 -1.732 25259 3072 1 4 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.960 -0.174 25259 3073 1 4 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.763 -2.541 25259 3074 1 4 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.034 -2.521 25259 3075 1 4 . 1 1 143 143 GLU H H 143 8.672 8.672 8.498 0.174 25259 3076 1 4 . 1 1 144 144 ASN N N 144 118.477 118.477 117.475 1.002 25259 3077 1 4 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.448 -0.006 25259 3078 1 4 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.849 -2.137 25259 3079 1 4 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.191 -2.236 25259 3080 1 4 . 1 1 144 144 ASN H H 144 7.656 7.656 8.366 -0.710 25259 3081 1 4 . 1 1 145 145 LEU N N 145 125.354 125.354 121.070 4.284 25259 3082 1 4 . 1 1 145 145 LEU HA H 145 3.797 3.797 4.000 -0.203 25259 3083 1 4 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.298 -0.975 25259 3084 1 4 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.042 -2.469 25259 3085 1 4 . 1 1 145 145 LEU H H 145 7.758 7.758 7.293 0.465 25259 3086 1 4 . 1 1 146 146 LEU N N 146 116.372 116.372 116.647 -0.275 25259 3087 1 4 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.778 0.098 25259 3088 1 4 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.928 -2.685 25259 3089 1 4 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.491 -2.594 25259 3090 1 4 . 1 1 146 146 LEU H H 146 7.242 7.242 7.320 -0.078 25259 3091 1 4 . 1 1 147 147 LYS N N 147 120.054 120.054 117.630 2.424 25259 3092 1 4 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.312 0.000 25259 3093 1 4 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.966 -1.343 25259 3094 1 4 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.017 -1.757 25259 3095 1 4 . 1 1 147 147 LYS H H 147 7.185 7.185 7.738 -0.553 25259 3096 1 4 . 1 1 148 148 ASN N N 148 119.498 119.498 117.663 1.835 25259 3097 1 4 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.901 0.061 25259 3098 1 4 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.536 -1.762 25259 3099 1 4 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.152 -0.666 25259 3100 1 4 . 1 1 148 148 ASN H H 148 7.698 7.698 7.624 0.074 25259 3101 1 4 . 1 1 149 149 GLU N N 149 122.834 122.834 118.429 4.405 25259 3102 1 4 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.339 0.262 25259 3103 1 4 . 1 1 149 149 GLU CA C 149 52.219 52.219 55.111 -2.892 25259 3104 1 4 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.520 -2.710 25259 3105 1 4 . 1 1 149 149 GLU H H 149 8.767 8.767 8.635 0.132 25259 3106 1 4 . 1 1 150 150 PRO HA H 150 3.608 3.608 3.087 0.521 25259 3107 1 4 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.507 -1.265 25259 3108 1 4 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.146 -3.051 25259 3109 1 4 . 1 1 151 151 SER N N 151 112.839 112.839 110.644 2.195 25259 3110 1 4 . 1 1 151 151 SER HA H 151 3.835 3.835 4.257 -0.422 25259 3111 1 4 . 1 1 151 151 SER CA C 151 59.270 59.270 59.098 0.172 25259 3112 1 4 . 1 1 151 151 SER CB C 151 59.451 59.451 62.839 -3.388 25259 3113 1 4 . 1 1 151 151 SER H H 151 8.519 8.519 8.330 0.189 25259 3114 1 4 . 1 1 152 152 LYS N N 152 126.710 126.710 124.297 2.413 25259 3115 1 4 . 1 1 152 152 LYS HA H 152 4.248 4.248 3.984 0.264 25259 3116 1 4 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.289 -3.524 25259 3117 1 4 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.219 -1.962 25259 3118 1 4 . 1 1 152 152 LYS H H 152 7.006 7.006 8.279 -1.273 25259 3119 1 4 . 1 1 153 153 TYR N N 153 123.239 123.239 115.176 8.063 25259 3120 1 4 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.589 -0.331 25259 3121 1 4 . 1 1 153 153 TYR CA C 153 59.309 59.309 57.245 2.064 25259 3122 1 4 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.931 -1.597 25259 3123 1 4 . 1 1 153 153 TYR H H 153 8.058 8.058 7.992 0.066 25259 3124 1 4 . 1 1 154 154 ILE N N 154 120.253 120.253 122.101 -1.848 25259 3125 1 4 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.222 0.151 25259 3126 1 4 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.315 -2.201 25259 3127 1 4 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.377 -1.429 25259 3128 1 4 . 1 1 154 154 ILE H H 154 8.193 8.193 7.667 0.526 25259 3129 1 4 . 1 1 155 155 SER N N 155 117.178 117.178 114.630 2.548 25259 3130 1 4 . 1 1 155 155 SER HA H 155 4.091 4.091 4.094 -0.003 25259 3131 1 4 . 1 1 155 155 SER CA C 155 59.961 59.961 61.671 -1.710 25259 3132 1 4 . 1 1 155 155 SER CB C 155 60.148 60.148 62.501 -2.353 25259 3133 1 4 . 1 1 155 155 SER H H 155 8.020 8.020 7.796 0.224 25259 3134 1 4 . 1 1 156 156 ASP N N 156 125.479 125.479 121.805 3.674 25259 3135 1 4 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.346 0.081 25259 3136 1 4 . 1 1 156 156 ASP CA C 156 54.760 54.760 57.204 -2.444 25259 3137 1 4 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.962 -3.089 25259 3138 1 4 . 1 1 156 156 ASP H H 156 8.638 8.638 7.779 0.859 25259 3139 1 4 . 1 1 157 157 ARG N N 157 121.542 121.542 119.784 1.758 25259 3140 1 4 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.004 0.107 25259 3141 1 4 . 1 1 157 157 ARG CA C 157 55.928 55.928 59.046 -3.118 25259 3142 1 4 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.870 -2.054 25259 3143 1 4 . 1 1 157 157 ARG H H 157 7.888 7.888 7.631 0.257 25259 3144 1 4 . 1 1 158 158 LEU N N 158 124.257 124.257 119.043 5.214 25259 3145 1 4 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.310 -0.039 25259 3146 1 4 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.692 -2.479 25259 3147 1 4 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.258 -2.313 25259 3148 1 4 . 1 1 158 158 LEU H H 158 8.442 8.442 7.620 0.822 25259 3149 1 4 . 1 1 159 159 ALA N N 159 124.146 124.146 121.347 2.799 25259 3150 1 4 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.100 0.232 25259 3151 1 4 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.607 -3.175 25259 3152 1 4 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.869 -2.962 25259 3153 1 4 . 1 1 159 159 ALA H H 159 8.086 8.086 8.256 -0.170 25259 3154 1 4 . 1 1 160 160 ASN N N 160 118.093 118.093 116.369 1.724 25259 3155 1 4 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.743 0.249 25259 3156 1 4 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.551 -1.974 25259 3157 1 4 . 1 1 160 160 ASN CB C 160 37.733 37.733 37.602 0.132 25259 3158 1 4 . 1 1 160 160 ASN H H 160 7.445 7.445 8.008 -0.563 25259 3159 1 4 . 1 1 161 161 GLY N N 161 108.365 108.365 106.310 2.055 25259 3160 1 4 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.538 -1.892 25259 3161 1 4 . 1 1 161 161 GLY H H 161 7.743 7.743 7.680 0.063 25259 3162 1 4 . 1 1 162 162 ALA N N 162 123.928 123.928 122.413 1.515 25259 3163 1 4 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.090 -0.217 25259 3164 1 4 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.094 -1.568 25259 3165 1 4 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.816 -3.756 25259 3166 1 4 . 1 1 162 162 ALA H H 162 8.035 8.035 7.608 0.427 25259 3167 1 4 . 1 1 163 163 THR N N 163 113.286 113.286 111.486 1.800 25259 3168 1 4 . 1 1 163 163 THR HA H 163 4.703 4.703 4.697 0.007 25259 3169 1 4 . 1 1 163 163 THR CA C 163 57.791 57.791 60.547 -2.756 25259 3170 1 4 . 1 1 163 163 THR CB C 163 68.974 68.974 71.398 -2.424 25259 3171 1 4 . 1 1 163 163 THR H H 163 8.451 8.451 8.807 -0.356 25259 3172 1 4 . 1 1 164 164 GLU N N 164 125.905 125.905 119.931 5.974 25259 3173 1 4 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.891 0.169 25259 3174 1 4 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.411 -0.826 25259 3175 1 4 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.306 -3.095 25259 3176 1 4 . 1 1 164 164 GLU H H 164 8.716 8.716 8.468 0.248 25259 3177 1 5 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.073 -0.398 25259 3178 1 5 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.521 -2.713 25259 3179 1 5 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.198 -3.128 25259 3180 1 5 . 1 1 3 3 ALA N N 3 126.741 126.741 122.245 4.496 25259 3181 1 5 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.561 -0.067 25259 3182 1 5 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.346 -1.144 25259 3183 1 5 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.737 -3.919 25259 3184 1 5 . 1 1 3 3 ALA H H 3 8.440 8.440 8.515 -0.075 25259 3185 1 5 . 1 1 4 4 THR N N 4 116.015 116.015 115.171 0.844 25259 3186 1 5 . 1 1 4 4 THR HA H 4 4.393 4.393 4.854 -0.461 25259 3187 1 5 . 1 1 4 4 THR CA C 4 59.148 59.148 61.894 -2.746 25259 3188 1 5 . 1 1 4 4 THR CB C 4 67.580 67.580 69.580 -2.000 25259 3189 1 5 . 1 1 4 4 THR H H 4 8.050 8.050 8.084 -0.034 25259 3190 1 5 . 1 1 5 5 LYS N N 5 126.350 126.350 120.244 6.106 25259 3191 1 5 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.534 -0.029 25259 3192 1 5 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.526 -1.609 25259 3193 1 5 . 1 1 5 5 LYS CB C 5 30.684 30.684 35.227 -4.543 25259 3194 1 5 . 1 1 5 5 LYS H H 5 8.332 8.332 8.345 -0.013 25259 3195 1 5 . 1 1 6 6 THR N N 6 118.124 118.124 114.419 3.705 25259 3196 1 5 . 1 1 6 6 THR HA H 6 4.440 4.440 4.515 -0.075 25259 3197 1 5 . 1 1 6 6 THR CA C 6 59.282 59.282 61.702 -2.420 25259 3198 1 5 . 1 1 6 6 THR CB C 6 67.685 67.685 69.155 -1.470 25259 3199 1 5 . 1 1 6 6 THR H H 6 8.283 8.283 8.297 -0.014 25259 3200 1 5 . 1 1 7 7 GLU N N 7 125.934 125.934 125.649 0.285 25259 3201 1 5 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.838 -0.494 25259 3202 1 5 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.318 -1.137 25259 3203 1 5 . 1 1 7 7 GLU CB C 7 27.816 27.816 31.019 -3.203 25259 3204 1 5 . 1 1 7 7 GLU H H 7 8.487 8.487 8.631 -0.144 25259 3205 1 5 . 1 1 8 8 LYS N N 8 123.945 123.945 120.194 3.751 25259 3206 1 5 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.616 -1.681 25259 3207 1 5 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.762 -3.197 25259 3208 1 5 . 1 1 8 8 LYS H H 8 8.278 8.278 8.297 -0.019 25259 3209 1 5 . 1 1 9 9 ASP N N 9 123.624 123.624 119.243 4.381 25259 3210 1 5 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.860 -0.521 25259 3211 1 5 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.952 -1.829 25259 3212 1 5 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.455 -3.522 25259 3213 1 5 . 1 1 9 9 ASP H H 9 8.277 8.277 8.380 -0.103 25259 3214 1 5 . 1 1 10 10 THR N N 10 116.812 116.812 114.998 1.814 25259 3215 1 5 . 1 1 10 10 THR HA H 10 4.349 4.349 4.604 -0.255 25259 3216 1 5 . 1 1 10 10 THR CA C 10 59.634 59.634 61.927 -2.293 25259 3217 1 5 . 1 1 10 10 THR CB C 10 67.254 67.254 70.243 -2.989 25259 3218 1 5 . 1 1 10 10 THR H H 10 8.049 8.049 8.313 -0.264 25259 3219 1 5 . 1 1 11 11 LEU N N 11 126.610 126.610 123.820 2.790 25259 3220 1 5 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.668 -0.276 25259 3221 1 5 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.668 -1.590 25259 3222 1 5 . 1 1 11 11 LEU CB C 11 39.633 39.633 44.238 -4.605 25259 3223 1 5 . 1 1 11 11 LEU H H 11 8.191 8.191 8.240 -0.049 25259 3224 1 5 . 1 1 12 12 GLN N N 12 123.274 123.274 121.708 1.566 25259 3225 1 5 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.405 -0.024 25259 3226 1 5 . 1 1 12 12 GLN CA C 12 53.574 53.574 56.639 -3.065 25259 3227 1 5 . 1 1 12 12 GLN CB C 12 26.803 26.803 29.219 -2.416 25259 3228 1 5 . 1 1 12 12 GLN H H 12 8.280 8.280 8.474 -0.194 25259 3229 1 5 . 1 1 13 13 SER N N 13 119.027 119.027 113.938 5.089 25259 3230 1 5 . 1 1 13 13 SER HA H 13 4.471 4.471 5.116 -0.645 25259 3231 1 5 . 1 1 13 13 SER CA C 13 55.869 55.869 57.456 -1.587 25259 3232 1 5 . 1 1 13 13 SER CB C 13 61.424 61.424 64.070 -2.646 25259 3233 1 5 . 1 1 13 13 SER H H 13 8.178 8.178 8.721 -0.543 25259 3234 1 5 . 1 1 14 14 ALA N N 14 128.314 128.314 124.275 4.039 25259 3235 1 5 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.811 -0.377 25259 3236 1 5 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.964 -2.268 25259 3237 1 5 . 1 1 14 14 ALA CB C 14 17.081 17.081 18.960 -1.879 25259 3238 1 5 . 1 1 14 14 ALA H H 14 8.195 8.195 8.687 -0.492 25259 3239 1 5 . 1 1 15 15 LEU N N 15 125.175 125.175 116.777 8.398 25259 3240 1 5 . 1 1 15 15 LEU HA H 15 4.640 4.640 5.000 -0.360 25259 3241 1 5 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.025 -2.421 25259 3242 1 5 . 1 1 15 15 LEU CB C 15 39.467 39.467 43.358 -3.890 25259 3243 1 5 . 1 1 15 15 LEU H H 15 8.050 8.050 8.615 -0.565 25259 3244 1 5 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.614 -0.110 25259 3245 1 5 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.940 -2.309 25259 3246 1 5 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.261 -2.603 25259 3247 1 5 . 1 1 17 17 VAL N N 17 123.223 123.223 116.739 6.484 25259 3248 1 5 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.314 -0.180 25259 3249 1 5 . 1 1 17 17 VAL CA C 17 59.827 59.827 60.545 -0.718 25259 3250 1 5 . 1 1 17 17 VAL CB C 17 30.377 30.377 33.051 -2.674 25259 3251 1 5 . 1 1 17 17 VAL H H 17 8.134 8.134 8.072 0.062 25259 3252 1 5 . 1 1 18 18 ILE N N 18 127.777 127.777 122.301 5.476 25259 3253 1 5 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.388 -0.145 25259 3254 1 5 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.347 -2.025 25259 3255 1 5 . 1 1 18 18 ILE CB C 18 36.254 36.254 38.174 -1.920 25259 3256 1 5 . 1 1 18 18 ILE H H 18 8.187 8.187 8.443 -0.256 25259 3257 1 5 . 1 1 19 19 GLU N N 19 128.148 128.148 123.726 4.422 25259 3258 1 5 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.700 -0.363 25259 3259 1 5 . 1 1 19 19 GLU CA C 19 54.091 54.091 56.080 -1.989 25259 3260 1 5 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.638 -4.462 25259 3261 1 5 . 1 1 19 19 GLU H H 19 8.475 8.475 8.513 -0.038 25259 3262 1 5 . 1 1 20 20 ASN N N 20 122.788 122.788 119.589 3.199 25259 3263 1 5 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.044 -0.349 25259 3264 1 5 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.916 -2.094 25259 3265 1 5 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.593 -4.227 25259 3266 1 5 . 1 1 20 20 ASN H H 20 8.477 8.477 8.487 -0.010 25259 3267 1 5 . 1 1 21 21 ALA N N 21 127.253 127.253 122.896 4.357 25259 3268 1 5 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.738 -0.417 25259 3269 1 5 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.343 -0.655 25259 3270 1 5 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.629 -3.716 25259 3271 1 5 . 1 1 21 21 ALA H H 21 8.325 8.325 8.221 0.104 25259 3272 1 5 . 1 1 22 22 GLU N N 22 122.044 122.044 120.232 1.812 25259 3273 1 5 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.220 0.073 25259 3274 1 5 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.925 -2.342 25259 3275 1 5 . 1 1 22 22 GLU CB C 22 27.285 27.285 27.686 -0.401 25259 3276 1 5 . 1 1 22 22 GLU H H 22 8.415 8.415 8.556 -0.141 25259 3277 1 5 . 1 1 23 23 LYS N N 23 123.622 123.622 121.207 2.415 25259 3278 1 5 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.567 -0.242 25259 3279 1 5 . 1 1 23 23 LYS CA C 23 54.496 54.496 54.679 -0.183 25259 3280 1 5 . 1 1 23 23 LYS CB C 23 30.653 30.653 34.659 -4.006 25259 3281 1 5 . 1 1 23 23 LYS H H 23 8.127 8.127 7.862 0.265 25259 3282 1 5 . 1 1 24 24 ASN N N 24 120.652 120.652 121.032 -0.380 25259 3283 1 5 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.990 -0.149 25259 3284 1 5 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.150 -2.487 25259 3285 1 5 . 1 1 24 24 ASN CB C 24 36.775 36.775 37.960 -1.185 25259 3286 1 5 . 1 1 24 24 ASN H H 24 8.424 8.424 8.716 -0.292 25259 3287 1 5 . 1 1 25 25 THR N N 25 117.102 117.102 114.334 2.768 25259 3288 1 5 . 1 1 25 25 THR HA H 25 4.367 4.367 4.406 -0.039 25259 3289 1 5 . 1 1 25 25 THR CA C 25 59.500 59.500 60.724 -1.224 25259 3290 1 5 . 1 1 25 25 THR CB C 25 67.610 67.610 70.912 -3.301 25259 3291 1 5 . 1 1 25 25 THR H H 25 7.852 7.852 7.677 0.175 25259 3292 1 5 . 1 1 26 26 VAL N N 26 126.491 126.491 125.346 1.145 25259 3293 1 5 . 1 1 26 26 VAL HA H 26 4.167 4.167 3.945 0.222 25259 3294 1 5 . 1 1 26 26 VAL CA C 26 60.193 60.193 62.459 -2.266 25259 3295 1 5 . 1 1 26 26 VAL CB C 26 29.605 29.605 30.389 -0.784 25259 3296 1 5 . 1 1 26 26 VAL H H 26 8.080 8.080 8.521 -0.441 25259 3297 1 5 . 1 1 27 27 VAL N N 27 132.992 132.992 129.497 3.495 25259 3298 1 5 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.116 -0.035 25259 3299 1 5 . 1 1 27 27 VAL CA C 27 58.984 58.984 62.149 -3.165 25259 3300 1 5 . 1 1 27 27 VAL CB C 27 31.540 31.540 31.419 0.121 25259 3301 1 5 . 1 1 27 27 VAL H H 27 8.830 8.830 8.371 0.459 25259 3302 1 5 . 1 1 28 28 THR N N 28 123.576 123.576 120.841 2.735 25259 3303 1 5 . 1 1 28 28 THR HA H 28 5.553 5.553 5.191 0.362 25259 3304 1 5 . 1 1 28 28 THR CA C 28 58.738 58.738 61.017 -2.280 25259 3305 1 5 . 1 1 28 28 THR CB C 28 68.443 68.443 71.247 -2.804 25259 3306 1 5 . 1 1 28 28 THR H H 28 8.165 8.165 8.127 0.038 25259 3307 1 5 . 1 1 29 29 LYS N N 29 129.099 129.099 123.615 5.484 25259 3308 1 5 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.720 0.222 25259 3309 1 5 . 1 1 29 29 LYS CA C 29 51.779 51.779 54.800 -3.021 25259 3310 1 5 . 1 1 29 29 LYS CB C 29 35.096 35.096 36.893 -1.797 25259 3311 1 5 . 1 1 29 29 LYS H H 29 9.273 9.273 9.103 0.170 25259 3312 1 5 . 1 1 30 30 THR N N 30 123.510 123.510 119.109 4.401 25259 3313 1 5 . 1 1 30 30 THR HA H 30 5.428 5.428 4.634 0.794 25259 3314 1 5 . 1 1 30 30 THR CA C 30 59.784 59.784 62.233 -2.449 25259 3315 1 5 . 1 1 30 30 THR CB C 30 67.818 67.818 70.279 -2.461 25259 3316 1 5 . 1 1 30 30 THR H H 30 8.993 8.993 8.481 0.512 25259 3317 1 5 . 1 1 31 31 LEU N N 31 128.293 128.293 125.393 2.900 25259 3318 1 5 . 1 1 31 31 LEU HA H 31 5.220 5.220 5.026 0.194 25259 3319 1 5 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.385 -3.330 25259 3320 1 5 . 1 1 31 31 LEU CB C 31 43.399 43.399 46.514 -3.115 25259 3321 1 5 . 1 1 31 31 LEU H H 31 9.557 9.557 8.291 1.266 25259 3322 1 5 . 1 1 32 32 VAL N N 32 126.919 126.919 120.004 6.915 25259 3323 1 5 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.409 0.042 25259 3324 1 5 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.383 -1.719 25259 3325 1 5 . 1 1 32 32 VAL CB C 32 29.449 29.449 32.301 -2.852 25259 3326 1 5 . 1 1 32 32 VAL H H 32 9.364 9.364 8.577 0.787 25259 3327 1 5 . 1 1 33 33 LEU N N 33 133.503 133.503 128.760 4.743 25259 3328 1 5 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.432 0.124 25259 3329 1 5 . 1 1 33 33 LEU CA C 33 52.004 52.004 54.164 -2.160 25259 3330 1 5 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.407 -4.560 25259 3331 1 5 . 1 1 33 33 LEU H H 33 8.587 8.587 8.181 0.406 25259 3332 1 5 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.447 0.034 25259 3333 1 5 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.368 -1.923 25259 3334 1 5 . 1 1 34 34 PRO CB C 34 29.565 29.565 31.921 -2.356 25259 3335 1 5 . 1 1 35 35 LYS N N 35 127.420 127.420 117.161 10.259 25259 3336 1 5 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.216 0.150 25259 3337 1 5 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.480 -2.361 25259 3338 1 5 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.389 -1.795 25259 3339 1 5 . 1 1 35 35 LYS H H 35 8.666 8.666 8.229 0.437 25259 3340 1 5 . 1 1 36 36 SER N N 36 122.222 122.222 115.294 6.928 25259 3341 1 5 . 1 1 36 36 SER HA H 36 4.753 4.753 4.448 0.305 25259 3342 1 5 . 1 1 36 36 SER CA C 36 55.328 55.328 58.863 -3.535 25259 3343 1 5 . 1 1 36 36 SER CB C 36 61.728 61.728 63.704 -1.976 25259 3344 1 5 . 1 1 36 36 SER H H 36 8.771 8.771 8.609 0.162 25259 3345 1 5 . 1 1 37 37 ASP N N 37 126.346 126.346 119.053 7.293 25259 3346 1 5 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.483 -0.029 25259 3347 1 5 . 1 1 37 37 ASP CA C 37 54.616 54.616 55.780 -1.164 25259 3348 1 5 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.525 -2.540 25259 3349 1 5 . 1 1 37 37 ASP H H 37 8.859 8.859 8.630 0.229 25259 3350 1 5 . 1 1 38 38 ASP N N 38 119.171 119.171 118.258 0.913 25259 3351 1 5 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.783 -0.168 25259 3352 1 5 . 1 1 38 38 ASP CA C 38 50.788 50.788 53.994 -3.206 25259 3353 1 5 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.213 -3.578 25259 3354 1 5 . 1 1 38 38 ASP H H 38 7.944 7.944 8.091 -0.147 25259 3355 1 5 . 1 1 39 39 GLY N N 39 110.352 110.352 109.881 0.471 25259 3356 1 5 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.486 -2.725 25259 3357 1 5 . 1 1 39 39 GLY H H 39 8.145 8.145 8.083 0.062 25259 3358 1 5 . 1 1 40 40 SER N N 40 120.090 120.090 115.350 4.740 25259 3359 1 5 . 1 1 40 40 SER HA H 40 4.877 4.877 4.616 0.261 25259 3360 1 5 . 1 1 40 40 SER CA C 40 56.525 56.525 57.984 -1.459 25259 3361 1 5 . 1 1 40 40 SER CB C 40 62.245 62.245 65.000 -2.755 25259 3362 1 5 . 1 1 40 40 SER H H 40 8.344 8.344 7.737 0.607 25259 3363 1 5 . 1 1 41 41 GLN N N 41 122.551 122.551 125.279 -2.728 25259 3364 1 5 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.636 0.291 25259 3365 1 5 . 1 1 41 41 GLN CA C 41 53.414 53.414 56.024 -2.610 25259 3366 1 5 . 1 1 41 41 GLN CB C 41 30.314 30.314 32.613 -2.299 25259 3367 1 5 . 1 1 41 41 GLN H H 41 8.627 8.627 8.181 0.446 25259 3368 1 5 . 1 1 42 42 GLN N N 42 131.724 131.724 122.908 8.816 25259 3369 1 5 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.693 0.918 25259 3370 1 5 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.543 -2.471 25259 3371 1 5 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.397 -2.078 25259 3372 1 5 . 1 1 42 42 GLN H H 42 9.189 9.189 8.555 0.634 25259 3373 1 5 . 1 1 43 43 THR N N 43 122.202 122.202 113.993 8.209 25259 3374 1 5 . 1 1 43 43 THR HA H 43 5.380 5.380 4.738 0.642 25259 3375 1 5 . 1 1 43 43 THR CA C 43 58.863 58.863 61.377 -2.514 25259 3376 1 5 . 1 1 43 43 THR CB C 43 68.893 68.893 71.959 -3.066 25259 3377 1 5 . 1 1 43 43 THR H H 43 9.139 9.139 8.051 1.088 25259 3378 1 5 . 1 1 44 44 GLN N N 44 127.190 127.190 122.317 4.873 25259 3379 1 5 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.292 0.342 25259 3380 1 5 . 1 1 44 44 GLN CA C 44 51.668 51.668 55.041 -3.373 25259 3381 1 5 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.827 -3.917 25259 3382 1 5 . 1 1 44 44 GLN H H 44 9.760 9.760 8.469 1.291 25259 3383 1 5 . 1 1 45 45 THR N N 45 123.479 123.479 120.051 3.428 25259 3384 1 5 . 1 1 45 45 THR HA H 45 5.421 5.421 4.906 0.515 25259 3385 1 5 . 1 1 45 45 THR CA C 45 60.071 60.071 62.485 -2.414 25259 3386 1 5 . 1 1 45 45 THR CB C 45 67.541 67.541 70.123 -2.582 25259 3387 1 5 . 1 1 45 45 THR H H 45 9.518 9.518 9.025 0.493 25259 3388 1 5 . 1 1 46 46 ILE N N 46 133.908 133.908 123.964 9.944 25259 3389 1 5 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.896 0.107 25259 3390 1 5 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.456 -1.986 25259 3391 1 5 . 1 1 46 46 ILE CB C 46 39.945 39.945 40.941 -0.996 25259 3392 1 5 . 1 1 46 46 ILE H H 46 9.830 9.830 9.220 0.610 25259 3393 1 5 . 1 1 47 47 THR N N 47 124.701 124.701 123.675 1.026 25259 3394 1 5 . 1 1 47 47 THR HA H 47 6.048 6.048 5.323 0.725 25259 3395 1 5 . 1 1 47 47 THR CA C 47 58.551 58.551 60.377 -1.826 25259 3396 1 5 . 1 1 47 47 THR CB C 47 67.819 67.819 69.729 -1.910 25259 3397 1 5 . 1 1 47 47 THR H H 47 8.843 8.843 8.820 0.023 25259 3398 1 5 . 1 1 48 48 TYR N N 48 127.369 127.369 120.159 7.210 25259 3399 1 5 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.201 0.077 25259 3400 1 5 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.646 -2.917 25259 3401 1 5 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.532 -2.099 25259 3402 1 5 . 1 1 48 48 TYR H H 48 9.638 9.638 8.503 1.135 25259 3403 1 5 . 1 1 49 49 LYS N N 49 122.138 122.138 116.193 5.945 25259 3404 1 5 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.696 -0.040 25259 3405 1 5 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.075 -3.103 25259 3406 1 5 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.934 -1.331 25259 3407 1 5 . 1 1 49 49 LYS H H 49 8.560 8.560 8.760 -0.200 25259 3408 1 5 . 1 1 50 50 ASP N N 50 130.208 130.208 121.601 8.607 25259 3409 1 5 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.802 -0.498 25259 3410 1 5 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.033 -0.273 25259 3411 1 5 . 1 1 50 50 ASP CB C 50 37.339 37.339 43.212 -5.873 25259 3412 1 5 . 1 1 50 50 ASP H H 50 9.597 9.597 8.647 0.950 25259 3413 1 5 . 1 1 51 51 LYS N N 51 124.586 124.586 118.341 6.245 25259 3414 1 5 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.457 0.074 25259 3415 1 5 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.117 -2.383 25259 3416 1 5 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.525 -4.130 25259 3417 1 5 . 1 1 51 51 LYS H H 51 8.450 8.450 8.260 0.190 25259 3418 1 5 . 1 1 52 52 THR N N 52 120.044 120.044 114.770 5.274 25259 3419 1 5 . 1 1 52 52 THR HA H 52 4.717 4.717 4.545 0.172 25259 3420 1 5 . 1 1 52 52 THR CA C 52 59.313 59.313 60.965 -1.652 25259 3421 1 5 . 1 1 52 52 THR CB C 52 68.815 68.815 71.177 -2.361 25259 3422 1 5 . 1 1 52 52 THR H H 52 8.658 8.658 7.781 0.877 25259 3423 1 5 . 1 1 53 53 PHE N N 53 128.987 128.987 124.387 4.600 25259 3424 1 5 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.687 -0.404 25259 3425 1 5 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.060 -1.071 25259 3426 1 5 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.795 0.516 25259 3427 1 5 . 1 1 53 53 PHE H H 53 9.218 9.218 8.694 0.524 25259 3428 1 5 . 1 1 54 54 LEU N N 54 124.874 124.874 126.078 -1.204 25259 3429 1 5 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.261 0.668 25259 3430 1 5 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.487 -3.246 25259 3431 1 5 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.761 -2.244 25259 3432 1 5 . 1 1 54 54 LEU H H 54 9.391 9.391 8.606 0.785 25259 3433 1 5 . 1 1 55 55 SER N N 55 115.516 115.516 108.890 6.626 25259 3434 1 5 . 1 1 55 55 SER HA H 55 5.194 5.194 4.818 0.376 25259 3435 1 5 . 1 1 55 55 SER CA C 55 55.818 55.818 57.385 -1.567 25259 3436 1 5 . 1 1 55 55 SER CB C 55 63.474 63.474 66.675 -3.201 25259 3437 1 5 . 1 1 55 55 SER H H 55 8.736 8.736 7.686 1.050 25259 3438 1 5 . 1 1 56 56 LEU N N 56 124.352 124.352 122.048 2.304 25259 3439 1 5 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.247 0.296 25259 3440 1 5 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.475 -2.838 25259 3441 1 5 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.129 -0.616 25259 3442 1 5 . 1 1 56 56 LEU H H 56 8.328 8.328 7.991 0.337 25259 3443 1 5 . 1 1 57 57 ALA N N 57 131.450 131.450 130.771 0.679 25259 3444 1 5 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.138 0.367 25259 3445 1 5 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.057 -1.855 25259 3446 1 5 . 1 1 57 57 ALA CB C 57 18.964 18.964 20.245 -1.281 25259 3447 1 5 . 1 1 57 57 ALA H H 57 9.208 9.208 8.279 0.929 25259 3448 1 5 . 1 1 58 58 ILE N N 58 126.248 126.248 126.498 -0.250 25259 3449 1 5 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.642 0.142 25259 3450 1 5 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.520 -2.273 25259 3451 1 5 . 1 1 58 58 ILE CB C 58 38.045 38.045 38.289 -0.245 25259 3452 1 5 . 1 1 58 58 ILE H H 58 9.597 9.597 9.104 0.493 25259 3453 1 5 . 1 1 59 59 GLN N N 59 132.065 132.065 127.459 4.606 25259 3454 1 5 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.771 0.476 25259 3455 1 5 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.918 -3.754 25259 3456 1 5 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.482 -0.821 25259 3457 1 5 . 1 1 59 59 GLN H H 59 9.389 9.389 8.923 0.466 25259 3458 1 5 . 1 1 60 60 GLN N N 60 130.314 130.314 120.042 10.272 25259 3459 1 5 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.644 0.565 25259 3460 1 5 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.588 -3.567 25259 3461 1 5 . 1 1 60 60 GLN CB C 60 29.476 29.476 32.878 -3.402 25259 3462 1 5 . 1 1 60 60 GLN H H 60 9.471 9.471 9.039 0.432 25259 3463 1 5 . 1 1 61 61 LYS N N 61 131.044 131.044 126.082 4.962 25259 3464 1 5 . 1 1 61 61 LYS HA H 61 5.415 5.415 4.964 0.451 25259 3465 1 5 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.503 -3.383 25259 3466 1 5 . 1 1 61 61 LYS CB C 61 32.417 32.417 34.903 -2.486 25259 3467 1 5 . 1 1 61 61 LYS H H 61 8.893 8.893 8.611 0.282 25259 3468 1 5 . 1 1 62 62 ARG N N 62 125.397 125.397 123.547 1.850 25259 3469 1 5 . 1 1 62 62 ARG HA H 62 5.003 5.003 4.954 0.049 25259 3470 1 5 . 1 1 62 62 ARG CA C 62 51.091 51.091 52.946 -1.855 25259 3471 1 5 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.661 -1.783 25259 3472 1 5 . 1 1 62 62 ARG H H 62 9.120 9.120 7.893 1.227 25259 3473 1 5 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.356 0.619 25259 3474 1 5 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.601 -3.104 25259 3475 1 5 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.223 -2.339 25259 3476 1 5 . 1 1 64 64 VAL N N 64 121.305 121.305 115.958 5.347 25259 3477 1 5 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.475 -0.451 25259 3478 1 5 . 1 1 64 64 VAL CA C 64 59.677 59.677 60.287 -0.610 25259 3479 1 5 . 1 1 64 64 VAL CB C 64 30.365 30.365 34.815 -4.450 25259 3480 1 5 . 1 1 64 64 VAL H H 64 7.520 7.520 8.072 -0.552 25259 3481 1 5 . 1 1 65 65 SER N N 65 123.215 123.215 116.833 6.382 25259 3482 1 5 . 1 1 65 65 SER HA H 65 4.521 4.521 4.694 -0.173 25259 3483 1 5 . 1 1 65 65 SER CA C 65 54.897 54.897 59.081 -4.184 25259 3484 1 5 . 1 1 65 65 SER CB C 65 62.564 62.564 64.176 -1.612 25259 3485 1 5 . 1 1 65 65 SER H H 65 8.080 8.080 8.614 -0.534 25259 3486 1 5 . 1 1 66 66 ASP N N 66 123.802 123.802 121.666 2.136 25259 3487 1 5 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.744 -0.315 25259 3488 1 5 . 1 1 66 66 ASP CA C 66 55.378 55.378 55.463 -0.085 25259 3489 1 5 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.089 -3.051 25259 3490 1 5 . 1 1 66 66 ASP H H 66 8.900 8.900 8.057 0.843 25259 3491 1 5 . 1 1 67 67 GLU N N 67 121.943 121.943 119.954 1.989 25259 3492 1 5 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.289 -0.100 25259 3493 1 5 . 1 1 67 67 GLU CA C 67 57.440 57.440 58.135 -0.695 25259 3494 1 5 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.979 -3.194 25259 3495 1 5 . 1 1 67 67 GLU H H 67 8.717 8.717 8.547 0.170 25259 3496 1 5 . 1 1 68 68 LEU N N 68 125.458 125.458 120.439 5.019 25259 3497 1 5 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.525 -0.182 25259 3498 1 5 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.449 -1.977 25259 3499 1 5 . 1 1 68 68 LEU CB C 68 39.404 39.404 42.173 -2.769 25259 3500 1 5 . 1 1 68 68 LEU H H 68 7.820 7.820 7.699 0.121 25259 3501 1 5 . 1 1 69 69 LYS N N 69 123.868 123.868 121.070 2.798 25259 3502 1 5 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.000 0.006 25259 3503 1 5 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.838 -2.221 25259 3504 1 5 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.951 -1.913 25259 3505 1 5 . 1 1 69 69 LYS H H 69 8.690 8.690 8.498 0.192 25259 3506 1 5 . 1 1 70 70 THR N N 70 117.109 117.109 114.797 2.312 25259 3507 1 5 . 1 1 70 70 THR HA H 70 4.088 4.088 4.146 -0.058 25259 3508 1 5 . 1 1 70 70 THR CA C 70 63.879 63.879 66.259 -2.380 25259 3509 1 5 . 1 1 70 70 THR CB C 70 66.383 66.383 68.929 -2.546 25259 3510 1 5 . 1 1 70 70 THR H H 70 7.935 7.935 7.566 0.369 25259 3511 1 5 . 1 1 71 71 TYR N N 71 127.006 127.006 123.892 3.114 25259 3512 1 5 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.250 -0.045 25259 3513 1 5 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.929 -1.704 25259 3514 1 5 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.171 -1.626 25259 3515 1 5 . 1 1 71 71 TYR H H 71 7.683 7.683 7.986 -0.303 25259 3516 1 5 . 1 1 72 72 ILE N N 72 125.064 125.064 118.815 6.249 25259 3517 1 5 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.768 -0.089 25259 3518 1 5 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.471 -2.576 25259 3519 1 5 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.939 -1.663 25259 3520 1 5 . 1 1 72 72 ILE H H 72 9.083 9.083 8.734 0.349 25259 3521 1 5 . 1 1 73 73 ASP N N 73 124.900 124.900 118.148 6.752 25259 3522 1 5 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.370 0.019 25259 3523 1 5 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.903 -1.865 25259 3524 1 5 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.813 -2.707 25259 3525 1 5 . 1 1 73 73 ASP H H 73 8.751 8.751 7.585 1.166 25259 3526 1 5 . 1 1 74 74 GLN N N 74 117.025 117.025 117.335 -0.310 25259 3527 1 5 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.909 0.229 25259 3528 1 5 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.021 -3.211 25259 3529 1 5 . 1 1 74 74 GLN CB C 74 27.564 27.564 28.860 -1.296 25259 3530 1 5 . 1 1 74 74 GLN H H 74 7.447 7.447 7.806 -0.359 25259 3531 1 5 . 1 1 75 75 HIS N N 75 116.494 116.494 113.371 3.123 25259 3532 1 5 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.688 0.028 25259 3533 1 5 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.962 -2.896 25259 3534 1 5 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.706 -4.404 25259 3535 1 5 . 1 1 75 75 HIS H H 75 8.402 8.402 8.073 0.329 25259 3536 1 5 . 1 1 76 76 GLY N N 76 112.564 112.564 105.701 6.863 25259 3537 1 5 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.780 -2.884 25259 3538 1 5 . 1 1 76 76 GLY H H 76 9.091 9.091 7.424 1.667 25259 3539 1 5 . 1 1 77 77 VAL N N 77 124.763 124.763 121.674 3.089 25259 3540 1 5 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.672 -0.107 25259 3541 1 5 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.842 -0.891 25259 3542 1 5 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.016 -2.178 25259 3543 1 5 . 1 1 77 77 VAL H H 77 8.927 8.927 8.624 0.303 25259 3544 1 5 . 1 1 78 78 GLU N N 78 124.388 124.388 117.751 6.637 25259 3545 1 5 . 1 1 78 78 GLU HA H 78 4.148 4.148 3.981 0.167 25259 3546 1 5 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.928 -1.612 25259 3547 1 5 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.412 -2.953 25259 3548 1 5 . 1 1 78 78 GLU H H 78 8.781 8.781 8.553 0.228 25259 3549 1 5 . 1 1 79 79 GLU N N 79 121.887 121.887 116.397 5.490 25259 3550 1 5 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.198 -0.010 25259 3551 1 5 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.916 -2.371 25259 3552 1 5 . 1 1 79 79 GLU CB C 79 27.033 27.033 28.380 -1.347 25259 3553 1 5 . 1 1 79 79 GLU H H 79 9.231 9.231 8.568 0.663 25259 3554 1 5 . 1 1 80 80 THR N N 80 120.781 120.781 116.444 4.337 25259 3555 1 5 . 1 1 80 80 THR HA H 80 4.059 4.059 3.918 0.141 25259 3556 1 5 . 1 1 80 80 THR CA C 80 65.487 65.487 66.508 -1.021 25259 3557 1 5 . 1 1 80 80 THR CB C 80 64.369 64.369 68.500 -4.131 25259 3558 1 5 . 1 1 80 80 THR H H 80 7.858 7.858 7.983 -0.125 25259 3559 1 5 . 1 1 81 81 GLN N N 81 125.303 125.303 121.100 4.203 25259 3560 1 5 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.864 0.180 25259 3561 1 5 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.233 -2.264 25259 3562 1 5 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.395 -2.318 25259 3563 1 5 . 1 1 81 81 GLN H H 81 8.765 8.765 7.687 1.078 25259 3564 1 5 . 1 1 82 82 LYS N N 82 120.458 120.458 119.192 1.266 25259 3565 1 5 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.951 0.138 25259 3566 1 5 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.661 -1.349 25259 3567 1 5 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.915 -1.761 25259 3568 1 5 . 1 1 82 82 LYS H H 82 7.521 7.521 7.404 0.117 25259 3569 1 5 . 1 1 83 83 ALA N N 83 125.234 125.234 119.812 5.422 25259 3570 1 5 . 1 1 83 83 ALA HA H 83 4.217 4.217 4.051 0.166 25259 3571 1 5 . 1 1 83 83 ALA CA C 83 52.442 52.442 53.810 -1.368 25259 3572 1 5 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.486 -2.199 25259 3573 1 5 . 1 1 83 83 ALA H H 83 7.782 7.782 7.761 0.021 25259 3574 1 5 . 1 1 84 84 LEU N N 84 123.348 123.348 117.424 5.924 25259 3575 1 5 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.988 0.070 25259 3576 1 5 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.258 -1.759 25259 3577 1 5 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.826 -2.518 25259 3578 1 5 . 1 1 84 84 LEU H H 84 8.590 8.590 7.328 1.262 25259 3579 1 5 . 1 1 85 85 LEU N N 85 122.872 122.872 117.744 5.128 25259 3580 1 5 . 1 1 85 85 LEU HA H 85 4.170 4.170 4.019 0.151 25259 3581 1 5 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.127 -1.731 25259 3582 1 5 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.695 -2.954 25259 3583 1 5 . 1 1 85 85 LEU H H 85 7.892 7.892 7.530 0.362 25259 3584 1 5 . 1 1 86 86 GLU N N 86 122.713 122.713 117.306 5.407 25259 3585 1 5 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.054 0.031 25259 3586 1 5 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.529 -1.784 25259 3587 1 5 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.915 -3.012 25259 3588 1 5 . 1 1 86 86 GLU H H 86 8.124 8.124 8.349 -0.225 25259 3589 1 5 . 1 1 87 87 ALA N N 87 123.163 123.163 122.469 0.694 25259 3590 1 5 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.070 0.071 25259 3591 1 5 . 1 1 87 87 ALA CA C 87 52.268 52.268 55.070 -2.802 25259 3592 1 5 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.223 -2.591 25259 3593 1 5 . 1 1 87 87 ALA H H 87 7.765 7.765 7.383 0.382 25259 3594 1 5 . 1 1 88 88 GLU N N 88 121.945 121.945 117.514 4.431 25259 3595 1 5 . 1 1 88 88 GLU HA H 88 4.084 4.084 3.882 0.202 25259 3596 1 5 . 1 1 88 88 GLU CA C 88 56.935 56.935 59.311 -2.376 25259 3597 1 5 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.317 -1.290 25259 3598 1 5 . 1 1 88 88 GLU H H 88 7.846 7.846 8.289 -0.443 25259 3599 1 5 . 1 1 89 89 GLU N N 89 117.978 117.978 115.900 2.078 25259 3600 1 5 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.149 -0.056 25259 3601 1 5 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.319 -3.105 25259 3602 1 5 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.568 -2.161 25259 3603 1 5 . 1 1 89 89 GLU H H 89 7.634 7.634 7.701 -0.067 25259 3604 1 5 . 1 1 90 90 LYS N N 90 117.519 117.519 116.821 0.698 25259 3605 1 5 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.382 0.049 25259 3606 1 5 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.880 -2.862 25259 3607 1 5 . 1 1 90 90 LYS CB C 90 31.031 31.031 33.349 -2.318 25259 3608 1 5 . 1 1 90 90 LYS H H 90 7.247 7.247 7.432 -0.185 25259 3609 1 5 . 1 1 91 91 ASP N N 91 124.888 124.888 122.924 1.964 25259 3610 1 5 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.638 0.045 25259 3611 1 5 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.370 -3.171 25259 3612 1 5 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.516 -2.935 25259 3613 1 5 . 1 1 91 91 ASP H H 91 7.370 7.370 7.993 -0.623 25259 3614 1 5 . 1 1 92 92 LYS N N 92 129.311 129.311 127.897 1.414 25259 3615 1 5 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.873 0.140 25259 3616 1 5 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.965 -2.749 25259 3617 1 5 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.456 -2.442 25259 3618 1 5 . 1 1 92 92 LYS H H 92 8.795 8.795 8.874 -0.079 25259 3619 1 5 . 1 1 93 93 SER N N 93 118.112 118.112 114.412 3.700 25259 3620 1 5 . 1 1 93 93 SER HA H 93 4.439 4.439 4.259 0.180 25259 3621 1 5 . 1 1 93 93 SER CA C 93 58.945 58.945 60.982 -2.037 25259 3622 1 5 . 1 1 93 93 SER CB C 93 60.278 60.278 63.197 -2.919 25259 3623 1 5 . 1 1 93 93 SER H H 93 8.488 8.488 8.015 0.473 25259 3624 1 5 . 1 1 94 94 ILE N N 94 128.950 128.950 123.382 5.568 25259 3625 1 5 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.433 0.049 25259 3626 1 5 . 1 1 94 94 ILE CA C 94 62.349 62.349 65.089 -2.740 25259 3627 1 5 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.698 -2.945 25259 3628 1 5 . 1 1 94 94 ILE H H 94 7.722 7.722 7.434 0.288 25259 3629 1 5 . 1 1 95 95 ILE N N 95 123.598 123.598 120.732 2.866 25259 3630 1 5 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.530 0.065 25259 3631 1 5 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.706 -2.959 25259 3632 1 5 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.686 -1.714 25259 3633 1 5 . 1 1 95 95 ILE H H 95 8.378 8.378 8.388 -0.010 25259 3634 1 5 . 1 1 96 96 GLU N N 96 118.317 118.317 117.231 1.086 25259 3635 1 5 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.998 -0.014 25259 3636 1 5 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.231 -2.736 25259 3637 1 5 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.586 -2.413 25259 3638 1 5 . 1 1 96 96 GLU H H 96 7.680 7.680 7.922 -0.242 25259 3639 1 5 . 1 1 97 97 ALA N N 97 124.797 124.797 122.772 2.025 25259 3640 1 5 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.830 -0.005 25259 3641 1 5 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.489 -2.192 25259 3642 1 5 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.577 -2.588 25259 3643 1 5 . 1 1 97 97 ALA H H 97 7.383 7.383 7.638 -0.255 25259 3644 1 5 . 1 1 98 98 ARG N N 98 115.469 115.469 114.292 1.177 25259 3645 1 5 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.275 0.031 25259 3646 1 5 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.526 -1.036 25259 3647 1 5 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.845 -1.607 25259 3648 1 5 . 1 1 98 98 ARG H H 98 8.229 8.229 7.978 0.251 25259 3649 1 5 . 1 1 99 99 LYS N N 99 120.219 120.219 117.832 2.387 25259 3650 1 5 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.284 -0.026 25259 3651 1 5 . 1 1 99 99 LYS CA C 99 55.241 55.241 56.273 -1.032 25259 3652 1 5 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.975 -2.479 25259 3653 1 5 . 1 1 99 99 LYS H H 99 7.270 7.270 7.296 -0.026 25259 3654 1 5 . 1 1 100 100 LEU N N 100 123.800 123.800 121.161 2.639 25259 3655 1 5 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.402 -0.061 25259 3656 1 5 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.116 -2.037 25259 3657 1 5 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.689 -3.558 25259 3658 1 5 . 1 1 100 100 LEU H H 100 7.837 7.837 7.835 0.002 25259 3659 1 5 . 1 1 101 101 ALA N N 101 130.512 130.512 126.633 3.879 25259 3660 1 5 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.354 0.022 25259 3661 1 5 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.762 -2.358 25259 3662 1 5 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.371 -2.575 25259 3663 1 5 . 1 1 101 101 ALA H H 101 8.213 8.213 8.736 -0.523 25259 3664 1 5 . 1 1 102 102 GLY N N 102 110.659 110.659 106.359 4.300 25259 3665 1 5 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.205 -1.312 25259 3666 1 5 . 1 1 102 102 GLY H H 102 8.738 8.738 7.510 1.228 25259 3667 1 5 . 1 1 103 103 PHE N N 103 123.097 123.097 121.294 1.803 25259 3668 1 5 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.348 -0.128 25259 3669 1 5 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.619 -2.851 25259 3670 1 5 . 1 1 103 103 PHE CB C 103 40.574 40.574 43.024 -2.450 25259 3671 1 5 . 1 1 103 103 PHE H H 103 7.514 7.514 7.554 -0.040 25259 3672 1 5 . 1 1 104 104 LYS N N 104 130.652 130.652 124.487 6.165 25259 3673 1 5 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.488 -0.368 25259 3674 1 5 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.374 -1.395 25259 3675 1 5 . 1 1 104 104 LYS CB C 104 34.237 34.237 37.093 -2.856 25259 3676 1 5 . 1 1 104 104 LYS H H 104 7.473 7.473 7.898 -0.425 25259 3677 1 5 . 1 1 105 105 LEU N N 105 127.372 127.372 122.730 4.642 25259 3678 1 5 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.813 0.183 25259 3679 1 5 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.389 -1.653 25259 3680 1 5 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.453 -1.489 25259 3681 1 5 . 1 1 105 105 LEU H H 105 8.393 8.393 8.191 0.202 25259 3682 1 5 . 1 1 106 106 GLU N N 106 129.358 129.358 125.484 3.874 25259 3683 1 5 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.711 0.133 25259 3684 1 5 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.883 -2.093 25259 3685 1 5 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.549 -1.921 25259 3686 1 5 . 1 1 106 106 GLU H H 106 8.849 8.849 8.911 -0.062 25259 3687 1 5 . 1 1 107 107 THR N N 107 131.118 131.118 117.065 14.053 25259 3688 1 5 . 1 1 107 107 THR HA H 107 5.110 5.110 4.800 0.310 25259 3689 1 5 . 1 1 107 107 THR CA C 107 59.832 59.832 60.520 -0.688 25259 3690 1 5 . 1 1 107 107 THR CB C 107 66.671 66.671 71.088 -4.417 25259 3691 1 5 . 1 1 107 107 THR H H 107 9.433 9.433 8.362 1.071 25259 3692 1 5 . 1 1 108 108 LYS N N 108 129.114 129.114 124.057 5.057 25259 3693 1 5 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.678 0.146 25259 3694 1 5 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.200 -3.006 25259 3695 1 5 . 1 1 108 108 LYS CB C 108 34.388 34.388 36.282 -1.894 25259 3696 1 5 . 1 1 108 108 LYS H H 108 9.410 9.410 8.949 0.461 25259 3697 1 5 . 1 1 109 109 LEU N N 109 129.323 129.323 125.235 4.088 25259 3698 1 5 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.491 0.213 25259 3699 1 5 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.521 -2.413 25259 3700 1 5 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.894 -3.239 25259 3701 1 5 . 1 1 109 109 LEU H H 109 8.862 8.862 8.415 0.447 25259 3702 1 5 . 1 1 110 110 LEU N N 110 129.123 129.123 128.478 0.645 25259 3703 1 5 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.218 0.005 25259 3704 1 5 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.887 -3.105 25259 3705 1 5 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.641 -1.980 25259 3706 1 5 . 1 1 110 110 LEU H H 110 8.373 8.373 8.585 -0.212 25259 3707 1 5 . 1 1 111 111 SER N N 111 114.587 114.587 109.801 4.786 25259 3708 1 5 . 1 1 111 111 SER HA H 111 4.557 4.557 4.552 0.005 25259 3709 1 5 . 1 1 111 111 SER CA C 111 53.889 53.889 57.881 -3.992 25259 3710 1 5 . 1 1 111 111 SER CB C 111 61.830 61.830 64.968 -3.138 25259 3711 1 5 . 1 1 111 111 SER H H 111 8.400 8.400 7.564 0.836 25259 3712 1 5 . 1 1 112 112 ALA N N 112 118.269 118.269 122.722 -4.453 25259 3713 1 5 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.247 0.062 25259 3714 1 5 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.441 -3.227 25259 3715 1 5 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.830 -2.242 25259 3716 1 5 . 1 1 112 112 ALA H H 112 8.556 8.556 8.520 0.036 25259 3717 1 5 . 1 1 113 113 THR N N 113 102.878 102.878 104.047 -1.169 25259 3718 1 5 . 1 1 113 113 THR HA H 113 4.662 4.662 4.425 0.237 25259 3719 1 5 . 1 1 113 113 THR CA C 113 58.689 58.689 61.259 -2.570 25259 3720 1 5 . 1 1 113 113 THR CB C 113 67.905 67.905 69.326 -1.421 25259 3721 1 5 . 1 1 113 113 THR H H 113 8.065 8.065 7.548 0.517 25259 3722 1 5 . 1 1 114 114 GLU N N 114 126.514 126.514 119.783 6.731 25259 3723 1 5 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.680 0.334 25259 3724 1 5 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.845 -2.838 25259 3725 1 5 . 1 1 114 114 GLU CB C 114 32.913 32.913 33.704 -0.791 25259 3726 1 5 . 1 1 114 114 GLU H H 114 7.357 7.357 7.735 -0.378 25259 3727 1 5 . 1 1 115 115 LEU N N 115 128.058 128.058 121.036 7.022 25259 3728 1 5 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.025 -0.103 25259 3729 1 5 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.810 -1.486 25259 3730 1 5 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.528 -1.389 25259 3731 1 5 . 1 1 115 115 LEU H H 115 8.930 8.930 8.105 0.825 25259 3732 1 5 . 1 1 116 116 GLN N N 116 126.540 126.540 118.898 7.642 25259 3733 1 5 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.311 0.404 25259 3734 1 5 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.369 -2.669 25259 3735 1 5 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.334 -1.042 25259 3736 1 5 . 1 1 116 116 GLN H H 116 9.221 9.221 8.958 0.263 25259 3737 1 5 . 1 1 117 117 THR N N 117 125.213 125.213 119.049 6.164 25259 3738 1 5 . 1 1 117 117 THR HA H 117 5.353 5.353 5.384 -0.031 25259 3739 1 5 . 1 1 117 117 THR CA C 117 58.926 58.926 61.074 -2.148 25259 3740 1 5 . 1 1 117 117 THR CB C 117 68.948 68.948 72.615 -3.667 25259 3741 1 5 . 1 1 117 117 THR H H 117 9.030 9.030 8.947 0.083 25259 3742 1 5 . 1 1 118 118 THR N N 118 127.799 127.799 118.592 9.207 25259 3743 1 5 . 1 1 118 118 THR HA H 118 5.527 5.527 5.175 0.352 25259 3744 1 5 . 1 1 118 118 THR CA C 118 59.201 59.201 61.840 -2.639 25259 3745 1 5 . 1 1 118 118 THR CB C 118 67.721 67.721 72.181 -4.460 25259 3746 1 5 . 1 1 118 118 THR H H 118 9.459 9.459 9.027 0.432 25259 3747 1 5 . 1 1 119 119 THR N N 119 129.258 129.258 121.018 8.240 25259 3748 1 5 . 1 1 119 119 THR HA H 119 4.885 4.885 4.648 0.237 25259 3749 1 5 . 1 1 119 119 THR CA C 119 58.463 58.463 61.116 -2.653 25259 3750 1 5 . 1 1 119 119 THR CB C 119 67.459 67.459 70.790 -3.331 25259 3751 1 5 . 1 1 119 119 THR H H 119 9.147 9.147 8.903 0.244 25259 3752 1 5 . 1 1 120 120 SER N N 120 123.389 123.389 122.245 1.144 25259 3753 1 5 . 1 1 120 120 SER HA H 120 5.328 5.328 4.950 0.378 25259 3754 1 5 . 1 1 120 120 SER CA C 120 54.386 54.386 57.262 -2.876 25259 3755 1 5 . 1 1 120 120 SER CB C 120 63.031 63.031 64.355 -1.324 25259 3756 1 5 . 1 1 120 120 SER H H 120 8.786 8.786 8.451 0.335 25259 3757 1 5 . 1 1 121 121 PHE N N 121 121.245 121.245 124.701 -3.456 25259 3758 1 5 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.732 0.380 25259 3759 1 5 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.867 -3.675 25259 3760 1 5 . 1 1 121 121 PHE CB C 121 40.265 40.265 40.170 0.095 25259 3761 1 5 . 1 1 121 121 PHE H H 121 8.831 8.831 9.135 -0.304 25259 3762 1 5 . 1 1 122 122 ASP N N 122 124.765 124.765 125.284 -0.519 25259 3763 1 5 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.930 -0.090 25259 3764 1 5 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.637 -3.800 25259 3765 1 5 . 1 1 122 122 ASP CB C 122 38.485 38.485 41.510 -3.025 25259 3766 1 5 . 1 1 122 122 ASP H H 122 8.819 8.819 8.868 -0.049 25259 3767 1 5 . 1 1 123 123 PHE N N 123 124.303 124.303 123.133 1.170 25259 3768 1 5 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.485 0.189 25259 3769 1 5 . 1 1 123 123 PHE CA C 123 57.798 57.798 58.581 -0.783 25259 3770 1 5 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.298 -2.758 25259 3771 1 5 . 1 1 123 123 PHE H H 123 8.262 8.262 8.127 0.135 25259 3772 1 5 . 1 1 124 124 GLN N N 124 120.792 120.792 117.606 3.186 25259 3773 1 5 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.360 0.074 25259 3774 1 5 . 1 1 124 124 GLN CA C 124 56.083 56.083 57.417 -1.335 25259 3775 1 5 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.931 -1.802 25259 3776 1 5 . 1 1 124 124 GLN H H 124 8.954 8.954 8.746 0.208 25259 3777 1 5 . 1 1 125 125 VAL N N 125 114.091 114.091 111.473 2.618 25259 3778 1 5 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.348 0.061 25259 3779 1 5 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.219 -2.921 25259 3780 1 5 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.426 -0.854 25259 3781 1 5 . 1 1 125 125 VAL H H 125 7.026 7.026 7.608 -0.582 25259 3782 1 5 . 1 1 126 126 LEU N N 126 125.158 125.158 124.338 0.820 25259 3783 1 5 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.364 0.111 25259 3784 1 5 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.321 -2.146 25259 3785 1 5 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.854 -0.800 25259 3786 1 5 . 1 1 126 126 LEU H H 126 8.106 8.106 7.952 0.154 25259 3787 1 5 . 1 1 127 127 ASP N N 127 130.026 130.026 128.771 1.255 25259 3788 1 5 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.617 0.224 25259 3789 1 5 . 1 1 127 127 ASP CA C 127 50.198 50.198 55.369 -5.171 25259 3790 1 5 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.190 -2.501 25259 3791 1 5 . 1 1 127 127 ASP H H 127 9.129 9.129 8.757 0.372 25259 3792 1 5 . 1 1 128 128 VAL N N 128 128.833 128.833 124.408 4.425 25259 3793 1 5 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.589 -0.065 25259 3794 1 5 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.238 -2.570 25259 3795 1 5 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.708 -2.213 25259 3796 1 5 . 1 1 128 128 VAL H H 128 8.288 8.288 7.786 0.502 25259 3797 1 5 . 1 1 129 129 LYS N N 129 123.914 123.914 119.756 4.158 25259 3798 1 5 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.000 0.043 25259 3799 1 5 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.849 -2.059 25259 3800 1 5 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.575 -2.638 25259 3801 1 5 . 1 1 129 129 LYS H H 129 8.226 8.226 8.255 -0.029 25259 3802 1 5 . 1 1 130 130 LYS N N 130 121.888 121.888 117.783 4.105 25259 3803 1 5 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.182 -0.097 25259 3804 1 5 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.977 -1.831 25259 3805 1 5 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.788 -2.448 25259 3806 1 5 . 1 1 130 130 LYS H H 130 7.590 7.590 7.690 -0.100 25259 3807 1 5 . 1 1 131 131 ALA N N 131 123.088 123.088 123.107 -0.019 25259 3808 1 5 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.020 -0.093 25259 3809 1 5 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.285 -2.883 25259 3810 1 5 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.247 -1.800 25259 3811 1 5 . 1 1 131 131 ALA H H 131 8.506 8.506 8.219 0.287 25259 3812 1 5 . 1 1 132 132 SER N N 132 110.456 110.456 112.043 -1.587 25259 3813 1 5 . 1 1 132 132 SER HA H 132 4.117 4.117 4.249 -0.132 25259 3814 1 5 . 1 1 132 132 SER CA C 132 58.289 58.289 58.924 -0.635 25259 3815 1 5 . 1 1 132 132 SER CB C 132 61.034 61.034 62.778 -1.744 25259 3816 1 5 . 1 1 132 132 SER H H 132 7.986 7.986 7.697 0.289 25259 3817 1 5 . 1 1 133 133 GLN N N 133 119.034 119.034 118.231 0.803 25259 3818 1 5 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.398 0.004 25259 3819 1 5 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.345 -1.820 25259 3820 1 5 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.526 -2.292 25259 3821 1 5 . 1 1 133 133 GLN H H 133 7.233 7.233 7.838 -0.605 25259 3822 1 5 . 1 1 134 134 LEU N N 134 123.291 123.291 120.833 2.458 25259 3823 1 5 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.524 -0.131 25259 3824 1 5 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.289 -0.973 25259 3825 1 5 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.820 -3.973 25259 3826 1 5 . 1 1 134 134 LEU H H 134 7.411 7.411 7.490 -0.079 25259 3827 1 5 . 1 1 135 135 GLU N N 135 128.446 128.446 125.778 2.668 25259 3828 1 5 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.860 0.086 25259 3829 1 5 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.660 -2.276 25259 3830 1 5 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.708 -2.412 25259 3831 1 5 . 1 1 135 135 GLU H H 135 8.986 8.986 9.120 -0.134 25259 3832 1 5 . 1 1 136 136 HIS N N 136 117.593 117.593 114.712 2.881 25259 3833 1 5 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.451 -0.068 25259 3834 1 5 . 1 1 136 136 HIS CA C 136 56.685 56.685 57.994 -1.309 25259 3835 1 5 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.184 -0.771 25259 3836 1 5 . 1 1 136 136 HIS H H 136 9.226 9.226 8.577 0.649 25259 3837 1 5 . 1 1 137 137 LEU N N 137 115.463 115.463 118.745 -3.282 25259 3838 1 5 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.642 -0.135 25259 3839 1 5 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.162 -2.214 25259 3840 1 5 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.663 -2.856 25259 3841 1 5 . 1 1 137 137 LEU H H 137 7.090 7.090 7.674 -0.584 25259 3842 1 5 . 1 1 138 138 LYS N N 138 124.686 124.686 121.143 3.543 25259 3843 1 5 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.062 0.107 25259 3844 1 5 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.512 -1.354 25259 3845 1 5 . 1 1 138 138 LYS CB C 138 30.088 30.088 31.958 -1.870 25259 3846 1 5 . 1 1 138 138 LYS H H 138 7.698 7.698 7.721 -0.023 25259 3847 1 5 . 1 1 139 139 ASN N N 139 118.077 118.077 113.338 4.739 25259 3848 1 5 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.699 -0.026 25259 3849 1 5 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.433 -1.651 25259 3850 1 5 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.829 -3.012 25259 3851 1 5 . 1 1 139 139 ASN H H 139 8.485 8.485 8.328 0.157 25259 3852 1 5 . 1 1 140 140 ILE N N 140 120.880 120.880 120.042 0.838 25259 3853 1 5 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.359 -0.329 25259 3854 1 5 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.258 -0.692 25259 3855 1 5 . 1 1 140 140 ILE CB C 140 35.774 35.774 39.303 -3.529 25259 3856 1 5 . 1 1 140 140 ILE H H 140 7.549 7.549 7.789 -0.240 25259 3857 1 5 . 1 1 141 141 GLY N N 141 110.676 110.676 115.543 -4.867 25259 3858 1 5 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.339 0.325 25259 3859 1 5 . 1 1 141 141 GLY H H 141 7.663 7.663 8.910 -1.247 25259 3860 1 5 . 1 1 142 142 LEU N N 142 123.857 123.857 123.660 0.197 25259 3861 1 5 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.729 -0.036 25259 3862 1 5 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.292 -2.099 25259 3863 1 5 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.301 -0.692 25259 3864 1 5 . 1 1 142 142 LEU H H 142 8.496 8.496 7.520 0.976 25259 3865 1 5 . 1 1 143 143 GLU N N 143 118.407 118.407 116.352 2.055 25259 3866 1 5 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.754 0.032 25259 3867 1 5 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.935 -1.713 25259 3868 1 5 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.784 -2.271 25259 3869 1 5 . 1 1 143 143 GLU H H 143 8.672 8.672 8.560 0.112 25259 3870 1 5 . 1 1 144 144 ASN N N 144 118.477 118.477 115.071 3.406 25259 3871 1 5 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.680 -0.238 25259 3872 1 5 . 1 1 144 144 ASN CA C 144 52.712 52.712 52.961 -0.249 25259 3873 1 5 . 1 1 144 144 ASN CB C 144 35.955 35.955 39.583 -3.628 25259 3874 1 5 . 1 1 144 144 ASN H H 144 7.656 7.656 7.654 0.002 25259 3875 1 5 . 1 1 145 145 LEU N N 145 125.354 125.354 121.426 3.928 25259 3876 1 5 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.834 -0.037 25259 3877 1 5 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.342 -1.019 25259 3878 1 5 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.135 -2.562 25259 3879 1 5 . 1 1 145 145 LEU H H 145 7.758 7.758 7.338 0.420 25259 3880 1 5 . 1 1 146 146 LEU N N 146 116.372 116.372 118.215 -1.843 25259 3881 1 5 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.931 -0.055 25259 3882 1 5 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.569 -2.326 25259 3883 1 5 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.126 -1.229 25259 3884 1 5 . 1 1 146 146 LEU H H 146 7.242 7.242 7.538 -0.296 25259 3885 1 5 . 1 1 147 147 LYS N N 147 120.054 120.054 118.017 2.037 25259 3886 1 5 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.506 -0.194 25259 3887 1 5 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.172 -0.549 25259 3888 1 5 . 1 1 147 147 LYS CB C 147 30.260 30.260 33.479 -3.219 25259 3889 1 5 . 1 1 147 147 LYS H H 147 7.185 7.185 8.219 -1.034 25259 3890 1 5 . 1 1 148 148 ASN N N 148 119.498 119.498 117.227 2.271 25259 3891 1 5 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.866 0.096 25259 3892 1 5 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.260 -2.486 25259 3893 1 5 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.755 -1.269 25259 3894 1 5 . 1 1 148 148 ASN H H 148 7.698 7.698 7.590 0.108 25259 3895 1 5 . 1 1 149 149 GLU N N 149 122.834 122.834 118.053 4.781 25259 3896 1 5 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.373 0.228 25259 3897 1 5 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.495 -2.276 25259 3898 1 5 . 1 1 149 149 GLU CB C 149 26.810 26.810 28.640 -1.830 25259 3899 1 5 . 1 1 149 149 GLU H H 149 8.767 8.767 8.704 0.063 25259 3900 1 5 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.976 0.632 25259 3901 1 5 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.400 -1.158 25259 3902 1 5 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.141 -3.046 25259 3903 1 5 . 1 1 151 151 SER N N 151 112.839 112.839 110.717 2.122 25259 3904 1 5 . 1 1 151 151 SER HA H 151 3.835 3.835 4.541 -0.706 25259 3905 1 5 . 1 1 151 151 SER CA C 151 59.270 59.270 58.456 0.814 25259 3906 1 5 . 1 1 151 151 SER CB C 151 59.451 59.451 63.145 -3.694 25259 3907 1 5 . 1 1 151 151 SER H H 151 8.519 8.519 7.838 0.681 25259 3908 1 5 . 1 1 152 152 LYS N N 152 126.710 126.710 123.257 3.453 25259 3909 1 5 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.097 0.151 25259 3910 1 5 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.806 -4.041 25259 3911 1 5 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.776 -2.519 25259 3912 1 5 . 1 1 152 152 LYS H H 152 7.006 7.006 7.510 -0.504 25259 3913 1 5 . 1 1 153 153 TYR N N 153 123.239 123.239 117.373 5.866 25259 3914 1 5 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.376 -0.118 25259 3915 1 5 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.857 0.452 25259 3916 1 5 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.248 -0.914 25259 3917 1 5 . 1 1 153 153 TYR H H 153 8.058 8.058 8.578 -0.520 25259 3918 1 5 . 1 1 154 154 ILE N N 154 120.253 120.253 120.930 -0.677 25259 3919 1 5 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.189 0.184 25259 3920 1 5 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.075 -1.961 25259 3921 1 5 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.163 -1.214 25259 3922 1 5 . 1 1 154 154 ILE H H 154 8.193 8.193 7.780 0.413 25259 3923 1 5 . 1 1 155 155 SER N N 155 117.178 117.178 115.119 2.059 25259 3924 1 5 . 1 1 155 155 SER HA H 155 4.091 4.091 4.025 0.066 25259 3925 1 5 . 1 1 155 155 SER CA C 155 59.961 59.961 61.681 -1.720 25259 3926 1 5 . 1 1 155 155 SER CB C 155 60.148 60.148 62.816 -2.668 25259 3927 1 5 . 1 1 155 155 SER H H 155 8.020 8.020 7.763 0.257 25259 3928 1 5 . 1 1 156 156 ASP N N 156 125.479 125.479 120.830 4.649 25259 3929 1 5 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.451 -0.024 25259 3930 1 5 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.575 -1.815 25259 3931 1 5 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.839 -2.966 25259 3932 1 5 . 1 1 156 156 ASP H H 156 8.638 8.638 7.422 1.216 25259 3933 1 5 . 1 1 157 157 ARG N N 157 121.542 121.542 119.721 1.821 25259 3934 1 5 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.000 0.111 25259 3935 1 5 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.835 -2.907 25259 3936 1 5 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.877 -2.061 25259 3937 1 5 . 1 1 157 157 ARG H H 157 7.888 7.888 8.036 -0.148 25259 3938 1 5 . 1 1 158 158 LEU N N 158 124.257 124.257 118.899 5.358 25259 3939 1 5 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.328 -0.057 25259 3940 1 5 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.687 -2.474 25259 3941 1 5 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.918 -1.973 25259 3942 1 5 . 1 1 158 158 LEU H H 158 8.442 8.442 7.765 0.677 25259 3943 1 5 . 1 1 159 159 ALA N N 159 124.146 124.146 120.030 4.116 25259 3944 1 5 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.140 0.192 25259 3945 1 5 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.124 -2.692 25259 3946 1 5 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.951 -3.044 25259 3947 1 5 . 1 1 159 159 ALA H H 159 8.086 8.086 7.347 0.739 25259 3948 1 5 . 1 1 160 160 ASN N N 160 118.093 118.093 117.277 0.816 25259 3949 1 5 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.582 0.410 25259 3950 1 5 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.980 -2.403 25259 3951 1 5 . 1 1 160 160 ASN CB C 160 37.733 37.733 37.470 0.263 25259 3952 1 5 . 1 1 160 160 ASN H H 160 7.445 7.445 8.212 -0.767 25259 3953 1 5 . 1 1 161 161 GLY N N 161 108.365 108.365 106.181 2.184 25259 3954 1 5 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.804 -2.158 25259 3955 1 5 . 1 1 161 161 GLY H H 161 7.743 7.743 8.361 -0.618 25259 3956 1 5 . 1 1 162 162 ALA N N 162 123.928 123.928 120.449 3.479 25259 3957 1 5 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.163 -0.290 25259 3958 1 5 . 1 1 162 162 ALA CA C 162 49.526 49.526 50.904 -1.378 25259 3959 1 5 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.737 -3.677 25259 3960 1 5 . 1 1 162 162 ALA H H 162 8.035 8.035 7.458 0.577 25259 3961 1 5 . 1 1 163 163 THR N N 163 113.286 113.286 110.532 2.754 25259 3962 1 5 . 1 1 163 163 THR HA H 163 4.703 4.703 4.694 0.009 25259 3963 1 5 . 1 1 163 163 THR CA C 163 57.791 57.791 60.188 -2.397 25259 3964 1 5 . 1 1 163 163 THR CB C 163 68.974 68.974 71.217 -2.243 25259 3965 1 5 . 1 1 163 163 THR H H 163 8.451 8.451 8.427 0.024 25259 3966 1 5 . 1 1 164 164 GLU N N 164 125.905 125.905 119.419 6.486 25259 3967 1 5 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.873 0.187 25259 3968 1 5 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.609 -1.024 25259 3969 1 5 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.277 -3.066 25259 3970 1 5 . 1 1 164 164 GLU H H 164 8.716 8.716 8.474 0.242 25259 3971 1 6 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.133 -0.458 25259 3972 1 6 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.184 -2.377 25259 3973 1 6 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.169 -3.099 25259 3974 1 6 . 1 1 3 3 ALA N N 3 126.741 126.741 121.899 4.842 25259 3975 1 6 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.486 0.008 25259 3976 1 6 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.314 -1.112 25259 3977 1 6 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.663 -3.845 25259 3978 1 6 . 1 1 3 3 ALA H H 3 8.440 8.440 8.322 0.118 25259 3979 1 6 . 1 1 4 4 THR N N 4 116.015 116.015 114.961 1.054 25259 3980 1 6 . 1 1 4 4 THR HA H 4 4.393 4.393 4.390 0.003 25259 3981 1 6 . 1 1 4 4 THR CA C 4 59.148 59.148 62.165 -3.017 25259 3982 1 6 . 1 1 4 4 THR CB C 4 67.580 67.580 69.249 -1.669 25259 3983 1 6 . 1 1 4 4 THR H H 4 8.050 8.050 8.209 -0.159 25259 3984 1 6 . 1 1 5 5 LYS N N 5 126.350 126.350 120.793 5.557 25259 3985 1 6 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.714 -0.209 25259 3986 1 6 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.230 -1.313 25259 3987 1 6 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.780 -4.096 25259 3988 1 6 . 1 1 5 5 LYS H H 5 8.332 8.332 8.314 0.018 25259 3989 1 6 . 1 1 6 6 THR N N 6 118.124 118.124 113.562 4.562 25259 3990 1 6 . 1 1 6 6 THR HA H 6 4.440 4.440 4.559 -0.119 25259 3991 1 6 . 1 1 6 6 THR CA C 6 59.282 59.282 62.005 -2.723 25259 3992 1 6 . 1 1 6 6 THR CB C 6 67.685 67.685 70.091 -2.405 25259 3993 1 6 . 1 1 6 6 THR H H 6 8.283 8.283 8.355 -0.072 25259 3994 1 6 . 1 1 7 7 GLU N N 7 125.934 125.934 125.661 0.273 25259 3995 1 6 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.591 -0.247 25259 3996 1 6 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.812 -1.631 25259 3997 1 6 . 1 1 7 7 GLU CB C 7 27.816 27.816 30.371 -2.555 25259 3998 1 6 . 1 1 7 7 GLU H H 7 8.487 8.487 8.503 -0.016 25259 3999 1 6 . 1 1 8 8 LYS N N 8 123.945 123.945 120.129 3.816 25259 4000 1 6 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.558 -1.623 25259 4001 1 6 . 1 1 8 8 LYS CB C 8 30.565 30.565 32.753 -2.188 25259 4002 1 6 . 1 1 8 8 LYS H H 8 8.278 8.278 8.245 0.033 25259 4003 1 6 . 1 1 9 9 ASP N N 9 123.624 123.624 120.067 3.557 25259 4004 1 6 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.818 -0.479 25259 4005 1 6 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.303 -1.179 25259 4006 1 6 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.355 -3.422 25259 4007 1 6 . 1 1 9 9 ASP H H 9 8.277 8.277 8.405 -0.128 25259 4008 1 6 . 1 1 10 10 THR N N 10 116.812 116.812 114.121 2.691 25259 4009 1 6 . 1 1 10 10 THR HA H 10 4.349 4.349 4.624 -0.275 25259 4010 1 6 . 1 1 10 10 THR CA C 10 59.634 59.634 61.952 -2.318 25259 4011 1 6 . 1 1 10 10 THR CB C 10 67.254 67.254 69.179 -1.925 25259 4012 1 6 . 1 1 10 10 THR H H 10 8.049 8.049 8.193 -0.144 25259 4013 1 6 . 1 1 11 11 LEU N N 11 126.610 126.610 124.484 2.126 25259 4014 1 6 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.435 -0.043 25259 4015 1 6 . 1 1 11 11 LEU CA C 11 53.078 53.078 55.247 -2.169 25259 4016 1 6 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.547 -2.914 25259 4017 1 6 . 1 1 11 11 LEU H H 11 8.191 8.191 8.200 -0.009 25259 4018 1 6 . 1 1 12 12 GLN N N 12 123.274 123.274 119.883 3.391 25259 4019 1 6 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.761 -0.379 25259 4020 1 6 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.831 -1.257 25259 4021 1 6 . 1 1 12 12 GLN CB C 12 26.803 26.803 30.691 -3.888 25259 4022 1 6 . 1 1 12 12 GLN H H 12 8.280 8.280 8.676 -0.396 25259 4023 1 6 . 1 1 13 13 SER N N 13 119.027 119.027 115.769 3.258 25259 4024 1 6 . 1 1 13 13 SER HA H 13 4.471 4.471 4.542 -0.071 25259 4025 1 6 . 1 1 13 13 SER CA C 13 55.869 55.869 58.026 -2.157 25259 4026 1 6 . 1 1 13 13 SER CB C 13 61.424 61.424 63.739 -2.314 25259 4027 1 6 . 1 1 13 13 SER H H 13 8.178 8.178 8.806 -0.628 25259 4028 1 6 . 1 1 14 14 ALA N N 14 128.314 128.314 125.057 3.257 25259 4029 1 6 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.740 -0.306 25259 4030 1 6 . 1 1 14 14 ALA CA C 14 49.696 49.696 52.070 -2.374 25259 4031 1 6 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.448 -2.367 25259 4032 1 6 . 1 1 14 14 ALA H H 14 8.195 8.195 8.506 -0.311 25259 4033 1 6 . 1 1 15 15 LEU N N 15 125.175 125.175 120.220 4.955 25259 4034 1 6 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.824 -0.184 25259 4035 1 6 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.569 -2.966 25259 4036 1 6 . 1 1 15 15 LEU CB C 15 39.467 39.467 43.349 -3.882 25259 4037 1 6 . 1 1 15 15 LEU H H 15 8.050 8.050 8.760 -0.710 25259 4038 1 6 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.672 -0.168 25259 4039 1 6 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.853 -2.222 25259 4040 1 6 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.297 -2.639 25259 4041 1 6 . 1 1 17 17 VAL N N 17 123.223 123.223 117.104 6.119 25259 4042 1 6 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.334 -0.200 25259 4043 1 6 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.460 -1.633 25259 4044 1 6 . 1 1 17 17 VAL CB C 17 30.377 30.377 32.760 -2.383 25259 4045 1 6 . 1 1 17 17 VAL H H 17 8.134 8.134 8.048 0.086 25259 4046 1 6 . 1 1 18 18 ILE N N 18 127.777 127.777 121.195 6.582 25259 4047 1 6 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.483 -0.240 25259 4048 1 6 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.558 -3.236 25259 4049 1 6 . 1 1 18 18 ILE CB C 18 36.254 36.254 38.317 -2.063 25259 4050 1 6 . 1 1 18 18 ILE H H 18 8.187 8.187 8.398 -0.211 25259 4051 1 6 . 1 1 19 19 GLU N N 19 128.148 128.148 122.233 5.915 25259 4052 1 6 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.516 -0.179 25259 4053 1 6 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.843 -1.752 25259 4054 1 6 . 1 1 19 19 GLU CB C 19 28.176 28.176 30.561 -2.385 25259 4055 1 6 . 1 1 19 19 GLU H H 19 8.475 8.475 8.344 0.131 25259 4056 1 6 . 1 1 20 20 ASN N N 20 122.788 122.788 117.156 5.632 25259 4057 1 6 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.009 -0.314 25259 4058 1 6 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.613 -1.791 25259 4059 1 6 . 1 1 20 20 ASN CB C 20 36.366 36.366 39.807 -3.442 25259 4060 1 6 . 1 1 20 20 ASN H H 20 8.477 8.477 8.557 -0.080 25259 4061 1 6 . 1 1 21 21 ALA N N 21 127.253 127.253 122.732 4.521 25259 4062 1 6 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.478 -0.157 25259 4063 1 6 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.797 -1.109 25259 4064 1 6 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.837 -3.924 25259 4065 1 6 . 1 1 21 21 ALA H H 21 8.325 8.325 8.258 0.067 25259 4066 1 6 . 1 1 22 22 GLU N N 22 122.044 122.044 120.969 1.075 25259 4067 1 6 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.545 -0.252 25259 4068 1 6 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.264 -1.681 25259 4069 1 6 . 1 1 22 22 GLU CB C 22 27.285 27.285 29.835 -2.550 25259 4070 1 6 . 1 1 22 22 GLU H H 22 8.415 8.415 8.540 -0.125 25259 4071 1 6 . 1 1 23 23 LYS N N 23 123.622 123.622 123.716 -0.094 25259 4072 1 6 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.601 -0.276 25259 4073 1 6 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.564 -1.068 25259 4074 1 6 . 1 1 23 23 LYS CB C 23 30.653 30.653 33.692 -3.039 25259 4075 1 6 . 1 1 23 23 LYS H H 23 8.127 8.127 8.554 -0.427 25259 4076 1 6 . 1 1 24 24 ASN N N 24 120.652 120.652 117.924 2.728 25259 4077 1 6 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.946 -0.105 25259 4078 1 6 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.201 -1.538 25259 4079 1 6 . 1 1 24 24 ASN CB C 24 36.775 36.775 40.211 -3.436 25259 4080 1 6 . 1 1 24 24 ASN H H 24 8.424 8.424 8.417 0.007 25259 4081 1 6 . 1 1 25 25 THR N N 25 117.102 117.102 116.112 0.990 25259 4082 1 6 . 1 1 25 25 THR HA H 25 4.367 4.367 4.360 0.007 25259 4083 1 6 . 1 1 25 25 THR CA C 25 59.500 59.500 62.733 -3.233 25259 4084 1 6 . 1 1 25 25 THR CB C 25 67.610 67.610 69.681 -2.071 25259 4085 1 6 . 1 1 25 25 THR H H 25 7.852 7.852 8.385 -0.533 25259 4086 1 6 . 1 1 26 26 VAL N N 26 126.491 126.491 121.808 4.683 25259 4087 1 6 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.320 -0.153 25259 4088 1 6 . 1 1 26 26 VAL CA C 26 60.193 60.193 59.975 0.218 25259 4089 1 6 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.421 -4.816 25259 4090 1 6 . 1 1 26 26 VAL H H 26 8.080 8.080 8.050 0.030 25259 4091 1 6 . 1 1 27 27 VAL N N 27 132.992 132.992 126.447 6.545 25259 4092 1 6 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.300 -0.219 25259 4093 1 6 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.870 -1.886 25259 4094 1 6 . 1 1 27 27 VAL CB C 27 31.540 31.540 34.266 -2.725 25259 4095 1 6 . 1 1 27 27 VAL H H 27 8.830 8.830 8.810 0.020 25259 4096 1 6 . 1 1 28 28 THR N N 28 123.576 123.576 121.454 2.122 25259 4097 1 6 . 1 1 28 28 THR HA H 28 5.553 5.553 4.814 0.739 25259 4098 1 6 . 1 1 28 28 THR CA C 28 58.738 58.738 60.967 -2.229 25259 4099 1 6 . 1 1 28 28 THR CB C 28 68.443 68.443 69.039 -0.596 25259 4100 1 6 . 1 1 28 28 THR H H 28 8.165 8.165 8.212 -0.047 25259 4101 1 6 . 1 1 29 29 LYS N N 29 129.099 129.099 127.947 1.152 25259 4102 1 6 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.658 0.284 25259 4103 1 6 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.812 -4.033 25259 4104 1 6 . 1 1 29 29 LYS CB C 29 35.096 35.096 33.905 1.191 25259 4105 1 6 . 1 1 29 29 LYS H H 29 9.273 9.273 8.811 0.462 25259 4106 1 6 . 1 1 30 30 THR N N 30 123.510 123.510 115.920 7.590 25259 4107 1 6 . 1 1 30 30 THR HA H 30 5.428 5.428 5.405 0.023 25259 4108 1 6 . 1 1 30 30 THR CA C 30 59.784 59.784 61.769 -1.985 25259 4109 1 6 . 1 1 30 30 THR CB C 30 67.818 67.818 71.910 -4.092 25259 4110 1 6 . 1 1 30 30 THR H H 30 8.993 8.993 8.465 0.528 25259 4111 1 6 . 1 1 31 31 LEU N N 31 128.293 128.293 124.147 4.146 25259 4112 1 6 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.985 0.235 25259 4113 1 6 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.780 -3.725 25259 4114 1 6 . 1 1 31 31 LEU CB C 31 43.399 43.399 46.103 -2.704 25259 4115 1 6 . 1 1 31 31 LEU H H 31 9.557 9.557 9.013 0.544 25259 4116 1 6 . 1 1 32 32 VAL N N 32 126.919 126.919 123.624 3.295 25259 4117 1 6 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.210 0.241 25259 4118 1 6 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.826 -2.162 25259 4119 1 6 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.892 -1.444 25259 4120 1 6 . 1 1 32 32 VAL H H 32 9.364 9.364 8.887 0.477 25259 4121 1 6 . 1 1 33 33 LEU N N 33 133.503 133.503 129.410 4.093 25259 4122 1 6 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.544 0.012 25259 4123 1 6 . 1 1 33 33 LEU CA C 33 52.004 52.004 52.743 -0.739 25259 4124 1 6 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.026 -4.179 25259 4125 1 6 . 1 1 33 33 LEU H H 33 8.587 8.587 7.829 0.758 25259 4126 1 6 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.383 0.098 25259 4127 1 6 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.389 -1.944 25259 4128 1 6 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.399 -2.834 25259 4129 1 6 . 1 1 35 35 LYS N N 35 127.420 127.420 118.530 8.890 25259 4130 1 6 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.250 0.116 25259 4131 1 6 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.098 -1.979 25259 4132 1 6 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.592 -1.998 25259 4133 1 6 . 1 1 35 35 LYS H H 35 8.666 8.666 8.484 0.182 25259 4134 1 6 . 1 1 36 36 SER N N 36 122.222 122.222 121.059 1.163 25259 4135 1 6 . 1 1 36 36 SER HA H 36 4.753 4.753 4.519 0.234 25259 4136 1 6 . 1 1 36 36 SER CA C 36 55.328 55.328 57.381 -2.053 25259 4137 1 6 . 1 1 36 36 SER CB C 36 61.728 61.728 61.782 -0.054 25259 4138 1 6 . 1 1 36 36 SER H H 36 8.771 8.771 8.725 0.046 25259 4139 1 6 . 1 1 37 37 ASP N N 37 126.346 126.346 121.914 4.432 25259 4140 1 6 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.360 0.094 25259 4141 1 6 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.025 -1.409 25259 4142 1 6 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.739 -2.754 25259 4143 1 6 . 1 1 37 37 ASP H H 37 8.859 8.859 8.049 0.810 25259 4144 1 6 . 1 1 38 38 ASP N N 38 119.171 119.171 116.768 2.403 25259 4145 1 6 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.741 -0.126 25259 4146 1 6 . 1 1 38 38 ASP CA C 38 50.788 50.788 53.940 -3.152 25259 4147 1 6 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.577 -3.942 25259 4148 1 6 . 1 1 38 38 ASP H H 38 7.944 7.944 7.863 0.081 25259 4149 1 6 . 1 1 39 39 GLY N N 39 110.352 110.352 107.828 2.524 25259 4150 1 6 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.374 -2.613 25259 4151 1 6 . 1 1 39 39 GLY H H 39 8.145 8.145 8.193 -0.048 25259 4152 1 6 . 1 1 40 40 SER N N 40 120.090 120.090 114.102 5.988 25259 4153 1 6 . 1 1 40 40 SER HA H 40 4.877 4.877 4.944 -0.067 25259 4154 1 6 . 1 1 40 40 SER CA C 40 56.525 56.525 57.145 -0.620 25259 4155 1 6 . 1 1 40 40 SER CB C 40 62.245 62.245 66.293 -4.048 25259 4156 1 6 . 1 1 40 40 SER H H 40 8.344 8.344 7.533 0.811 25259 4157 1 6 . 1 1 41 41 GLN N N 41 122.551 122.551 119.249 3.302 25259 4158 1 6 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.689 0.238 25259 4159 1 6 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.221 -1.807 25259 4160 1 6 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.045 -2.732 25259 4161 1 6 . 1 1 41 41 GLN H H 41 8.627 8.627 9.138 -0.511 25259 4162 1 6 . 1 1 42 42 GLN N N 42 131.724 131.724 116.601 15.123 25259 4163 1 6 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.649 0.962 25259 4164 1 6 . 1 1 42 42 GLN CA C 42 52.072 52.072 55.080 -3.008 25259 4165 1 6 . 1 1 42 42 GLN CB C 42 30.319 30.319 31.924 -1.605 25259 4166 1 6 . 1 1 42 42 GLN H H 42 9.189 9.189 8.709 0.480 25259 4167 1 6 . 1 1 43 43 THR N N 43 122.202 122.202 115.443 6.759 25259 4168 1 6 . 1 1 43 43 THR HA H 43 5.380 5.380 5.046 0.334 25259 4169 1 6 . 1 1 43 43 THR CA C 43 58.863 58.863 61.091 -2.228 25259 4170 1 6 . 1 1 43 43 THR CB C 43 68.893 68.893 72.370 -3.477 25259 4171 1 6 . 1 1 43 43 THR H H 43 9.139 9.139 7.959 1.180 25259 4172 1 6 . 1 1 44 44 GLN N N 44 127.190 127.190 121.674 5.516 25259 4173 1 6 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.202 0.432 25259 4174 1 6 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.776 -3.107 25259 4175 1 6 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.856 -3.946 25259 4176 1 6 . 1 1 44 44 GLN H H 44 9.760 9.760 8.996 0.764 25259 4177 1 6 . 1 1 45 45 THR N N 45 123.479 123.479 121.248 2.231 25259 4178 1 6 . 1 1 45 45 THR HA H 45 5.421 5.421 5.087 0.335 25259 4179 1 6 . 1 1 45 45 THR CA C 45 60.071 60.071 61.970 -1.899 25259 4180 1 6 . 1 1 45 45 THR CB C 45 67.541 67.541 70.216 -2.675 25259 4181 1 6 . 1 1 45 45 THR H H 45 9.518 9.518 9.146 0.372 25259 4182 1 6 . 1 1 46 46 ILE N N 46 133.908 133.908 128.655 5.253 25259 4183 1 6 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.713 0.290 25259 4184 1 6 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.684 -2.213 25259 4185 1 6 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.733 0.212 25259 4186 1 6 . 1 1 46 46 ILE H H 46 9.830 9.830 9.425 0.405 25259 4187 1 6 . 1 1 47 47 THR N N 47 124.701 124.701 124.337 0.364 25259 4188 1 6 . 1 1 47 47 THR HA H 47 6.048 6.048 5.078 0.970 25259 4189 1 6 . 1 1 47 47 THR CA C 47 58.551 58.551 62.106 -3.555 25259 4190 1 6 . 1 1 47 47 THR CB C 47 67.819 67.819 68.791 -0.972 25259 4191 1 6 . 1 1 47 47 THR H H 47 8.843 8.843 8.533 0.310 25259 4192 1 6 . 1 1 48 48 TYR N N 48 127.369 127.369 122.021 5.348 25259 4193 1 6 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.127 0.151 25259 4194 1 6 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.613 -2.884 25259 4195 1 6 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.703 -2.271 25259 4196 1 6 . 1 1 48 48 TYR H H 48 9.638 9.638 8.850 0.788 25259 4197 1 6 . 1 1 49 49 LYS N N 49 122.138 122.138 118.525 3.613 25259 4198 1 6 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.461 0.195 25259 4199 1 6 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.974 -3.002 25259 4200 1 6 . 1 1 49 49 LYS CB C 49 33.603 33.603 33.958 -0.355 25259 4201 1 6 . 1 1 49 49 LYS H H 49 8.560 8.560 8.908 -0.348 25259 4202 1 6 . 1 1 50 50 ASP N N 50 130.208 130.208 120.603 9.605 25259 4203 1 6 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.741 -0.437 25259 4204 1 6 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.320 -0.560 25259 4205 1 6 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.874 -5.535 25259 4206 1 6 . 1 1 50 50 ASP H H 50 9.597 9.597 8.537 1.060 25259 4207 1 6 . 1 1 51 51 LYS N N 51 124.586 124.586 117.131 7.455 25259 4208 1 6 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.340 0.191 25259 4209 1 6 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.349 -2.615 25259 4210 1 6 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.174 -3.779 25259 4211 1 6 . 1 1 51 51 LYS H H 51 8.450 8.450 8.082 0.368 25259 4212 1 6 . 1 1 52 52 THR N N 52 120.044 120.044 115.192 4.852 25259 4213 1 6 . 1 1 52 52 THR HA H 52 4.717 4.717 4.556 0.161 25259 4214 1 6 . 1 1 52 52 THR CA C 52 59.313 59.313 61.216 -1.903 25259 4215 1 6 . 1 1 52 52 THR CB C 52 68.815 68.815 71.546 -2.731 25259 4216 1 6 . 1 1 52 52 THR H H 52 8.658 8.658 7.713 0.945 25259 4217 1 6 . 1 1 53 53 PHE N N 53 128.987 128.987 124.345 4.642 25259 4218 1 6 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.581 -0.298 25259 4219 1 6 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.856 -0.868 25259 4220 1 6 . 1 1 53 53 PHE CB C 53 38.311 38.311 38.137 0.174 25259 4221 1 6 . 1 1 53 53 PHE H H 53 9.218 9.218 8.763 0.455 25259 4222 1 6 . 1 1 54 54 LEU N N 54 124.874 124.874 125.386 -0.512 25259 4223 1 6 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.412 0.517 25259 4224 1 6 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.774 -2.533 25259 4225 1 6 . 1 1 54 54 LEU CB C 54 40.517 40.517 41.937 -1.420 25259 4226 1 6 . 1 1 54 54 LEU H H 54 9.391 9.391 8.602 0.789 25259 4227 1 6 . 1 1 55 55 SER N N 55 115.516 115.516 108.861 6.655 25259 4228 1 6 . 1 1 55 55 SER HA H 55 5.194 5.194 4.986 0.208 25259 4229 1 6 . 1 1 55 55 SER CA C 55 55.818 55.818 57.747 -1.929 25259 4230 1 6 . 1 1 55 55 SER CB C 55 63.474 63.474 66.671 -3.197 25259 4231 1 6 . 1 1 55 55 SER H H 55 8.736 8.736 7.830 0.906 25259 4232 1 6 . 1 1 56 56 LEU N N 56 124.352 124.352 122.300 2.052 25259 4233 1 6 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.282 0.261 25259 4234 1 6 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.952 -3.315 25259 4235 1 6 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.517 -1.004 25259 4236 1 6 . 1 1 56 56 LEU H H 56 8.328 8.328 8.926 -0.598 25259 4237 1 6 . 1 1 57 57 ALA N N 57 131.450 131.450 130.644 0.806 25259 4238 1 6 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.154 0.351 25259 4239 1 6 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.103 -1.901 25259 4240 1 6 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.070 -2.106 25259 4241 1 6 . 1 1 57 57 ALA H H 57 9.208 9.208 9.185 0.023 25259 4242 1 6 . 1 1 58 58 ILE N N 58 126.248 126.248 126.921 -0.673 25259 4243 1 6 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.241 0.543 25259 4244 1 6 . 1 1 58 58 ILE CA C 58 58.247 58.247 62.240 -3.993 25259 4245 1 6 . 1 1 58 58 ILE CB C 58 38.045 38.045 37.915 0.130 25259 4246 1 6 . 1 1 58 58 ILE H H 58 9.597 9.597 8.295 1.302 25259 4247 1 6 . 1 1 59 59 GLN N N 59 132.065 132.065 127.897 4.168 25259 4248 1 6 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.512 0.735 25259 4249 1 6 . 1 1 59 59 GLN CA C 59 52.164 52.164 56.110 -3.946 25259 4250 1 6 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.463 -0.802 25259 4251 1 6 . 1 1 59 59 GLN H H 59 9.389 9.389 8.475 0.914 25259 4252 1 6 . 1 1 60 60 GLN N N 60 130.314 130.314 119.968 10.346 25259 4253 1 6 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.582 0.627 25259 4254 1 6 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.537 -3.516 25259 4255 1 6 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.315 -3.839 25259 4256 1 6 . 1 1 60 60 GLN H H 60 9.471 9.471 8.881 0.590 25259 4257 1 6 . 1 1 61 61 LYS N N 61 131.044 131.044 127.303 3.741 25259 4258 1 6 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.051 0.364 25259 4259 1 6 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.885 -2.765 25259 4260 1 6 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.985 -3.568 25259 4261 1 6 . 1 1 61 61 LYS H H 61 8.893 8.893 9.096 -0.203 25259 4262 1 6 . 1 1 62 62 ARG N N 62 125.397 125.397 124.514 0.883 25259 4263 1 6 . 1 1 62 62 ARG HA H 62 5.003 5.003 4.961 0.042 25259 4264 1 6 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.010 -1.919 25259 4265 1 6 . 1 1 62 62 ARG CB C 62 29.878 29.878 33.157 -3.279 25259 4266 1 6 . 1 1 62 62 ARG H H 62 9.120 9.120 8.561 0.559 25259 4267 1 6 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.592 0.383 25259 4268 1 6 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.694 -3.197 25259 4269 1 6 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.203 -2.319 25259 4270 1 6 . 1 1 64 64 VAL N N 64 121.305 121.305 116.481 4.824 25259 4271 1 6 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.221 -0.197 25259 4272 1 6 . 1 1 64 64 VAL CA C 64 59.677 59.677 61.129 -1.452 25259 4273 1 6 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.496 -2.131 25259 4274 1 6 . 1 1 64 64 VAL H H 64 7.520 7.520 7.842 -0.322 25259 4275 1 6 . 1 1 65 65 SER N N 65 123.215 123.215 113.199 10.016 25259 4276 1 6 . 1 1 65 65 SER HA H 65 4.521 4.521 4.723 -0.202 25259 4277 1 6 . 1 1 65 65 SER CA C 65 54.897 54.897 57.134 -2.237 25259 4278 1 6 . 1 1 65 65 SER CB C 65 62.564 62.564 66.320 -3.756 25259 4279 1 6 . 1 1 65 65 SER H H 65 8.080 8.080 8.157 -0.077 25259 4280 1 6 . 1 1 66 66 ASP N N 66 123.802 123.802 122.244 1.558 25259 4281 1 6 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.642 -0.213 25259 4282 1 6 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.711 -1.333 25259 4283 1 6 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.118 -3.080 25259 4284 1 6 . 1 1 66 66 ASP H H 66 8.900 8.900 8.833 0.067 25259 4285 1 6 . 1 1 67 67 GLU N N 67 121.943 121.943 120.637 1.306 25259 4286 1 6 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.054 0.135 25259 4287 1 6 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.678 -2.238 25259 4288 1 6 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.364 -2.579 25259 4289 1 6 . 1 1 67 67 GLU H H 67 8.717 8.717 8.586 0.131 25259 4290 1 6 . 1 1 68 68 LEU N N 68 125.458 125.458 119.430 6.028 25259 4291 1 6 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.219 0.124 25259 4292 1 6 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.555 -3.083 25259 4293 1 6 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.125 -1.721 25259 4294 1 6 . 1 1 68 68 LEU H H 68 7.820 7.820 7.968 -0.148 25259 4295 1 6 . 1 1 69 69 LYS N N 69 123.868 123.868 120.349 3.519 25259 4296 1 6 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.028 -0.022 25259 4297 1 6 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.848 -2.231 25259 4298 1 6 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.025 -1.988 25259 4299 1 6 . 1 1 69 69 LYS H H 69 8.690 8.690 8.361 0.329 25259 4300 1 6 . 1 1 70 70 THR N N 70 117.109 117.109 117.066 0.043 25259 4301 1 6 . 1 1 70 70 THR HA H 70 4.088 4.088 3.944 0.144 25259 4302 1 6 . 1 1 70 70 THR CA C 70 63.879 63.879 67.035 -3.156 25259 4303 1 6 . 1 1 70 70 THR CB C 70 66.383 66.383 68.905 -2.522 25259 4304 1 6 . 1 1 70 70 THR H H 70 7.935 7.935 7.848 0.087 25259 4305 1 6 . 1 1 71 71 TYR N N 71 127.006 127.006 122.993 4.013 25259 4306 1 6 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.197 0.008 25259 4307 1 6 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.980 -1.754 25259 4308 1 6 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.267 -1.722 25259 4309 1 6 . 1 1 71 71 TYR H H 71 7.683 7.683 7.901 -0.218 25259 4310 1 6 . 1 1 72 72 ILE N N 72 125.064 125.064 120.677 4.387 25259 4311 1 6 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.545 0.134 25259 4312 1 6 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.425 -2.530 25259 4313 1 6 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.992 -1.716 25259 4314 1 6 . 1 1 72 72 ILE H H 72 9.083 9.083 8.753 0.330 25259 4315 1 6 . 1 1 73 73 ASP N N 73 124.900 124.900 118.663 6.237 25259 4316 1 6 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.405 -0.016 25259 4317 1 6 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.778 -1.740 25259 4318 1 6 . 1 1 73 73 ASP CB C 73 38.107 38.107 41.027 -2.920 25259 4319 1 6 . 1 1 73 73 ASP H H 73 8.751 8.751 7.996 0.755 25259 4320 1 6 . 1 1 74 74 GLN N N 74 117.025 117.025 117.838 -0.813 25259 4321 1 6 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.058 0.080 25259 4322 1 6 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.210 -3.400 25259 4323 1 6 . 1 1 74 74 GLN CB C 74 27.564 27.564 28.956 -1.392 25259 4324 1 6 . 1 1 74 74 GLN H H 74 7.447 7.447 8.200 -0.753 25259 4325 1 6 . 1 1 75 75 HIS N N 75 116.494 116.494 115.019 1.475 25259 4326 1 6 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.515 0.201 25259 4327 1 6 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.737 -2.671 25259 4328 1 6 . 1 1 75 75 HIS CB C 75 28.302 28.302 31.681 -3.379 25259 4329 1 6 . 1 1 75 75 HIS H H 75 8.402 8.402 8.135 0.267 25259 4330 1 6 . 1 1 76 76 GLY N N 76 112.564 112.564 104.647 7.917 25259 4331 1 6 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.393 -2.497 25259 4332 1 6 . 1 1 76 76 GLY H H 76 9.091 9.091 7.410 1.681 25259 4333 1 6 . 1 1 77 77 VAL N N 77 124.763 124.763 120.992 3.771 25259 4334 1 6 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.635 -0.070 25259 4335 1 6 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.257 -0.306 25259 4336 1 6 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.199 -2.361 25259 4337 1 6 . 1 1 77 77 VAL H H 77 8.927 8.927 8.771 0.156 25259 4338 1 6 . 1 1 78 78 GLU N N 78 124.388 124.388 118.469 5.919 25259 4339 1 6 . 1 1 78 78 GLU HA H 78 4.148 4.148 3.955 0.193 25259 4340 1 6 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.280 -0.964 25259 4341 1 6 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.317 -1.858 25259 4342 1 6 . 1 1 78 78 GLU H H 78 8.781 8.781 8.359 0.422 25259 4343 1 6 . 1 1 79 79 GLU N N 79 121.887 121.887 119.562 2.325 25259 4344 1 6 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.283 -0.095 25259 4345 1 6 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.162 -2.617 25259 4346 1 6 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.726 -2.693 25259 4347 1 6 . 1 1 79 79 GLU H H 79 9.231 9.231 8.032 1.199 25259 4348 1 6 . 1 1 80 80 THR N N 80 120.781 120.781 116.527 4.254 25259 4349 1 6 . 1 1 80 80 THR HA H 80 4.059 4.059 4.168 -0.109 25259 4350 1 6 . 1 1 80 80 THR CA C 80 65.487 65.487 66.620 -1.133 25259 4351 1 6 . 1 1 80 80 THR CB C 80 64.369 64.369 68.292 -3.923 25259 4352 1 6 . 1 1 80 80 THR H H 80 7.858 7.858 8.470 -0.612 25259 4353 1 6 . 1 1 81 81 GLN N N 81 125.303 125.303 121.731 3.572 25259 4354 1 6 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.943 0.101 25259 4355 1 6 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.469 -2.500 25259 4356 1 6 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.503 -2.426 25259 4357 1 6 . 1 1 81 81 GLN H H 81 8.765 8.765 8.177 0.588 25259 4358 1 6 . 1 1 82 82 LYS N N 82 120.458 120.458 120.074 0.384 25259 4359 1 6 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.914 0.175 25259 4360 1 6 . 1 1 82 82 LYS CA C 82 57.312 57.312 59.495 -2.183 25259 4361 1 6 . 1 1 82 82 LYS CB C 82 30.154 30.154 32.180 -2.026 25259 4362 1 6 . 1 1 82 82 LYS H H 82 7.521 7.521 7.497 0.024 25259 4363 1 6 . 1 1 83 83 ALA N N 83 125.234 125.234 121.763 3.471 25259 4364 1 6 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.936 0.281 25259 4365 1 6 . 1 1 83 83 ALA CA C 83 52.442 52.442 55.154 -2.712 25259 4366 1 6 . 1 1 83 83 ALA CB C 83 15.287 15.287 18.188 -2.901 25259 4367 1 6 . 1 1 83 83 ALA H H 83 7.782 7.782 8.172 -0.390 25259 4368 1 6 . 1 1 84 84 LEU N N 84 123.348 123.348 118.149 5.199 25259 4369 1 6 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.898 0.160 25259 4370 1 6 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.860 -2.361 25259 4371 1 6 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.448 -2.140 25259 4372 1 6 . 1 1 84 84 LEU H H 84 8.590 8.590 7.837 0.753 25259 4373 1 6 . 1 1 85 85 LEU N N 85 122.872 122.872 117.361 5.511 25259 4374 1 6 . 1 1 85 85 LEU HA H 85 4.170 4.170 4.044 0.126 25259 4375 1 6 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.349 -1.953 25259 4376 1 6 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.604 -2.863 25259 4377 1 6 . 1 1 85 85 LEU H H 85 7.892 7.892 7.562 0.330 25259 4378 1 6 . 1 1 86 86 GLU N N 86 122.713 122.713 119.182 3.531 25259 4379 1 6 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.174 -0.089 25259 4380 1 6 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.203 -1.458 25259 4381 1 6 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.920 -3.017 25259 4382 1 6 . 1 1 86 86 GLU H H 86 8.124 8.124 8.552 -0.428 25259 4383 1 6 . 1 1 87 87 ALA N N 87 123.163 123.163 122.751 0.412 25259 4384 1 6 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.102 0.039 25259 4385 1 6 . 1 1 87 87 ALA CA C 87 52.268 52.268 55.033 -2.765 25259 4386 1 6 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.492 -2.860 25259 4387 1 6 . 1 1 87 87 ALA H H 87 7.765 7.765 7.541 0.224 25259 4388 1 6 . 1 1 88 88 GLU N N 88 121.945 121.945 117.532 4.413 25259 4389 1 6 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.044 0.040 25259 4390 1 6 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.684 -1.749 25259 4391 1 6 . 1 1 88 88 GLU CB C 88 28.027 28.027 28.988 -0.961 25259 4392 1 6 . 1 1 88 88 GLU H H 88 7.846 7.846 7.967 -0.121 25259 4393 1 6 . 1 1 89 89 GLU N N 89 117.978 117.978 118.610 -0.632 25259 4394 1 6 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.079 0.014 25259 4395 1 6 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.682 -3.468 25259 4396 1 6 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.276 -1.869 25259 4397 1 6 . 1 1 89 89 GLU H H 89 7.634 7.634 7.870 -0.236 25259 4398 1 6 . 1 1 90 90 LYS N N 90 117.519 117.519 114.953 2.566 25259 4399 1 6 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.489 -0.058 25259 4400 1 6 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.098 -2.080 25259 4401 1 6 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.659 -1.628 25259 4402 1 6 . 1 1 90 90 LYS H H 90 7.247 7.247 7.546 -0.299 25259 4403 1 6 . 1 1 91 91 ASP N N 91 124.888 124.888 123.307 1.581 25259 4404 1 6 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.576 0.107 25259 4405 1 6 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.218 -3.019 25259 4406 1 6 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.456 -2.875 25259 4407 1 6 . 1 1 91 91 ASP H H 91 7.370 7.370 7.612 -0.242 25259 4408 1 6 . 1 1 92 92 LYS N N 92 129.311 129.311 127.352 1.959 25259 4409 1 6 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.896 0.117 25259 4410 1 6 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.642 -2.426 25259 4411 1 6 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.536 -2.521 25259 4412 1 6 . 1 1 92 92 LYS H H 92 8.795 8.795 8.743 0.052 25259 4413 1 6 . 1 1 93 93 SER N N 93 118.112 118.112 114.319 3.793 25259 4414 1 6 . 1 1 93 93 SER HA H 93 4.439 4.439 4.167 0.272 25259 4415 1 6 . 1 1 93 93 SER CA C 93 58.945 58.945 61.506 -2.561 25259 4416 1 6 . 1 1 93 93 SER CB C 93 60.278 60.278 62.799 -2.521 25259 4417 1 6 . 1 1 93 93 SER H H 93 8.488 8.488 8.515 -0.027 25259 4418 1 6 . 1 1 94 94 ILE N N 94 128.950 128.950 122.908 6.042 25259 4419 1 6 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.769 -0.287 25259 4420 1 6 . 1 1 94 94 ILE CA C 94 62.349 62.349 62.987 -0.638 25259 4421 1 6 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.696 -2.943 25259 4422 1 6 . 1 1 94 94 ILE H H 94 7.722 7.722 7.043 0.679 25259 4423 1 6 . 1 1 95 95 ILE N N 95 123.598 123.598 120.549 3.049 25259 4424 1 6 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.488 0.107 25259 4425 1 6 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.875 -3.128 25259 4426 1 6 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.586 -1.614 25259 4427 1 6 . 1 1 95 95 ILE H H 95 8.378 8.378 7.924 0.454 25259 4428 1 6 . 1 1 96 96 GLU N N 96 118.317 118.317 117.786 0.531 25259 4429 1 6 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.995 -0.011 25259 4430 1 6 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.074 -2.579 25259 4431 1 6 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.050 -1.877 25259 4432 1 6 . 1 1 96 96 GLU H H 96 7.680 7.680 8.289 -0.609 25259 4433 1 6 . 1 1 97 97 ALA N N 97 124.797 124.797 120.933 3.864 25259 4434 1 6 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.950 -0.125 25259 4435 1 6 . 1 1 97 97 ALA CA C 97 52.297 52.297 53.796 -1.499 25259 4436 1 6 . 1 1 97 97 ALA CB C 97 14.989 14.989 18.548 -3.559 25259 4437 1 6 . 1 1 97 97 ALA H H 97 7.383 7.383 7.345 0.038 25259 4438 1 6 . 1 1 98 98 ARG N N 98 115.469 115.469 117.230 -1.761 25259 4439 1 6 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.287 0.019 25259 4440 1 6 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.206 -1.716 25259 4441 1 6 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.928 -1.690 25259 4442 1 6 . 1 1 98 98 ARG H H 98 8.229 8.229 8.310 -0.081 25259 4443 1 6 . 1 1 99 99 LYS N N 99 120.219 120.219 117.624 2.595 25259 4444 1 6 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.078 0.180 25259 4445 1 6 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.599 -2.357 25259 4446 1 6 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.315 -1.819 25259 4447 1 6 . 1 1 99 99 LYS H H 99 7.270 7.270 7.463 -0.193 25259 4448 1 6 . 1 1 100 100 LEU N N 100 123.800 123.800 119.807 3.993 25259 4449 1 6 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.277 0.064 25259 4450 1 6 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.673 -2.595 25259 4451 1 6 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.451 -3.320 25259 4452 1 6 . 1 1 100 100 LEU H H 100 7.837 7.837 7.658 0.179 25259 4453 1 6 . 1 1 101 101 ALA N N 101 130.512 130.512 125.825 4.687 25259 4454 1 6 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.450 -0.075 25259 4455 1 6 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.899 -2.495 25259 4456 1 6 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.693 -2.897 25259 4457 1 6 . 1 1 101 101 ALA H H 101 8.213 8.213 8.868 -0.655 25259 4458 1 6 . 1 1 102 102 GLY N N 102 110.659 110.659 105.484 5.175 25259 4459 1 6 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.106 -1.213 25259 4460 1 6 . 1 1 102 102 GLY H H 102 8.738 8.738 8.244 0.494 25259 4461 1 6 . 1 1 103 103 PHE N N 103 123.097 123.097 121.192 1.905 25259 4462 1 6 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.229 -0.009 25259 4463 1 6 . 1 1 103 103 PHE CA C 103 53.768 53.768 57.127 -3.359 25259 4464 1 6 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.550 -1.976 25259 4465 1 6 . 1 1 103 103 PHE H H 103 7.514 7.514 7.464 0.050 25259 4466 1 6 . 1 1 104 104 LYS N N 104 130.652 130.652 123.921 6.731 25259 4467 1 6 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.339 -0.219 25259 4468 1 6 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.878 -1.899 25259 4469 1 6 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.719 -2.482 25259 4470 1 6 . 1 1 104 104 LYS H H 104 7.473 7.473 7.555 -0.082 25259 4471 1 6 . 1 1 105 105 LEU N N 105 127.372 127.372 123.266 4.106 25259 4472 1 6 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.934 0.062 25259 4473 1 6 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.051 -2.315 25259 4474 1 6 . 1 1 105 105 LEU CB C 105 43.964 43.964 44.716 -0.752 25259 4475 1 6 . 1 1 105 105 LEU H H 105 8.393 8.393 8.208 0.185 25259 4476 1 6 . 1 1 106 106 GLU N N 106 129.358 129.358 127.166 2.192 25259 4477 1 6 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.758 0.086 25259 4478 1 6 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.802 -2.012 25259 4479 1 6 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.431 -1.803 25259 4480 1 6 . 1 1 106 106 GLU H H 106 8.849 8.849 8.305 0.544 25259 4481 1 6 . 1 1 107 107 THR N N 107 131.118 131.118 118.684 12.434 25259 4482 1 6 . 1 1 107 107 THR HA H 107 5.110 5.110 4.976 0.134 25259 4483 1 6 . 1 1 107 107 THR CA C 107 59.832 59.832 60.730 -0.898 25259 4484 1 6 . 1 1 107 107 THR CB C 107 66.671 66.671 70.871 -4.200 25259 4485 1 6 . 1 1 107 107 THR H H 107 9.433 9.433 8.401 1.032 25259 4486 1 6 . 1 1 108 108 LYS N N 108 129.114 129.114 124.801 4.313 25259 4487 1 6 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.608 0.216 25259 4488 1 6 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.523 -3.329 25259 4489 1 6 . 1 1 108 108 LYS CB C 108 34.388 34.388 36.296 -1.908 25259 4490 1 6 . 1 1 108 108 LYS H H 108 9.410 9.410 9.144 0.266 25259 4491 1 6 . 1 1 109 109 LEU N N 109 129.323 129.323 126.426 2.897 25259 4492 1 6 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.329 0.375 25259 4493 1 6 . 1 1 109 109 LEU CA C 109 52.108 52.108 55.181 -3.073 25259 4494 1 6 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.191 -2.537 25259 4495 1 6 . 1 1 109 109 LEU H H 109 8.862 8.862 8.642 0.220 25259 4496 1 6 . 1 1 110 110 LEU N N 110 129.123 129.123 128.235 0.888 25259 4497 1 6 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.152 0.071 25259 4498 1 6 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.707 -2.925 25259 4499 1 6 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.548 -1.887 25259 4500 1 6 . 1 1 110 110 LEU H H 110 8.373 8.373 8.713 -0.340 25259 4501 1 6 . 1 1 111 111 SER N N 111 114.587 114.587 110.508 4.079 25259 4502 1 6 . 1 1 111 111 SER HA H 111 4.557 4.557 4.553 0.004 25259 4503 1 6 . 1 1 111 111 SER CA C 111 53.889 53.889 57.746 -3.857 25259 4504 1 6 . 1 1 111 111 SER CB C 111 61.830 61.830 64.481 -2.651 25259 4505 1 6 . 1 1 111 111 SER H H 111 8.400 8.400 7.604 0.796 25259 4506 1 6 . 1 1 112 112 ALA N N 112 118.269 118.269 123.201 -4.932 25259 4507 1 6 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.346 -0.037 25259 4508 1 6 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.170 -2.956 25259 4509 1 6 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.652 -2.064 25259 4510 1 6 . 1 1 112 112 ALA H H 112 8.556 8.556 8.551 0.005 25259 4511 1 6 . 1 1 113 113 THR N N 113 102.878 102.878 102.685 0.193 25259 4512 1 6 . 1 1 113 113 THR HA H 113 4.662 4.662 4.443 0.219 25259 4513 1 6 . 1 1 113 113 THR CA C 113 58.689 58.689 61.320 -2.631 25259 4514 1 6 . 1 1 113 113 THR CB C 113 67.905 67.905 69.862 -1.957 25259 4515 1 6 . 1 1 113 113 THR H H 113 8.065 8.065 7.660 0.405 25259 4516 1 6 . 1 1 114 114 GLU N N 114 126.514 126.514 121.103 5.411 25259 4517 1 6 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.908 0.106 25259 4518 1 6 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.961 -1.954 25259 4519 1 6 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.696 -1.783 25259 4520 1 6 . 1 1 114 114 GLU H H 114 7.357 7.357 7.939 -0.582 25259 4521 1 6 . 1 1 115 115 LEU N N 115 128.058 128.058 118.718 9.340 25259 4522 1 6 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.389 -0.467 25259 4523 1 6 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.829 -1.505 25259 4524 1 6 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.451 -2.312 25259 4525 1 6 . 1 1 115 115 LEU H H 115 8.930 8.930 8.981 -0.051 25259 4526 1 6 . 1 1 116 116 GLN N N 116 126.540 126.540 118.703 7.837 25259 4527 1 6 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.301 0.414 25259 4528 1 6 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.465 -2.765 25259 4529 1 6 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.741 -1.449 25259 4530 1 6 . 1 1 116 116 GLN H H 116 9.221 9.221 9.226 -0.005 25259 4531 1 6 . 1 1 117 117 THR N N 117 125.213 125.213 119.487 5.726 25259 4532 1 6 . 1 1 117 117 THR HA H 117 5.353 5.353 5.352 0.001 25259 4533 1 6 . 1 1 117 117 THR CA C 117 58.926 58.926 61.062 -2.135 25259 4534 1 6 . 1 1 117 117 THR CB C 117 68.948 68.948 72.431 -3.483 25259 4535 1 6 . 1 1 117 117 THR H H 117 9.030 9.030 9.066 -0.036 25259 4536 1 6 . 1 1 118 118 THR N N 118 127.799 127.799 118.648 9.151 25259 4537 1 6 . 1 1 118 118 THR HA H 118 5.527 5.527 5.006 0.521 25259 4538 1 6 . 1 1 118 118 THR CA C 118 59.201 59.201 62.095 -2.894 25259 4539 1 6 . 1 1 118 118 THR CB C 118 67.721 67.721 71.625 -3.904 25259 4540 1 6 . 1 1 118 118 THR H H 118 9.459 9.459 8.725 0.734 25259 4541 1 6 . 1 1 119 119 THR N N 119 129.258 129.258 123.395 5.863 25259 4542 1 6 . 1 1 119 119 THR HA H 119 4.885 4.885 4.546 0.339 25259 4543 1 6 . 1 1 119 119 THR CA C 119 58.463 58.463 61.521 -3.058 25259 4544 1 6 . 1 1 119 119 THR CB C 119 67.459 67.459 68.711 -1.252 25259 4545 1 6 . 1 1 119 119 THR H H 119 9.147 9.147 8.994 0.153 25259 4546 1 6 . 1 1 120 120 SER N N 120 123.389 123.389 121.518 1.871 25259 4547 1 6 . 1 1 120 120 SER HA H 120 5.328 5.328 4.636 0.692 25259 4548 1 6 . 1 1 120 120 SER CA C 120 54.386 54.386 57.111 -2.725 25259 4549 1 6 . 1 1 120 120 SER CB C 120 63.031 63.031 63.961 -0.930 25259 4550 1 6 . 1 1 120 120 SER H H 120 8.786 8.786 7.817 0.969 25259 4551 1 6 . 1 1 121 121 PHE N N 121 121.245 121.245 124.618 -3.373 25259 4552 1 6 . 1 1 121 121 PHE HA H 121 5.112 5.112 5.004 0.108 25259 4553 1 6 . 1 1 121 121 PHE CA C 121 53.192 53.192 55.848 -2.656 25259 4554 1 6 . 1 1 121 121 PHE CB C 121 40.265 40.265 42.182 -1.917 25259 4555 1 6 . 1 1 121 121 PHE H H 121 8.831 8.831 8.999 -0.169 25259 4556 1 6 . 1 1 122 122 ASP N N 122 124.765 124.765 123.468 1.297 25259 4557 1 6 . 1 1 122 122 ASP HA H 122 4.840 4.840 5.098 -0.258 25259 4558 1 6 . 1 1 122 122 ASP CA C 122 49.837 49.837 52.495 -2.658 25259 4559 1 6 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.669 -2.184 25259 4560 1 6 . 1 1 122 122 ASP H H 122 8.819 8.819 8.856 -0.037 25259 4561 1 6 . 1 1 123 123 PHE N N 123 124.303 124.303 123.288 1.015 25259 4562 1 6 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.106 0.568 25259 4563 1 6 . 1 1 123 123 PHE CA C 123 57.798 57.798 62.356 -4.558 25259 4564 1 6 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.991 -3.451 25259 4565 1 6 . 1 1 123 123 PHE H H 123 8.262 8.262 8.747 -0.485 25259 4566 1 6 . 1 1 124 124 GLN N N 124 120.792 120.792 117.790 3.002 25259 4567 1 6 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.140 0.294 25259 4568 1 6 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.641 -2.558 25259 4569 1 6 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.920 -1.791 25259 4570 1 6 . 1 1 124 124 GLN H H 124 8.954 8.954 8.289 0.665 25259 4571 1 6 . 1 1 125 125 VAL N N 125 114.091 114.091 110.955 3.136 25259 4572 1 6 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.411 -0.002 25259 4573 1 6 . 1 1 125 125 VAL CA C 125 59.298 59.298 60.955 -1.657 25259 4574 1 6 . 1 1 125 125 VAL CB C 125 32.572 32.572 32.502 0.070 25259 4575 1 6 . 1 1 125 125 VAL H H 125 7.026 7.026 7.811 -0.785 25259 4576 1 6 . 1 1 126 126 LEU N N 126 125.158 125.158 123.312 1.846 25259 4577 1 6 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.564 -0.089 25259 4578 1 6 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.123 -0.948 25259 4579 1 6 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.639 -1.585 25259 4580 1 6 . 1 1 126 126 LEU H H 126 8.106 8.106 7.624 0.482 25259 4581 1 6 . 1 1 127 127 ASP N N 127 130.026 130.026 129.604 0.422 25259 4582 1 6 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.688 0.153 25259 4583 1 6 . 1 1 127 127 ASP CA C 127 50.198 50.198 54.509 -4.311 25259 4584 1 6 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.028 -2.339 25259 4585 1 6 . 1 1 127 127 ASP H H 127 9.129 9.129 9.029 0.100 25259 4586 1 6 . 1 1 128 128 VAL N N 128 128.833 128.833 123.216 5.617 25259 4587 1 6 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.562 -0.038 25259 4588 1 6 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.270 -2.602 25259 4589 1 6 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.819 -2.324 25259 4590 1 6 . 1 1 128 128 VAL H H 128 8.288 8.288 8.034 0.254 25259 4591 1 6 . 1 1 129 129 LYS N N 129 123.914 123.914 118.027 5.887 25259 4592 1 6 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.018 0.025 25259 4593 1 6 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.645 -1.857 25259 4594 1 6 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.883 -2.946 25259 4595 1 6 . 1 1 129 129 LYS H H 129 8.226 8.226 8.228 -0.002 25259 4596 1 6 . 1 1 130 130 LYS N N 130 121.888 121.888 117.644 4.244 25259 4597 1 6 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.373 -0.288 25259 4598 1 6 . 1 1 130 130 LYS CA C 130 56.146 56.146 56.769 -0.623 25259 4599 1 6 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.581 -3.241 25259 4600 1 6 . 1 1 130 130 LYS H H 130 7.590 7.590 7.722 -0.132 25259 4601 1 6 . 1 1 131 131 ALA N N 131 123.088 123.088 123.552 -0.464 25259 4602 1 6 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.048 -0.121 25259 4603 1 6 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.211 -2.809 25259 4604 1 6 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.240 -1.793 25259 4605 1 6 . 1 1 131 131 ALA H H 131 8.506 8.506 8.547 -0.041 25259 4606 1 6 . 1 1 132 132 SER N N 132 110.456 110.456 111.671 -1.215 25259 4607 1 6 . 1 1 132 132 SER HA H 132 4.117 4.117 4.189 -0.072 25259 4608 1 6 . 1 1 132 132 SER CA C 132 58.289 58.289 59.676 -1.387 25259 4609 1 6 . 1 1 132 132 SER CB C 132 61.034 61.034 63.177 -2.143 25259 4610 1 6 . 1 1 132 132 SER H H 132 7.986 7.986 8.326 -0.340 25259 4611 1 6 . 1 1 133 133 GLN N N 133 119.034 119.034 117.354 1.680 25259 4612 1 6 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.610 -0.208 25259 4613 1 6 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.592 -2.067 25259 4614 1 6 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.880 -2.646 25259 4615 1 6 . 1 1 133 133 GLN H H 133 7.233 7.233 7.859 -0.626 25259 4616 1 6 . 1 1 134 134 LEU N N 134 123.291 123.291 123.624 -0.333 25259 4617 1 6 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.303 0.090 25259 4618 1 6 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.598 -2.282 25259 4619 1 6 . 1 1 134 134 LEU CB C 134 38.847 38.847 39.396 -0.549 25259 4620 1 6 . 1 1 134 134 LEU H H 134 7.411 7.411 8.067 -0.656 25259 4621 1 6 . 1 1 135 135 GLU N N 135 128.446 128.446 123.185 5.261 25259 4622 1 6 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.690 0.256 25259 4623 1 6 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.563 -2.179 25259 4624 1 6 . 1 1 135 135 GLU CB C 135 27.296 27.296 28.796 -1.500 25259 4625 1 6 . 1 1 135 135 GLU H H 135 8.986 8.986 7.921 1.065 25259 4626 1 6 . 1 1 136 136 HIS N N 136 117.593 117.593 118.572 -0.979 25259 4627 1 6 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.386 -0.003 25259 4628 1 6 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.847 -2.162 25259 4629 1 6 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.743 -1.330 25259 4630 1 6 . 1 1 136 136 HIS H H 136 9.226 9.226 8.692 0.534 25259 4631 1 6 . 1 1 137 137 LEU N N 137 115.463 115.463 116.639 -1.176 25259 4632 1 6 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.450 0.057 25259 4633 1 6 . 1 1 137 137 LEU CA C 137 51.948 51.948 56.468 -4.520 25259 4634 1 6 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.259 -2.452 25259 4635 1 6 . 1 1 137 137 LEU H H 137 7.090 7.090 8.677 -1.587 25259 4636 1 6 . 1 1 138 138 LYS N N 138 124.686 124.686 120.168 4.518 25259 4637 1 6 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.061 0.108 25259 4638 1 6 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.833 -1.675 25259 4639 1 6 . 1 1 138 138 LYS CB C 138 30.088 30.088 31.918 -1.830 25259 4640 1 6 . 1 1 138 138 LYS H H 138 7.698 7.698 7.344 0.354 25259 4641 1 6 . 1 1 139 139 ASN N N 139 118.077 118.077 115.015 3.062 25259 4642 1 6 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.605 0.068 25259 4643 1 6 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.486 -2.704 25259 4644 1 6 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.828 -3.011 25259 4645 1 6 . 1 1 139 139 ASN H H 139 8.485 8.485 7.780 0.705 25259 4646 1 6 . 1 1 140 140 ILE N N 140 120.880 120.880 118.569 2.311 25259 4647 1 6 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.335 -0.305 25259 4648 1 6 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.445 -0.879 25259 4649 1 6 . 1 1 140 140 ILE CB C 140 35.774 35.774 40.127 -4.353 25259 4650 1 6 . 1 1 140 140 ILE H H 140 7.549 7.549 7.379 0.170 25259 4651 1 6 . 1 1 141 141 GLY N N 141 110.676 110.676 114.671 -3.995 25259 4652 1 6 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.818 -0.154 25259 4653 1 6 . 1 1 141 141 GLY H H 141 7.663 7.663 8.791 -1.128 25259 4654 1 6 . 1 1 142 142 LEU N N 142 123.857 123.857 122.486 1.371 25259 4655 1 6 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.851 -0.158 25259 4656 1 6 . 1 1 142 142 LEU CA C 142 55.193 55.193 58.100 -2.907 25259 4657 1 6 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.471 -0.862 25259 4658 1 6 . 1 1 142 142 LEU H H 142 8.496 8.496 7.750 0.746 25259 4659 1 6 . 1 1 143 143 GLU N N 143 118.407 118.407 118.363 0.044 25259 4660 1 6 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.876 -0.090 25259 4661 1 6 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.346 -2.124 25259 4662 1 6 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.799 -2.285 25259 4663 1 6 . 1 1 143 143 GLU H H 143 8.672 8.672 8.715 -0.043 25259 4664 1 6 . 1 1 144 144 ASN N N 144 118.477 118.477 115.676 2.801 25259 4665 1 6 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.396 0.046 25259 4666 1 6 . 1 1 144 144 ASN CA C 144 52.712 52.712 55.580 -2.868 25259 4667 1 6 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.401 -2.446 25259 4668 1 6 . 1 1 144 144 ASN H H 144 7.656 7.656 8.382 -0.726 25259 4669 1 6 . 1 1 145 145 LEU N N 145 125.354 125.354 119.768 5.586 25259 4670 1 6 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.823 -0.026 25259 4671 1 6 . 1 1 145 145 LEU CA C 145 56.323 56.323 56.859 -0.536 25259 4672 1 6 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.166 -2.593 25259 4673 1 6 . 1 1 145 145 LEU H H 145 7.758 7.758 7.368 0.390 25259 4674 1 6 . 1 1 146 146 LEU N N 146 116.372 116.372 116.854 -0.482 25259 4675 1 6 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.822 0.054 25259 4676 1 6 . 1 1 146 146 LEU CA C 146 53.243 53.243 56.166 -2.923 25259 4677 1 6 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.773 -2.876 25259 4678 1 6 . 1 1 146 146 LEU H H 146 7.242 7.242 7.751 -0.509 25259 4679 1 6 . 1 1 147 147 LYS N N 147 120.054 120.054 115.339 4.715 25259 4680 1 6 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.076 0.236 25259 4681 1 6 . 1 1 147 147 LYS CA C 147 54.623 54.623 57.120 -2.497 25259 4682 1 6 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.402 -2.142 25259 4683 1 6 . 1 1 147 147 LYS H H 147 7.185 7.185 7.751 -0.566 25259 4684 1 6 . 1 1 148 148 ASN N N 148 119.498 119.498 116.984 2.514 25259 4685 1 6 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.845 0.117 25259 4686 1 6 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.614 -1.840 25259 4687 1 6 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.637 -1.151 25259 4688 1 6 . 1 1 148 148 ASN H H 148 7.698 7.698 7.481 0.217 25259 4689 1 6 . 1 1 149 149 GLU N N 149 122.834 122.834 118.510 4.324 25259 4690 1 6 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.403 0.198 25259 4691 1 6 . 1 1 149 149 GLU CA C 149 52.219 52.219 55.473 -3.254 25259 4692 1 6 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.436 -2.626 25259 4693 1 6 . 1 1 149 149 GLU H H 149 8.767 8.767 8.645 0.122 25259 4694 1 6 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.916 0.692 25259 4695 1 6 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.450 -1.208 25259 4696 1 6 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.297 -3.202 25259 4697 1 6 . 1 1 151 151 SER N N 151 112.839 112.839 112.037 0.802 25259 4698 1 6 . 1 1 151 151 SER HA H 151 3.835 3.835 4.303 -0.468 25259 4699 1 6 . 1 1 151 151 SER CA C 151 59.270 59.270 59.084 0.186 25259 4700 1 6 . 1 1 151 151 SER CB C 151 59.451 59.451 62.956 -3.505 25259 4701 1 6 . 1 1 151 151 SER H H 151 8.519 8.519 7.769 0.750 25259 4702 1 6 . 1 1 152 152 LYS N N 152 126.710 126.710 121.784 4.926 25259 4703 1 6 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.064 0.184 25259 4704 1 6 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.252 -3.487 25259 4705 1 6 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.337 -2.080 25259 4706 1 6 . 1 1 152 152 LYS H H 152 7.006 7.006 8.273 -1.267 25259 4707 1 6 . 1 1 153 153 TYR N N 153 123.239 123.239 116.179 7.060 25259 4708 1 6 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.536 -0.278 25259 4709 1 6 . 1 1 153 153 TYR CA C 153 59.309 59.309 57.687 1.622 25259 4710 1 6 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.380 -1.046 25259 4711 1 6 . 1 1 153 153 TYR H H 153 8.058 8.058 8.132 -0.074 25259 4712 1 6 . 1 1 154 154 ILE N N 154 120.253 120.253 121.882 -1.629 25259 4713 1 6 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.205 0.168 25259 4714 1 6 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.207 -2.093 25259 4715 1 6 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.303 -1.355 25259 4716 1 6 . 1 1 154 154 ILE H H 154 8.193 8.193 7.875 0.318 25259 4717 1 6 . 1 1 155 155 SER N N 155 117.178 117.178 114.829 2.349 25259 4718 1 6 . 1 1 155 155 SER HA H 155 4.091 4.091 4.035 0.056 25259 4719 1 6 . 1 1 155 155 SER CA C 155 59.961 59.961 62.176 -2.215 25259 4720 1 6 . 1 1 155 155 SER CB C 155 60.148 60.148 62.652 -2.504 25259 4721 1 6 . 1 1 155 155 SER H H 155 8.020 8.020 7.793 0.227 25259 4722 1 6 . 1 1 156 156 ASP N N 156 125.479 125.479 120.255 5.224 25259 4723 1 6 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.476 -0.049 25259 4724 1 6 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.189 -1.429 25259 4725 1 6 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.980 -3.107 25259 4726 1 6 . 1 1 156 156 ASP H H 156 8.638 8.638 7.846 0.792 25259 4727 1 6 . 1 1 157 157 ARG N N 157 121.542 121.542 118.043 3.499 25259 4728 1 6 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.392 -0.281 25259 4729 1 6 . 1 1 157 157 ARG CA C 157 55.928 55.928 56.700 -0.772 25259 4730 1 6 . 1 1 157 157 ARG CB C 157 27.816 27.816 30.551 -2.735 25259 4731 1 6 . 1 1 157 157 ARG H H 157 7.888 7.888 7.437 0.451 25259 4732 1 6 . 1 1 158 158 LEU N N 158 124.257 124.257 121.740 2.517 25259 4733 1 6 . 1 1 158 158 LEU HA H 158 4.271 4.271 3.879 0.392 25259 4734 1 6 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.287 -3.074 25259 4735 1 6 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.260 -2.315 25259 4736 1 6 . 1 1 158 158 LEU H H 158 8.442 8.442 8.160 0.282 25259 4737 1 6 . 1 1 159 159 ALA N N 159 124.146 124.146 118.271 5.875 25259 4738 1 6 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.126 0.206 25259 4739 1 6 . 1 1 159 159 ALA CA C 159 51.432 51.432 53.843 -2.411 25259 4740 1 6 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.849 -2.942 25259 4741 1 6 . 1 1 159 159 ALA H H 159 8.086 8.086 7.942 0.144 25259 4742 1 6 . 1 1 160 160 ASN N N 160 118.093 118.093 117.190 0.903 25259 4743 1 6 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.680 0.312 25259 4744 1 6 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.446 -2.869 25259 4745 1 6 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.188 -0.455 25259 4746 1 6 . 1 1 160 160 ASN H H 160 7.445 7.445 7.623 -0.178 25259 4747 1 6 . 1 1 161 161 GLY N N 161 108.365 108.365 105.643 2.722 25259 4748 1 6 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.928 -1.282 25259 4749 1 6 . 1 1 161 161 GLY H H 161 7.743 7.743 7.521 0.222 25259 4750 1 6 . 1 1 162 162 ALA N N 162 123.928 123.928 121.984 1.944 25259 4751 1 6 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.948 -0.075 25259 4752 1 6 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.359 -1.833 25259 4753 1 6 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.203 -3.143 25259 4754 1 6 . 1 1 162 162 ALA H H 162 8.035 8.035 7.398 0.637 25259 4755 1 6 . 1 1 163 163 THR N N 163 113.286 113.286 111.650 1.636 25259 4756 1 6 . 1 1 163 163 THR HA H 163 4.703 4.703 4.675 0.028 25259 4757 1 6 . 1 1 163 163 THR CA C 163 57.791 57.791 60.452 -2.661 25259 4758 1 6 . 1 1 163 163 THR CB C 163 68.974 68.974 71.336 -2.362 25259 4759 1 6 . 1 1 163 163 THR H H 163 8.451 8.451 8.358 0.093 25259 4760 1 6 . 1 1 164 164 GLU N N 164 125.905 125.905 120.672 5.233 25259 4761 1 6 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.725 0.335 25259 4762 1 6 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.584 -1.999 25259 4763 1 6 . 1 1 164 164 GLU CB C 164 29.211 29.211 31.421 -2.210 25259 4764 1 6 . 1 1 164 164 GLU H H 164 8.716 8.716 8.592 0.124 25259 4765 1 7 . 1 1 2 2 PRO HA H 2 4.675 4.675 4.547 0.128 25259 4766 1 7 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.629 -1.821 25259 4767 1 7 . 1 1 2 2 PRO CB C 2 30.070 30.070 32.752 -2.683 25259 4768 1 7 . 1 1 3 3 ALA N N 3 126.741 126.741 123.414 3.327 25259 4769 1 7 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.691 -0.197 25259 4770 1 7 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.489 -1.287 25259 4771 1 7 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.673 -3.855 25259 4772 1 7 . 1 1 3 3 ALA H H 3 8.440 8.440 8.347 0.093 25259 4773 1 7 . 1 1 4 4 THR N N 4 116.015 116.015 117.514 -1.499 25259 4774 1 7 . 1 1 4 4 THR HA H 4 4.393 4.393 4.183 0.210 25259 4775 1 7 . 1 1 4 4 THR CA C 4 59.148 59.148 63.138 -3.990 25259 4776 1 7 . 1 1 4 4 THR CB C 4 67.580 67.580 69.389 -1.809 25259 4777 1 7 . 1 1 4 4 THR H H 4 8.050 8.050 8.558 -0.508 25259 4778 1 7 . 1 1 5 5 LYS N N 5 126.350 126.350 120.552 5.798 25259 4779 1 7 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.802 -0.297 25259 4780 1 7 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.786 -1.869 25259 4781 1 7 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.498 -3.814 25259 4782 1 7 . 1 1 5 5 LYS H H 5 8.332 8.332 8.159 0.173 25259 4783 1 7 . 1 1 6 6 THR N N 6 118.124 118.124 113.278 4.846 25259 4784 1 7 . 1 1 6 6 THR HA H 6 4.440 4.440 4.618 -0.178 25259 4785 1 7 . 1 1 6 6 THR CA C 6 59.282 59.282 61.357 -2.075 25259 4786 1 7 . 1 1 6 6 THR CB C 6 67.685 67.685 71.014 -3.329 25259 4787 1 7 . 1 1 6 6 THR H H 6 8.283 8.283 8.376 -0.093 25259 4788 1 7 . 1 1 7 7 GLU N N 7 125.934 125.934 122.601 3.333 25259 4789 1 7 . 1 1 7 7 GLU HA H 7 4.344 4.344 5.024 -0.680 25259 4790 1 7 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.453 -1.272 25259 4791 1 7 . 1 1 7 7 GLU CB C 7 27.816 27.816 33.537 -5.721 25259 4792 1 7 . 1 1 7 7 GLU H H 7 8.487 8.487 8.930 -0.443 25259 4793 1 7 . 1 1 8 8 LYS N N 8 123.945 123.945 120.220 3.725 25259 4794 1 7 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.588 -1.653 25259 4795 1 7 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.958 -3.393 25259 4796 1 7 . 1 1 8 8 LYS H H 8 8.278 8.278 8.310 -0.032 25259 4797 1 7 . 1 1 9 9 ASP N N 9 123.624 123.624 121.735 1.889 25259 4798 1 7 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.618 -0.279 25259 4799 1 7 . 1 1 9 9 ASP CA C 9 52.123 52.123 54.963 -2.840 25259 4800 1 7 . 1 1 9 9 ASP CB C 9 38.933 38.933 40.981 -2.048 25259 4801 1 7 . 1 1 9 9 ASP H H 9 8.277 8.277 8.375 -0.098 25259 4802 1 7 . 1 1 10 10 THR N N 10 116.812 116.812 116.054 0.758 25259 4803 1 7 . 1 1 10 10 THR HA H 10 4.349 4.349 4.557 -0.208 25259 4804 1 7 . 1 1 10 10 THR CA C 10 59.634 59.634 61.845 -2.211 25259 4805 1 7 . 1 1 10 10 THR CB C 10 67.254 67.254 69.639 -2.385 25259 4806 1 7 . 1 1 10 10 THR H H 10 8.049 8.049 8.148 -0.099 25259 4807 1 7 . 1 1 11 11 LEU N N 11 126.610 126.610 122.738 3.872 25259 4808 1 7 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.861 -0.469 25259 4809 1 7 . 1 1 11 11 LEU CA C 11 53.078 53.078 53.656 -0.578 25259 4810 1 7 . 1 1 11 11 LEU CB C 11 39.633 39.633 43.949 -4.316 25259 4811 1 7 . 1 1 11 11 LEU H H 11 8.191 8.191 8.735 -0.544 25259 4812 1 7 . 1 1 12 12 GLN N N 12 123.274 123.274 119.591 3.683 25259 4813 1 7 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.740 -0.358 25259 4814 1 7 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.074 -1.500 25259 4815 1 7 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.304 -4.501 25259 4816 1 7 . 1 1 12 12 GLN H H 12 8.280 8.280 8.581 -0.301 25259 4817 1 7 . 1 1 13 13 SER N N 13 119.027 119.027 115.291 3.736 25259 4818 1 7 . 1 1 13 13 SER HA H 13 4.471 4.471 4.734 -0.263 25259 4819 1 7 . 1 1 13 13 SER CA C 13 55.869 55.869 57.815 -1.946 25259 4820 1 7 . 1 1 13 13 SER CB C 13 61.424 61.424 65.227 -3.803 25259 4821 1 7 . 1 1 13 13 SER H H 13 8.178 8.178 8.486 -0.308 25259 4822 1 7 . 1 1 14 14 ALA N N 14 128.314 128.314 125.114 3.200 25259 4823 1 7 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.550 -0.116 25259 4824 1 7 . 1 1 14 14 ALA CA C 14 49.696 49.696 52.097 -2.401 25259 4825 1 7 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.119 -2.038 25259 4826 1 7 . 1 1 14 14 ALA H H 14 8.195 8.195 8.276 -0.081 25259 4827 1 7 . 1 1 15 15 LEU N N 15 125.175 125.175 123.218 1.957 25259 4828 1 7 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.945 -0.305 25259 4829 1 7 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.375 -2.771 25259 4830 1 7 . 1 1 15 15 LEU CB C 15 39.467 39.467 43.127 -3.660 25259 4831 1 7 . 1 1 15 15 LEU H H 15 8.050 8.050 8.434 -0.384 25259 4832 1 7 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.879 -0.375 25259 4833 1 7 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.756 -2.125 25259 4834 1 7 . 1 1 16 16 PRO CB C 16 29.658 29.658 33.945 -4.287 25259 4835 1 7 . 1 1 17 17 VAL N N 17 123.223 123.223 118.945 4.278 25259 4836 1 7 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.439 -0.305 25259 4837 1 7 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.539 -1.712 25259 4838 1 7 . 1 1 17 17 VAL CB C 17 30.377 30.377 34.192 -3.815 25259 4839 1 7 . 1 1 17 17 VAL H H 17 8.134 8.134 8.084 0.050 25259 4840 1 7 . 1 1 18 18 ILE N N 18 127.777 127.777 122.100 5.677 25259 4841 1 7 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.511 -0.268 25259 4842 1 7 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.686 -2.364 25259 4843 1 7 . 1 1 18 18 ILE CB C 18 36.254 36.254 39.938 -3.684 25259 4844 1 7 . 1 1 18 18 ILE H H 18 8.187 8.187 8.155 0.032 25259 4845 1 7 . 1 1 19 19 GLU N N 19 128.148 128.148 126.271 1.877 25259 4846 1 7 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.542 -0.205 25259 4847 1 7 . 1 1 19 19 GLU CA C 19 54.091 54.091 56.561 -2.470 25259 4848 1 7 . 1 1 19 19 GLU CB C 19 28.176 28.176 30.701 -2.525 25259 4849 1 7 . 1 1 19 19 GLU H H 19 8.475 8.475 8.566 -0.091 25259 4850 1 7 . 1 1 20 20 ASN N N 20 122.788 122.788 123.420 -0.632 25259 4851 1 7 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.901 -0.206 25259 4852 1 7 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.059 -2.237 25259 4853 1 7 . 1 1 20 20 ASN CB C 20 36.366 36.366 38.866 -2.500 25259 4854 1 7 . 1 1 20 20 ASN H H 20 8.477 8.477 8.756 -0.279 25259 4855 1 7 . 1 1 21 21 ALA N N 21 127.253 127.253 127.331 -0.078 25259 4856 1 7 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.590 -0.269 25259 4857 1 7 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.750 -1.062 25259 4858 1 7 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.383 -3.470 25259 4859 1 7 . 1 1 21 21 ALA H H 21 8.325 8.325 8.098 0.227 25259 4860 1 7 . 1 1 22 22 GLU N N 22 122.044 122.044 120.937 1.107 25259 4861 1 7 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.226 0.067 25259 4862 1 7 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.334 -1.751 25259 4863 1 7 . 1 1 22 22 GLU CB C 22 27.285 27.285 27.930 -0.645 25259 4864 1 7 . 1 1 22 22 GLU H H 22 8.415 8.415 8.513 -0.098 25259 4865 1 7 . 1 1 23 23 LYS N N 23 123.622 123.622 121.686 1.936 25259 4866 1 7 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.248 0.077 25259 4867 1 7 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.997 -1.501 25259 4868 1 7 . 1 1 23 23 LYS CB C 23 30.653 30.653 33.251 -2.598 25259 4869 1 7 . 1 1 23 23 LYS H H 23 8.127 8.127 7.964 0.163 25259 4870 1 7 . 1 1 24 24 ASN N N 24 120.652 120.652 119.471 1.181 25259 4871 1 7 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.603 0.238 25259 4872 1 7 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.535 -2.872 25259 4873 1 7 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.196 -2.421 25259 4874 1 7 . 1 1 24 24 ASN H H 24 8.424 8.424 8.577 -0.153 25259 4875 1 7 . 1 1 25 25 THR N N 25 117.102 117.102 115.541 1.561 25259 4876 1 7 . 1 1 25 25 THR HA H 25 4.367 4.367 4.213 0.154 25259 4877 1 7 . 1 1 25 25 THR CA C 25 59.500 59.500 62.407 -2.907 25259 4878 1 7 . 1 1 25 25 THR CB C 25 67.610 67.610 70.165 -2.555 25259 4879 1 7 . 1 1 25 25 THR H H 25 7.852 7.852 8.261 -0.409 25259 4880 1 7 . 1 1 26 26 VAL N N 26 126.491 126.491 123.075 3.416 25259 4881 1 7 . 1 1 26 26 VAL HA H 26 4.167 4.167 3.870 0.297 25259 4882 1 7 . 1 1 26 26 VAL CA C 26 60.193 60.193 62.352 -2.159 25259 4883 1 7 . 1 1 26 26 VAL CB C 26 29.605 29.605 32.453 -2.848 25259 4884 1 7 . 1 1 26 26 VAL H H 26 8.080 8.080 8.088 -0.008 25259 4885 1 7 . 1 1 27 27 VAL N N 27 132.992 132.992 128.979 4.013 25259 4886 1 7 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.253 -0.172 25259 4887 1 7 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.436 -1.452 25259 4888 1 7 . 1 1 27 27 VAL CB C 27 31.540 31.540 33.478 -1.938 25259 4889 1 7 . 1 1 27 27 VAL H H 27 8.830 8.830 8.653 0.177 25259 4890 1 7 . 1 1 28 28 THR N N 28 123.576 123.576 119.797 3.779 25259 4891 1 7 . 1 1 28 28 THR HA H 28 5.553 5.553 4.898 0.655 25259 4892 1 7 . 1 1 28 28 THR CA C 28 58.738 58.738 60.594 -1.856 25259 4893 1 7 . 1 1 28 28 THR CB C 28 68.443 68.443 68.849 -0.406 25259 4894 1 7 . 1 1 28 28 THR H H 28 8.165 8.165 8.291 -0.126 25259 4895 1 7 . 1 1 29 29 LYS N N 29 129.099 129.099 126.112 2.987 25259 4896 1 7 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.470 0.472 25259 4897 1 7 . 1 1 29 29 LYS CA C 29 51.779 51.779 56.426 -4.647 25259 4898 1 7 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.030 1.066 25259 4899 1 7 . 1 1 29 29 LYS H H 29 9.273 9.273 8.951 0.322 25259 4900 1 7 . 1 1 30 30 THR N N 30 123.510 123.510 119.209 4.301 25259 4901 1 7 . 1 1 30 30 THR HA H 30 5.428 5.428 4.878 0.550 25259 4902 1 7 . 1 1 30 30 THR CA C 30 59.784 59.784 62.113 -2.329 25259 4903 1 7 . 1 1 30 30 THR CB C 30 67.818 67.818 70.847 -3.029 25259 4904 1 7 . 1 1 30 30 THR H H 30 8.993 8.993 8.238 0.755 25259 4905 1 7 . 1 1 31 31 LEU N N 31 128.293 128.293 128.956 -0.663 25259 4906 1 7 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.902 0.318 25259 4907 1 7 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.240 -3.185 25259 4908 1 7 . 1 1 31 31 LEU CB C 31 43.399 43.399 42.817 0.582 25259 4909 1 7 . 1 1 31 31 LEU H H 31 9.557 9.557 8.696 0.861 25259 4910 1 7 . 1 1 32 32 VAL N N 32 126.919 126.919 126.215 0.704 25259 4911 1 7 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.048 0.403 25259 4912 1 7 . 1 1 32 32 VAL CA C 32 59.664 59.664 62.047 -2.383 25259 4913 1 7 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.584 -1.135 25259 4914 1 7 . 1 1 32 32 VAL H H 32 9.364 9.364 8.600 0.764 25259 4915 1 7 . 1 1 33 33 LEU N N 33 133.503 133.503 129.339 4.164 25259 4916 1 7 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.352 0.204 25259 4917 1 7 . 1 1 33 33 LEU CA C 33 52.004 52.004 54.067 -2.063 25259 4918 1 7 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.327 -4.480 25259 4919 1 7 . 1 1 33 33 LEU H H 33 8.587 8.587 7.784 0.803 25259 4920 1 7 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.431 0.050 25259 4921 1 7 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.380 -1.935 25259 4922 1 7 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.311 -2.746 25259 4923 1 7 . 1 1 35 35 LYS N N 35 127.420 127.420 118.839 8.581 25259 4924 1 7 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.119 0.247 25259 4925 1 7 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.089 -1.970 25259 4926 1 7 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.886 -2.292 25259 4927 1 7 . 1 1 35 35 LYS H H 35 8.666 8.666 8.476 0.190 25259 4928 1 7 . 1 1 36 36 SER N N 36 122.222 122.222 120.240 1.982 25259 4929 1 7 . 1 1 36 36 SER HA H 36 4.753 4.753 4.484 0.269 25259 4930 1 7 . 1 1 36 36 SER CA C 36 55.328 55.328 59.278 -3.950 25259 4931 1 7 . 1 1 36 36 SER CB C 36 61.728 61.728 61.945 -0.217 25259 4932 1 7 . 1 1 36 36 SER H H 36 8.771 8.771 8.544 0.227 25259 4933 1 7 . 1 1 37 37 ASP N N 37 126.346 126.346 124.523 1.823 25259 4934 1 7 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.291 0.163 25259 4935 1 7 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.762 -3.146 25259 4936 1 7 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.377 -2.392 25259 4937 1 7 . 1 1 37 37 ASP H H 37 8.859 8.859 8.612 0.247 25259 4938 1 7 . 1 1 38 38 ASP N N 38 119.171 119.171 120.654 -1.483 25259 4939 1 7 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.692 -0.077 25259 4940 1 7 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.759 -3.971 25259 4941 1 7 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.319 -3.684 25259 4942 1 7 . 1 1 38 38 ASP H H 38 7.944 7.944 8.385 -0.441 25259 4943 1 7 . 1 1 39 39 GLY N N 39 110.352 110.352 108.409 1.943 25259 4944 1 7 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.402 -2.641 25259 4945 1 7 . 1 1 39 39 GLY H H 39 8.145 8.145 8.237 -0.092 25259 4946 1 7 . 1 1 40 40 SER N N 40 120.090 120.090 119.261 0.829 25259 4947 1 7 . 1 1 40 40 SER HA H 40 4.877 4.877 4.678 0.199 25259 4948 1 7 . 1 1 40 40 SER CA C 40 56.525 56.525 58.169 -1.644 25259 4949 1 7 . 1 1 40 40 SER CB C 40 62.245 62.245 64.593 -2.348 25259 4950 1 7 . 1 1 40 40 SER H H 40 8.344 8.344 7.991 0.353 25259 4951 1 7 . 1 1 41 41 GLN N N 41 122.551 122.551 121.605 0.946 25259 4952 1 7 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.822 0.105 25259 4953 1 7 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.439 -2.025 25259 4954 1 7 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.072 -2.758 25259 4955 1 7 . 1 1 41 41 GLN H H 41 8.627 8.627 8.841 -0.214 25259 4956 1 7 . 1 1 42 42 GLN N N 42 131.724 131.724 119.505 12.219 25259 4957 1 7 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.975 0.636 25259 4958 1 7 . 1 1 42 42 GLN CA C 42 52.072 52.072 53.929 -1.857 25259 4959 1 7 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.744 -2.425 25259 4960 1 7 . 1 1 42 42 GLN H H 42 9.189 9.189 8.810 0.379 25259 4961 1 7 . 1 1 43 43 THR N N 43 122.202 122.202 113.987 8.215 25259 4962 1 7 . 1 1 43 43 THR HA H 43 5.380 5.380 4.773 0.607 25259 4963 1 7 . 1 1 43 43 THR CA C 43 58.863 58.863 60.950 -2.087 25259 4964 1 7 . 1 1 43 43 THR CB C 43 68.893 68.893 71.960 -3.067 25259 4965 1 7 . 1 1 43 43 THR H H 43 9.139 9.139 8.341 0.798 25259 4966 1 7 . 1 1 44 44 GLN N N 44 127.190 127.190 120.045 7.145 25259 4967 1 7 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.180 0.454 25259 4968 1 7 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.609 -2.941 25259 4969 1 7 . 1 1 44 44 GLN CB C 44 28.910 28.910 33.452 -4.542 25259 4970 1 7 . 1 1 44 44 GLN H H 44 9.760 9.760 8.492 1.268 25259 4971 1 7 . 1 1 45 45 THR N N 45 123.479 123.479 117.422 6.057 25259 4972 1 7 . 1 1 45 45 THR HA H 45 5.421 5.421 5.191 0.230 25259 4973 1 7 . 1 1 45 45 THR CA C 45 60.071 60.071 60.713 -0.642 25259 4974 1 7 . 1 1 45 45 THR CB C 45 67.541 67.541 71.281 -3.740 25259 4975 1 7 . 1 1 45 45 THR H H 45 9.518 9.518 9.182 0.336 25259 4976 1 7 . 1 1 46 46 ILE N N 46 133.908 133.908 125.046 8.862 25259 4977 1 7 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.737 0.266 25259 4978 1 7 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.953 -2.482 25259 4979 1 7 . 1 1 46 46 ILE CB C 46 39.945 39.945 41.803 -1.858 25259 4980 1 7 . 1 1 46 46 ILE H H 46 9.830 9.830 9.212 0.618 25259 4981 1 7 . 1 1 47 47 THR N N 47 124.701 124.701 124.249 0.452 25259 4982 1 7 . 1 1 47 47 THR HA H 47 6.048 6.048 5.502 0.546 25259 4983 1 7 . 1 1 47 47 THR CA C 47 58.551 58.551 61.551 -3.000 25259 4984 1 7 . 1 1 47 47 THR CB C 47 67.819 67.819 69.801 -1.982 25259 4985 1 7 . 1 1 47 47 THR H H 47 8.843 8.843 8.910 -0.067 25259 4986 1 7 . 1 1 48 48 TYR N N 48 127.369 127.369 122.158 5.211 25259 4987 1 7 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.122 0.156 25259 4988 1 7 . 1 1 48 48 TYR CA C 48 53.729 53.729 55.913 -2.184 25259 4989 1 7 . 1 1 48 48 TYR CB C 48 39.432 39.432 42.049 -2.617 25259 4990 1 7 . 1 1 48 48 TYR H H 48 9.638 9.638 8.498 1.140 25259 4991 1 7 . 1 1 49 49 LYS N N 49 122.138 122.138 116.932 5.206 25259 4992 1 7 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.390 0.266 25259 4993 1 7 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.593 -3.621 25259 4994 1 7 . 1 1 49 49 LYS CB C 49 33.603 33.603 32.967 0.636 25259 4995 1 7 . 1 1 49 49 LYS H H 49 8.560 8.560 8.868 -0.308 25259 4996 1 7 . 1 1 50 50 ASP N N 50 130.208 130.208 120.947 9.261 25259 4997 1 7 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.664 -0.360 25259 4998 1 7 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.064 -0.304 25259 4999 1 7 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.666 -5.327 25259 5000 1 7 . 1 1 50 50 ASP H H 50 9.597 9.597 8.557 1.040 25259 5001 1 7 . 1 1 51 51 LYS N N 51 124.586 124.586 118.462 6.124 25259 5002 1 7 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.441 0.090 25259 5003 1 7 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.274 -2.540 25259 5004 1 7 . 1 1 51 51 LYS CB C 51 30.395 30.395 33.733 -3.338 25259 5005 1 7 . 1 1 51 51 LYS H H 51 8.450 8.450 8.197 0.253 25259 5006 1 7 . 1 1 52 52 THR N N 52 120.044 120.044 113.899 6.145 25259 5007 1 7 . 1 1 52 52 THR HA H 52 4.717 4.717 4.498 0.219 25259 5008 1 7 . 1 1 52 52 THR CA C 52 59.313 59.313 60.805 -1.492 25259 5009 1 7 . 1 1 52 52 THR CB C 52 68.815 68.815 71.699 -2.884 25259 5010 1 7 . 1 1 52 52 THR H H 52 8.658 8.658 7.626 1.032 25259 5011 1 7 . 1 1 53 53 PHE N N 53 128.987 128.987 123.929 5.058 25259 5012 1 7 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.459 -0.176 25259 5013 1 7 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.867 -0.878 25259 5014 1 7 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.883 0.428 25259 5015 1 7 . 1 1 53 53 PHE H H 53 9.218 9.218 8.761 0.457 25259 5016 1 7 . 1 1 54 54 LEU N N 54 124.874 124.874 125.588 -0.714 25259 5017 1 7 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.230 0.699 25259 5018 1 7 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.300 -3.059 25259 5019 1 7 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.753 -2.236 25259 5020 1 7 . 1 1 54 54 LEU H H 54 9.391 9.391 8.640 0.751 25259 5021 1 7 . 1 1 55 55 SER N N 55 115.516 115.516 108.985 6.531 25259 5022 1 7 . 1 1 55 55 SER HA H 55 5.194 5.194 5.526 -0.332 25259 5023 1 7 . 1 1 55 55 SER CA C 55 55.818 55.818 57.223 -1.405 25259 5024 1 7 . 1 1 55 55 SER CB C 55 63.474 63.474 65.472 -1.998 25259 5025 1 7 . 1 1 55 55 SER H H 55 8.736 8.736 7.748 0.988 25259 5026 1 7 . 1 1 56 56 LEU N N 56 124.352 124.352 122.127 2.225 25259 5027 1 7 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.434 0.109 25259 5028 1 7 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.396 -2.759 25259 5029 1 7 . 1 1 56 56 LEU CB C 56 45.513 45.513 47.386 -1.873 25259 5030 1 7 . 1 1 56 56 LEU H H 56 8.328 8.328 8.418 -0.090 25259 5031 1 7 . 1 1 57 57 ALA N N 57 131.450 131.450 123.365 8.085 25259 5032 1 7 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.599 -0.094 25259 5033 1 7 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.559 -2.357 25259 5034 1 7 . 1 1 57 57 ALA CB C 57 18.964 18.964 22.866 -3.902 25259 5035 1 7 . 1 1 57 57 ALA H H 57 9.208 9.208 8.714 0.494 25259 5036 1 7 . 1 1 58 58 ILE N N 58 126.248 126.248 120.169 6.079 25259 5037 1 7 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.804 -0.020 25259 5038 1 7 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.161 -1.914 25259 5039 1 7 . 1 1 58 58 ILE CB C 58 38.045 38.045 40.650 -2.604 25259 5040 1 7 . 1 1 58 58 ILE H H 58 9.597 9.597 8.950 0.647 25259 5041 1 7 . 1 1 59 59 GLN N N 59 132.065 132.065 126.555 5.510 25259 5042 1 7 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.666 0.581 25259 5043 1 7 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.789 -3.625 25259 5044 1 7 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.353 -0.692 25259 5045 1 7 . 1 1 59 59 GLN H H 59 9.389 9.389 8.317 1.072 25259 5046 1 7 . 1 1 60 60 GLN N N 60 130.314 130.314 119.824 10.490 25259 5047 1 7 . 1 1 60 60 GLN HA H 60 5.209 5.209 5.045 0.164 25259 5048 1 7 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.519 -2.498 25259 5049 1 7 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.480 -4.005 25259 5050 1 7 . 1 1 60 60 GLN H H 60 9.471 9.471 8.903 0.568 25259 5051 1 7 . 1 1 61 61 LYS N N 61 131.044 131.044 124.234 6.810 25259 5052 1 7 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.084 0.331 25259 5053 1 7 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.328 -3.208 25259 5054 1 7 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.033 -3.616 25259 5055 1 7 . 1 1 61 61 LYS H H 61 8.893 8.893 9.059 -0.166 25259 5056 1 7 . 1 1 62 62 ARG N N 62 125.397 125.397 121.531 3.866 25259 5057 1 7 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.402 -0.399 25259 5058 1 7 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.648 -2.557 25259 5059 1 7 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.954 -2.076 25259 5060 1 7 . 1 1 62 62 ARG H H 62 9.120 9.120 8.121 0.999 25259 5061 1 7 . 1 1 63 63 PRO HA H 63 4.975 4.975 5.008 -0.033 25259 5062 1 7 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.493 -2.996 25259 5063 1 7 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.632 -2.748 25259 5064 1 7 . 1 1 64 64 VAL N N 64 121.305 121.305 116.707 4.598 25259 5065 1 7 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.500 -0.476 25259 5066 1 7 . 1 1 64 64 VAL CA C 64 59.677 59.677 60.668 -0.991 25259 5067 1 7 . 1 1 64 64 VAL CB C 64 30.365 30.365 34.720 -4.355 25259 5068 1 7 . 1 1 64 64 VAL H H 64 7.520 7.520 8.269 -0.749 25259 5069 1 7 . 1 1 65 65 SER N N 65 123.215 123.215 118.468 4.747 25259 5070 1 7 . 1 1 65 65 SER HA H 65 4.521 4.521 4.705 -0.184 25259 5071 1 7 . 1 1 65 65 SER CA C 65 54.897 54.897 59.057 -4.160 25259 5072 1 7 . 1 1 65 65 SER CB C 65 62.564 62.564 64.396 -1.832 25259 5073 1 7 . 1 1 65 65 SER H H 65 8.080 8.080 8.630 -0.550 25259 5074 1 7 . 1 1 66 66 ASP N N 66 123.802 123.802 121.716 2.086 25259 5075 1 7 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.689 -0.260 25259 5076 1 7 . 1 1 66 66 ASP CA C 66 55.378 55.378 55.195 0.183 25259 5077 1 7 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.011 -2.973 25259 5078 1 7 . 1 1 66 66 ASP H H 66 8.900 8.900 7.970 0.930 25259 5079 1 7 . 1 1 67 67 GLU N N 67 121.943 121.943 120.574 1.369 25259 5080 1 7 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.125 0.064 25259 5081 1 7 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.076 -1.636 25259 5082 1 7 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.701 -2.916 25259 5083 1 7 . 1 1 67 67 GLU H H 67 8.717 8.717 8.491 0.226 25259 5084 1 7 . 1 1 68 68 LEU N N 68 125.458 125.458 120.345 5.113 25259 5085 1 7 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.159 0.184 25259 5086 1 7 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.231 -2.759 25259 5087 1 7 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.835 -2.431 25259 5088 1 7 . 1 1 68 68 LEU H H 68 7.820 7.820 7.994 -0.174 25259 5089 1 7 . 1 1 69 69 LYS N N 69 123.868 123.868 119.981 3.887 25259 5090 1 7 . 1 1 69 69 LYS HA H 69 4.006 4.006 3.999 0.007 25259 5091 1 7 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.318 -1.700 25259 5092 1 7 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.973 -1.935 25259 5093 1 7 . 1 1 69 69 LYS H H 69 8.690 8.690 8.414 0.276 25259 5094 1 7 . 1 1 70 70 THR N N 70 117.109 117.109 115.886 1.223 25259 5095 1 7 . 1 1 70 70 THR HA H 70 4.088 4.088 3.953 0.135 25259 5096 1 7 . 1 1 70 70 THR CA C 70 63.879 63.879 67.032 -3.153 25259 5097 1 7 . 1 1 70 70 THR CB C 70 66.383 66.383 68.692 -2.308 25259 5098 1 7 . 1 1 70 70 THR H H 70 7.935 7.935 7.733 0.202 25259 5099 1 7 . 1 1 71 71 TYR N N 71 127.006 127.006 122.275 4.731 25259 5100 1 7 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.284 -0.079 25259 5101 1 7 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.890 -1.665 25259 5102 1 7 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.421 -1.876 25259 5103 1 7 . 1 1 71 71 TYR H H 71 7.683 7.683 7.616 0.067 25259 5104 1 7 . 1 1 72 72 ILE N N 72 125.064 125.064 120.562 4.502 25259 5105 1 7 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.703 -0.024 25259 5106 1 7 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.102 -2.207 25259 5107 1 7 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.823 -1.547 25259 5108 1 7 . 1 1 72 72 ILE H H 72 9.083 9.083 7.940 1.143 25259 5109 1 7 . 1 1 73 73 ASP N N 73 124.900 124.900 119.134 5.766 25259 5110 1 7 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.462 -0.073 25259 5111 1 7 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.691 -1.653 25259 5112 1 7 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.952 -2.845 25259 5113 1 7 . 1 1 73 73 ASP H H 73 8.751 8.751 7.847 0.904 25259 5114 1 7 . 1 1 74 74 GLN N N 74 117.025 117.025 117.216 -0.191 25259 5115 1 7 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.996 0.142 25259 5116 1 7 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.464 -3.654 25259 5117 1 7 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.418 -1.854 25259 5118 1 7 . 1 1 74 74 GLN H H 74 7.447 7.447 7.733 -0.286 25259 5119 1 7 . 1 1 75 75 HIS N N 75 116.494 116.494 114.476 2.018 25259 5120 1 7 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.559 0.157 25259 5121 1 7 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.657 -2.591 25259 5122 1 7 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.072 -4.770 25259 5123 1 7 . 1 1 75 75 HIS H H 75 8.402 8.402 7.911 0.491 25259 5124 1 7 . 1 1 76 76 GLY N N 76 112.564 112.564 105.038 7.526 25259 5125 1 7 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.928 -3.032 25259 5126 1 7 . 1 1 76 76 GLY H H 76 9.091 9.091 7.787 1.304 25259 5127 1 7 . 1 1 77 77 VAL N N 77 124.763 124.763 121.874 2.889 25259 5128 1 7 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.760 -0.195 25259 5129 1 7 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.422 -0.471 25259 5130 1 7 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.047 -2.209 25259 5131 1 7 . 1 1 77 77 VAL H H 77 8.927 8.927 8.578 0.349 25259 5132 1 7 . 1 1 78 78 GLU N N 78 124.388 124.388 118.706 5.682 25259 5133 1 7 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.126 0.022 25259 5134 1 7 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.111 -0.795 25259 5135 1 7 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.712 -2.253 25259 5136 1 7 . 1 1 78 78 GLU H H 78 8.781 8.781 8.664 0.117 25259 5137 1 7 . 1 1 79 79 GLU N N 79 121.887 121.887 119.118 2.769 25259 5138 1 7 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.158 0.030 25259 5139 1 7 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.243 -2.698 25259 5140 1 7 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.370 -2.337 25259 5141 1 7 . 1 1 79 79 GLU H H 79 9.231 9.231 8.460 0.771 25259 5142 1 7 . 1 1 80 80 THR N N 80 120.781 120.781 116.518 4.263 25259 5143 1 7 . 1 1 80 80 THR HA H 80 4.059 4.059 3.973 0.086 25259 5144 1 7 . 1 1 80 80 THR CA C 80 65.487 65.487 66.678 -1.191 25259 5145 1 7 . 1 1 80 80 THR CB C 80 64.369 64.369 68.403 -4.034 25259 5146 1 7 . 1 1 80 80 THR H H 80 7.858 7.858 8.431 -0.573 25259 5147 1 7 . 1 1 81 81 GLN N N 81 125.303 125.303 120.634 4.669 25259 5148 1 7 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.969 0.075 25259 5149 1 7 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.034 -2.065 25259 5150 1 7 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.245 -2.168 25259 5151 1 7 . 1 1 81 81 GLN H H 81 8.765 8.765 7.828 0.937 25259 5152 1 7 . 1 1 82 82 LYS N N 82 120.458 120.458 118.670 1.788 25259 5153 1 7 . 1 1 82 82 LYS HA H 82 4.089 4.089 4.082 0.007 25259 5154 1 7 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.023 -0.711 25259 5155 1 7 . 1 1 82 82 LYS CB C 82 30.154 30.154 32.072 -1.918 25259 5156 1 7 . 1 1 82 82 LYS H H 82 7.521 7.521 7.924 -0.403 25259 5157 1 7 . 1 1 83 83 ALA N N 83 125.234 125.234 122.612 2.622 25259 5158 1 7 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.796 0.421 25259 5159 1 7 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.594 -2.152 25259 5160 1 7 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.050 -1.763 25259 5161 1 7 . 1 1 83 83 ALA H H 83 7.782 7.782 7.897 -0.115 25259 5162 1 7 . 1 1 84 84 LEU N N 84 123.348 123.348 118.763 4.585 25259 5163 1 7 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.791 0.267 25259 5164 1 7 . 1 1 84 84 LEU CA C 84 55.499 55.499 58.102 -2.603 25259 5165 1 7 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.239 -1.931 25259 5166 1 7 . 1 1 84 84 LEU H H 84 8.590 8.590 8.019 0.571 25259 5167 1 7 . 1 1 85 85 LEU N N 85 122.872 122.872 117.858 5.014 25259 5168 1 7 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.942 0.228 25259 5169 1 7 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.444 -2.048 25259 5170 1 7 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.301 -2.560 25259 5171 1 7 . 1 1 85 85 LEU H H 85 7.892 7.892 7.326 0.566 25259 5172 1 7 . 1 1 86 86 GLU N N 86 122.713 122.713 119.441 3.272 25259 5173 1 7 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.984 0.101 25259 5174 1 7 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.270 -2.526 25259 5175 1 7 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.638 -2.735 25259 5176 1 7 . 1 1 86 86 GLU H H 86 8.124 8.124 8.274 -0.150 25259 5177 1 7 . 1 1 87 87 ALA N N 87 123.163 123.163 122.271 0.892 25259 5178 1 7 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.015 0.126 25259 5179 1 7 . 1 1 87 87 ALA CA C 87 52.268 52.268 55.105 -2.837 25259 5180 1 7 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.154 -2.522 25259 5181 1 7 . 1 1 87 87 ALA H H 87 7.765 7.765 7.905 -0.140 25259 5182 1 7 . 1 1 88 88 GLU N N 88 121.945 121.945 117.761 4.184 25259 5183 1 7 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.019 0.065 25259 5184 1 7 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.692 -1.757 25259 5185 1 7 . 1 1 88 88 GLU CB C 88 28.027 28.027 28.971 -0.944 25259 5186 1 7 . 1 1 88 88 GLU H H 88 7.846 7.846 8.302 -0.456 25259 5187 1 7 . 1 1 89 89 GLU N N 89 117.978 117.978 118.792 -0.814 25259 5188 1 7 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.101 -0.008 25259 5189 1 7 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.739 -3.525 25259 5190 1 7 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.432 -2.025 25259 5191 1 7 . 1 1 89 89 GLU H H 89 7.634 7.634 7.629 0.005 25259 5192 1 7 . 1 1 90 90 LYS N N 90 117.519 117.519 116.596 0.923 25259 5193 1 7 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.289 0.142 25259 5194 1 7 . 1 1 90 90 LYS CA C 90 53.018 53.018 56.047 -3.029 25259 5195 1 7 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.321 -1.290 25259 5196 1 7 . 1 1 90 90 LYS H H 90 7.247 7.247 7.661 -0.414 25259 5197 1 7 . 1 1 91 91 ASP N N 91 124.888 124.888 122.463 2.425 25259 5198 1 7 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.588 0.095 25259 5199 1 7 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.610 -2.411 25259 5200 1 7 . 1 1 91 91 ASP CB C 91 39.581 39.581 41.928 -2.347 25259 5201 1 7 . 1 1 91 91 ASP H H 91 7.370 7.370 7.453 -0.083 25259 5202 1 7 . 1 1 92 92 LYS N N 92 129.311 129.311 127.739 1.572 25259 5203 1 7 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.859 0.154 25259 5204 1 7 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.404 -2.188 25259 5205 1 7 . 1 1 92 92 LYS CB C 92 30.015 30.015 31.870 -1.855 25259 5206 1 7 . 1 1 92 92 LYS H H 92 8.795 8.795 8.653 0.142 25259 5207 1 7 . 1 1 93 93 SER N N 93 118.112 118.112 116.518 1.594 25259 5208 1 7 . 1 1 93 93 SER HA H 93 4.439 4.439 4.171 0.268 25259 5209 1 7 . 1 1 93 93 SER CA C 93 58.945 58.945 61.168 -2.223 25259 5210 1 7 . 1 1 93 93 SER CB C 93 60.278 60.278 63.041 -2.763 25259 5211 1 7 . 1 1 93 93 SER H H 93 8.488 8.488 8.441 0.047 25259 5212 1 7 . 1 1 94 94 ILE N N 94 128.950 128.950 122.355 6.595 25259 5213 1 7 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.485 -0.003 25259 5214 1 7 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.580 -2.231 25259 5215 1 7 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.868 -3.115 25259 5216 1 7 . 1 1 94 94 ILE H H 94 7.722 7.722 7.333 0.389 25259 5217 1 7 . 1 1 95 95 ILE N N 95 123.598 123.598 120.860 2.738 25259 5218 1 7 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.482 0.113 25259 5219 1 7 . 1 1 95 95 ILE CA C 95 62.747 62.747 66.088 -3.341 25259 5220 1 7 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.411 -1.439 25259 5221 1 7 . 1 1 95 95 ILE H H 95 8.378 8.378 8.620 -0.242 25259 5222 1 7 . 1 1 96 96 GLU N N 96 118.317 118.317 118.576 -0.259 25259 5223 1 7 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.958 0.026 25259 5224 1 7 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.478 -2.983 25259 5225 1 7 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.231 -2.058 25259 5226 1 7 . 1 1 96 96 GLU H H 96 7.680 7.680 7.915 -0.235 25259 5227 1 7 . 1 1 97 97 ALA N N 97 124.797 124.797 122.282 2.515 25259 5228 1 7 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.802 0.023 25259 5229 1 7 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.559 -2.262 25259 5230 1 7 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.615 -2.626 25259 5231 1 7 . 1 1 97 97 ALA H H 97 7.383 7.383 7.438 -0.055 25259 5232 1 7 . 1 1 98 98 ARG N N 98 115.469 115.469 115.472 -0.003 25259 5233 1 7 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.323 -0.017 25259 5234 1 7 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.508 -1.018 25259 5235 1 7 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.867 -1.629 25259 5236 1 7 . 1 1 98 98 ARG H H 98 8.229 8.229 8.138 0.091 25259 5237 1 7 . 1 1 99 99 LYS N N 99 120.219 120.219 117.642 2.577 25259 5238 1 7 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.122 0.136 25259 5239 1 7 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.530 -2.289 25259 5240 1 7 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.251 -1.755 25259 5241 1 7 . 1 1 99 99 LYS H H 99 7.270 7.270 7.427 -0.157 25259 5242 1 7 . 1 1 100 100 LEU N N 100 123.800 123.800 119.670 4.130 25259 5243 1 7 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.351 -0.010 25259 5244 1 7 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.244 -2.165 25259 5245 1 7 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.322 -3.192 25259 5246 1 7 . 1 1 100 100 LEU H H 100 7.837 7.837 7.711 0.126 25259 5247 1 7 . 1 1 101 101 ALA N N 101 130.512 130.512 124.531 5.981 25259 5248 1 7 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.446 -0.070 25259 5249 1 7 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.190 -2.786 25259 5250 1 7 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.877 -3.081 25259 5251 1 7 . 1 1 101 101 ALA H H 101 8.213 8.213 8.968 -0.755 25259 5252 1 7 . 1 1 102 102 GLY N N 102 110.659 110.659 105.275 5.384 25259 5253 1 7 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.563 -0.670 25259 5254 1 7 . 1 1 102 102 GLY H H 102 8.738 8.738 7.982 0.756 25259 5255 1 7 . 1 1 103 103 PHE N N 103 123.097 123.097 121.748 1.349 25259 5256 1 7 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.484 -0.264 25259 5257 1 7 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.195 -2.427 25259 5258 1 7 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.553 -1.979 25259 5259 1 7 . 1 1 103 103 PHE H H 103 7.514 7.514 7.423 0.091 25259 5260 1 7 . 1 1 104 104 LYS N N 104 130.652 130.652 125.026 5.626 25259 5261 1 7 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.339 -0.219 25259 5262 1 7 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.441 -1.462 25259 5263 1 7 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.862 -2.625 25259 5264 1 7 . 1 1 104 104 LYS H H 104 7.473 7.473 8.064 -0.591 25259 5265 1 7 . 1 1 105 105 LEU N N 105 127.372 127.372 123.438 3.934 25259 5266 1 7 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.031 -0.035 25259 5267 1 7 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.238 -2.502 25259 5268 1 7 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.072 -1.108 25259 5269 1 7 . 1 1 105 105 LEU H H 105 8.393 8.393 8.180 0.213 25259 5270 1 7 . 1 1 106 106 GLU N N 106 129.358 129.358 125.661 3.697 25259 5271 1 7 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.663 0.181 25259 5272 1 7 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.888 -2.098 25259 5273 1 7 . 1 1 106 106 GLU CB C 106 31.628 31.628 34.186 -2.558 25259 5274 1 7 . 1 1 106 106 GLU H H 106 8.849 8.849 8.690 0.159 25259 5275 1 7 . 1 1 107 107 THR N N 107 131.118 131.118 116.801 14.317 25259 5276 1 7 . 1 1 107 107 THR HA H 107 5.110 5.110 5.063 0.047 25259 5277 1 7 . 1 1 107 107 THR CA C 107 59.832 59.832 60.406 -0.574 25259 5278 1 7 . 1 1 107 107 THR CB C 107 66.671 66.671 71.110 -4.439 25259 5279 1 7 . 1 1 107 107 THR H H 107 9.433 9.433 8.261 1.172 25259 5280 1 7 . 1 1 108 108 LYS N N 108 129.114 129.114 123.193 5.921 25259 5281 1 7 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.655 0.169 25259 5282 1 7 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.630 -2.436 25259 5283 1 7 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.937 -1.549 25259 5284 1 7 . 1 1 108 108 LYS H H 108 9.410 9.410 9.240 0.170 25259 5285 1 7 . 1 1 109 109 LEU N N 109 129.323 129.323 127.367 1.956 25259 5286 1 7 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.503 0.201 25259 5287 1 7 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.282 -2.174 25259 5288 1 7 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.177 -2.522 25259 5289 1 7 . 1 1 109 109 LEU H H 109 8.862 8.862 8.567 0.295 25259 5290 1 7 . 1 1 110 110 LEU N N 110 129.123 129.123 127.430 1.693 25259 5291 1 7 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.132 0.091 25259 5292 1 7 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.887 -3.105 25259 5293 1 7 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.321 -1.660 25259 5294 1 7 . 1 1 110 110 LEU H H 110 8.373 8.373 8.261 0.112 25259 5295 1 7 . 1 1 111 111 SER N N 111 114.587 114.587 110.199 4.388 25259 5296 1 7 . 1 1 111 111 SER HA H 111 4.557 4.557 4.605 -0.048 25259 5297 1 7 . 1 1 111 111 SER CA C 111 53.889 53.889 57.658 -3.769 25259 5298 1 7 . 1 1 111 111 SER CB C 111 61.830 61.830 64.913 -3.083 25259 5299 1 7 . 1 1 111 111 SER H H 111 8.400 8.400 7.879 0.521 25259 5300 1 7 . 1 1 112 112 ALA N N 112 118.269 118.269 122.718 -4.449 25259 5301 1 7 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.316 -0.007 25259 5302 1 7 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.570 -3.356 25259 5303 1 7 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.413 -1.825 25259 5304 1 7 . 1 1 112 112 ALA H H 112 8.556 8.556 8.574 -0.018 25259 5305 1 7 . 1 1 113 113 THR N N 113 102.878 102.878 101.964 0.914 25259 5306 1 7 . 1 1 113 113 THR HA H 113 4.662 4.662 4.502 0.160 25259 5307 1 7 . 1 1 113 113 THR CA C 113 58.689 58.689 61.526 -2.837 25259 5308 1 7 . 1 1 113 113 THR CB C 113 67.905 67.905 70.531 -2.627 25259 5309 1 7 . 1 1 113 113 THR H H 113 8.065 8.065 7.659 0.406 25259 5310 1 7 . 1 1 114 114 GLU N N 114 126.514 126.514 121.032 5.482 25259 5311 1 7 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.140 -0.126 25259 5312 1 7 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.429 -1.422 25259 5313 1 7 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.517 -1.604 25259 5314 1 7 . 1 1 114 114 GLU H H 114 7.357 7.357 7.783 -0.426 25259 5315 1 7 . 1 1 115 115 LEU N N 115 128.058 128.058 120.377 7.681 25259 5316 1 7 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.471 -0.549 25259 5317 1 7 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.252 -0.928 25259 5318 1 7 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.879 -1.740 25259 5319 1 7 . 1 1 115 115 LEU H H 115 8.930 8.930 8.611 0.319 25259 5320 1 7 . 1 1 116 116 GLN N N 116 126.540 126.540 118.151 8.389 25259 5321 1 7 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.124 0.591 25259 5322 1 7 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.739 -3.039 25259 5323 1 7 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.217 -0.925 25259 5324 1 7 . 1 1 116 116 GLN H H 116 9.221 9.221 8.900 0.321 25259 5325 1 7 . 1 1 117 117 THR N N 117 125.213 125.213 120.029 5.184 25259 5326 1 7 . 1 1 117 117 THR HA H 117 5.353 5.353 5.310 0.043 25259 5327 1 7 . 1 1 117 117 THR CA C 117 58.926 58.926 60.907 -1.981 25259 5328 1 7 . 1 1 117 117 THR CB C 117 68.948 68.948 72.254 -3.305 25259 5329 1 7 . 1 1 117 117 THR H H 117 9.030 9.030 8.889 0.141 25259 5330 1 7 . 1 1 118 118 THR N N 118 127.799 127.799 118.785 9.014 25259 5331 1 7 . 1 1 118 118 THR HA H 118 5.527 5.527 5.144 0.383 25259 5332 1 7 . 1 1 118 118 THR CA C 118 59.201 59.201 61.894 -2.693 25259 5333 1 7 . 1 1 118 118 THR CB C 118 67.721 67.721 72.256 -4.535 25259 5334 1 7 . 1 1 118 118 THR H H 118 9.459 9.459 8.571 0.888 25259 5335 1 7 . 1 1 119 119 THR N N 119 129.258 129.258 121.957 7.301 25259 5336 1 7 . 1 1 119 119 THR HA H 119 4.885 4.885 4.723 0.162 25259 5337 1 7 . 1 1 119 119 THR CA C 119 58.463 58.463 61.255 -2.792 25259 5338 1 7 . 1 1 119 119 THR CB C 119 67.459 67.459 70.716 -3.257 25259 5339 1 7 . 1 1 119 119 THR H H 119 9.147 9.147 8.801 0.346 25259 5340 1 7 . 1 1 120 120 SER N N 120 123.389 123.389 120.046 3.343 25259 5341 1 7 . 1 1 120 120 SER HA H 120 5.328 5.328 5.058 0.270 25259 5342 1 7 . 1 1 120 120 SER CA C 120 54.386 54.386 56.384 -1.998 25259 5343 1 7 . 1 1 120 120 SER CB C 120 63.031 63.031 64.975 -1.944 25259 5344 1 7 . 1 1 120 120 SER H H 120 8.786 8.786 8.671 0.115 25259 5345 1 7 . 1 1 121 121 PHE N N 121 121.245 121.245 122.663 -1.418 25259 5346 1 7 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.929 0.183 25259 5347 1 7 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.389 -3.197 25259 5348 1 7 . 1 1 121 121 PHE CB C 121 40.265 40.265 40.627 -0.361 25259 5349 1 7 . 1 1 121 121 PHE H H 121 8.831 8.831 9.229 -0.398 25259 5350 1 7 . 1 1 122 122 ASP N N 122 124.765 124.765 125.892 -1.127 25259 5351 1 7 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.912 -0.072 25259 5352 1 7 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.925 -4.088 25259 5353 1 7 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.003 -1.518 25259 5354 1 7 . 1 1 122 122 ASP H H 122 8.819 8.819 8.837 -0.018 25259 5355 1 7 . 1 1 123 123 PHE N N 123 124.303 124.303 122.417 1.886 25259 5356 1 7 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.141 0.533 25259 5357 1 7 . 1 1 123 123 PHE CA C 123 57.798 57.798 61.565 -3.767 25259 5358 1 7 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.700 -3.160 25259 5359 1 7 . 1 1 123 123 PHE H H 123 8.262 8.262 7.948 0.314 25259 5360 1 7 . 1 1 124 124 GLN N N 124 120.792 120.792 117.635 3.157 25259 5361 1 7 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.174 0.260 25259 5362 1 7 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.396 -2.313 25259 5363 1 7 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.952 -1.823 25259 5364 1 7 . 1 1 124 124 GLN H H 124 8.954 8.954 8.046 0.908 25259 5365 1 7 . 1 1 125 125 VAL N N 125 114.091 114.091 110.649 3.442 25259 5366 1 7 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.396 0.013 25259 5367 1 7 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.425 -2.127 25259 5368 1 7 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.121 -0.549 25259 5369 1 7 . 1 1 125 125 VAL H H 125 7.026 7.026 7.813 -0.787 25259 5370 1 7 . 1 1 126 126 LEU N N 126 125.158 125.158 123.282 1.876 25259 5371 1 7 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.310 0.165 25259 5372 1 7 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.806 -1.631 25259 5373 1 7 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.643 -0.589 25259 5374 1 7 . 1 1 126 126 LEU H H 126 8.106 8.106 7.739 0.367 25259 5375 1 7 . 1 1 127 127 ASP N N 127 130.026 130.026 129.097 0.929 25259 5376 1 7 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.599 0.242 25259 5377 1 7 . 1 1 127 127 ASP CA C 127 50.198 50.198 54.398 -4.200 25259 5378 1 7 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.280 -2.591 25259 5379 1 7 . 1 1 127 127 ASP H H 127 9.129 9.129 8.968 0.161 25259 5380 1 7 . 1 1 128 128 VAL N N 128 128.833 128.833 123.828 5.005 25259 5381 1 7 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.745 -0.221 25259 5382 1 7 . 1 1 128 128 VAL CA C 128 63.668 63.668 64.970 -1.302 25259 5383 1 7 . 1 1 128 128 VAL CB C 128 29.495 29.495 32.180 -2.685 25259 5384 1 7 . 1 1 128 128 VAL H H 128 8.288 8.288 8.117 0.171 25259 5385 1 7 . 1 1 129 129 LYS N N 129 123.914 123.914 117.487 6.427 25259 5386 1 7 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.025 0.018 25259 5387 1 7 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.874 -2.085 25259 5388 1 7 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.610 -2.673 25259 5389 1 7 . 1 1 129 129 LYS H H 129 8.226 8.226 8.534 -0.308 25259 5390 1 7 . 1 1 130 130 LYS N N 130 121.888 121.888 117.680 4.208 25259 5391 1 7 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.291 -0.206 25259 5392 1 7 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.346 -1.200 25259 5393 1 7 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.883 -2.543 25259 5394 1 7 . 1 1 130 130 LYS H H 130 7.590 7.590 7.634 -0.044 25259 5395 1 7 . 1 1 131 131 ALA N N 131 123.088 123.088 122.659 0.429 25259 5396 1 7 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.159 -0.232 25259 5397 1 7 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.023 -2.621 25259 5398 1 7 . 1 1 131 131 ALA CB C 131 16.447 16.447 17.959 -1.512 25259 5399 1 7 . 1 1 131 131 ALA H H 131 8.506 8.506 7.729 0.777 25259 5400 1 7 . 1 1 132 132 SER N N 132 110.456 110.456 112.391 -1.935 25259 5401 1 7 . 1 1 132 132 SER HA H 132 4.117 4.117 4.275 -0.158 25259 5402 1 7 . 1 1 132 132 SER CA C 132 58.289 58.289 59.850 -1.561 25259 5403 1 7 . 1 1 132 132 SER CB C 132 61.034 61.034 63.110 -2.076 25259 5404 1 7 . 1 1 132 132 SER H H 132 7.986 7.986 7.836 0.150 25259 5405 1 7 . 1 1 133 133 GLN N N 133 119.034 119.034 118.419 0.615 25259 5406 1 7 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.574 -0.172 25259 5407 1 7 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.458 -1.933 25259 5408 1 7 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.650 -1.416 25259 5409 1 7 . 1 1 133 133 GLN H H 133 7.233 7.233 7.697 -0.464 25259 5410 1 7 . 1 1 134 134 LEU N N 134 123.291 123.291 121.001 2.290 25259 5411 1 7 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.679 -0.286 25259 5412 1 7 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.302 -0.986 25259 5413 1 7 . 1 1 134 134 LEU CB C 134 38.847 38.847 44.784 -5.937 25259 5414 1 7 . 1 1 134 134 LEU H H 134 7.411 7.411 7.494 -0.083 25259 5415 1 7 . 1 1 135 135 GLU N N 135 128.446 128.446 124.764 3.682 25259 5416 1 7 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.877 0.069 25259 5417 1 7 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.833 -2.449 25259 5418 1 7 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.582 -2.286 25259 5419 1 7 . 1 1 135 135 GLU H H 135 8.986 8.986 9.027 -0.041 25259 5420 1 7 . 1 1 136 136 HIS N N 136 117.593 117.593 117.416 0.177 25259 5421 1 7 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.426 -0.043 25259 5422 1 7 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.282 -1.597 25259 5423 1 7 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.734 -1.321 25259 5424 1 7 . 1 1 136 136 HIS H H 136 9.226 9.226 8.475 0.751 25259 5425 1 7 . 1 1 137 137 LEU N N 137 115.463 115.463 116.321 -0.858 25259 5426 1 7 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.606 -0.099 25259 5427 1 7 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.261 -2.313 25259 5428 1 7 . 1 1 137 137 LEU CB C 137 39.807 39.807 43.104 -3.297 25259 5429 1 7 . 1 1 137 137 LEU H H 137 7.090 7.090 7.880 -0.790 25259 5430 1 7 . 1 1 138 138 LYS N N 138 124.686 124.686 120.935 3.751 25259 5431 1 7 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.028 0.141 25259 5432 1 7 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.689 -1.531 25259 5433 1 7 . 1 1 138 138 LYS CB C 138 30.088 30.088 31.963 -1.875 25259 5434 1 7 . 1 1 138 138 LYS H H 138 7.698 7.698 7.707 -0.009 25259 5435 1 7 . 1 1 139 139 ASN N N 139 118.077 118.077 116.612 1.465 25259 5436 1 7 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.607 0.066 25259 5437 1 7 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.882 -2.100 25259 5438 1 7 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.738 -2.921 25259 5439 1 7 . 1 1 139 139 ASN H H 139 8.485 8.485 8.355 0.130 25259 5440 1 7 . 1 1 140 140 ILE N N 140 120.880 120.880 119.281 1.599 25259 5441 1 7 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.208 -0.178 25259 5442 1 7 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.514 -0.948 25259 5443 1 7 . 1 1 140 140 ILE CB C 140 35.774 35.774 39.020 -3.245 25259 5444 1 7 . 1 1 140 140 ILE H H 140 7.549 7.549 7.581 -0.032 25259 5445 1 7 . 1 1 141 141 GLY N N 141 110.676 110.676 111.709 -1.033 25259 5446 1 7 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.034 0.630 25259 5447 1 7 . 1 1 141 141 GLY H H 141 7.663 7.663 8.387 -0.724 25259 5448 1 7 . 1 1 142 142 LEU N N 142 123.857 123.857 123.795 0.062 25259 5449 1 7 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.909 -0.216 25259 5450 1 7 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.976 -2.783 25259 5451 1 7 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.556 -0.947 25259 5452 1 7 . 1 1 142 142 LEU H H 142 8.496 8.496 7.680 0.816 25259 5453 1 7 . 1 1 143 143 GLU N N 143 118.407 118.407 117.645 0.762 25259 5454 1 7 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.928 -0.142 25259 5455 1 7 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.996 -1.774 25259 5456 1 7 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.895 -2.382 25259 5457 1 7 . 1 1 143 143 GLU H H 143 8.672 8.672 8.573 0.099 25259 5458 1 7 . 1 1 144 144 ASN N N 144 118.477 118.477 114.613 3.864 25259 5459 1 7 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.540 -0.098 25259 5460 1 7 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.335 -1.623 25259 5461 1 7 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.472 -2.517 25259 5462 1 7 . 1 1 144 144 ASN H H 144 7.656 7.656 7.898 -0.242 25259 5463 1 7 . 1 1 145 145 LEU N N 145 125.354 125.354 118.949 6.405 25259 5464 1 7 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.948 -0.151 25259 5465 1 7 . 1 1 145 145 LEU CA C 145 56.323 56.323 56.188 0.135 25259 5466 1 7 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.587 -3.014 25259 5467 1 7 . 1 1 145 145 LEU H H 145 7.758 7.758 7.228 0.530 25259 5468 1 7 . 1 1 146 146 LEU N N 146 116.372 116.372 118.924 -2.552 25259 5469 1 7 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.868 0.008 25259 5470 1 7 . 1 1 146 146 LEU CA C 146 53.243 53.243 56.213 -2.970 25259 5471 1 7 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.215 -2.318 25259 5472 1 7 . 1 1 146 146 LEU H H 146 7.242 7.242 7.661 -0.419 25259 5473 1 7 . 1 1 147 147 LYS N N 147 120.054 120.054 116.716 3.338 25259 5474 1 7 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.253 0.059 25259 5475 1 7 . 1 1 147 147 LYS CA C 147 54.623 54.623 56.477 -1.854 25259 5476 1 7 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.760 -2.500 25259 5477 1 7 . 1 1 147 147 LYS H H 147 7.185 7.185 8.109 -0.924 25259 5478 1 7 . 1 1 148 148 ASN N N 148 119.498 119.498 118.194 1.304 25259 5479 1 7 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.781 0.181 25259 5480 1 7 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.112 -2.338 25259 5481 1 7 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.071 -0.585 25259 5482 1 7 . 1 1 148 148 ASN H H 148 7.698 7.698 7.622 0.076 25259 5483 1 7 . 1 1 149 149 GLU N N 149 122.834 122.834 119.400 3.434 25259 5484 1 7 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.276 0.326 25259 5485 1 7 . 1 1 149 149 GLU CA C 149 52.219 52.219 55.868 -3.649 25259 5486 1 7 . 1 1 149 149 GLU CB C 149 26.810 26.810 30.058 -3.248 25259 5487 1 7 . 1 1 149 149 GLU H H 149 8.767 8.767 8.659 0.108 25259 5488 1 7 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.841 0.767 25259 5489 1 7 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.817 -1.575 25259 5490 1 7 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.346 -3.251 25259 5491 1 7 . 1 1 151 151 SER N N 151 112.839 112.839 112.258 0.581 25259 5492 1 7 . 1 1 151 151 SER HA H 151 3.835 3.835 4.094 -0.259 25259 5493 1 7 . 1 1 151 151 SER CA C 151 59.270 59.270 59.465 -0.195 25259 5494 1 7 . 1 1 151 151 SER CB C 151 59.451 59.451 62.816 -3.365 25259 5495 1 7 . 1 1 151 151 SER H H 151 8.519 8.519 7.695 0.824 25259 5496 1 7 . 1 1 152 152 LYS N N 152 126.710 126.710 120.504 6.206 25259 5497 1 7 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.097 0.151 25259 5498 1 7 . 1 1 152 152 LYS CA C 152 55.765 55.765 58.886 -3.121 25259 5499 1 7 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.465 -2.208 25259 5500 1 7 . 1 1 152 152 LYS H H 152 7.006 7.006 7.666 -0.660 25259 5501 1 7 . 1 1 153 153 TYR N N 153 123.239 123.239 113.824 9.415 25259 5502 1 7 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.786 -0.528 25259 5503 1 7 . 1 1 153 153 TYR CA C 153 59.309 59.309 56.161 3.148 25259 5504 1 7 . 1 1 153 153 TYR CB C 153 36.334 36.334 38.664 -2.330 25259 5505 1 7 . 1 1 153 153 TYR H H 153 8.058 8.058 7.824 0.234 25259 5506 1 7 . 1 1 154 154 ILE N N 154 120.253 120.253 123.698 -3.445 25259 5507 1 7 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.143 0.230 25259 5508 1 7 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.877 -2.763 25259 5509 1 7 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.510 -1.562 25259 5510 1 7 . 1 1 154 154 ILE H H 154 8.193 8.193 7.288 0.905 25259 5511 1 7 . 1 1 155 155 SER N N 155 117.178 117.178 114.809 2.369 25259 5512 1 7 . 1 1 155 155 SER HA H 155 4.091 4.091 4.091 -0.000 25259 5513 1 7 . 1 1 155 155 SER CA C 155 59.961 59.961 61.672 -1.712 25259 5514 1 7 . 1 1 155 155 SER CB C 155 60.148 60.148 62.847 -2.699 25259 5515 1 7 . 1 1 155 155 SER H H 155 8.020 8.020 8.159 -0.139 25259 5516 1 7 . 1 1 156 156 ASP N N 156 125.479 125.479 122.145 3.334 25259 5517 1 7 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.459 -0.032 25259 5518 1 7 . 1 1 156 156 ASP CA C 156 54.760 54.760 57.029 -2.269 25259 5519 1 7 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.965 -3.092 25259 5520 1 7 . 1 1 156 156 ASP H H 156 8.638 8.638 8.238 0.400 25259 5521 1 7 . 1 1 157 157 ARG N N 157 121.542 121.542 120.004 1.538 25259 5522 1 7 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.002 0.109 25259 5523 1 7 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.654 -2.726 25259 5524 1 7 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.721 -1.905 25259 5525 1 7 . 1 1 157 157 ARG H H 157 7.888 7.888 8.032 -0.144 25259 5526 1 7 . 1 1 158 158 LEU N N 158 124.257 124.257 119.927 4.330 25259 5527 1 7 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.275 -0.004 25259 5528 1 7 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.155 -2.942 25259 5529 1 7 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.965 -2.020 25259 5530 1 7 . 1 1 158 158 LEU H H 158 8.442 8.442 7.993 0.449 25259 5531 1 7 . 1 1 159 159 ALA N N 159 124.146 124.146 120.631 3.515 25259 5532 1 7 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.051 0.281 25259 5533 1 7 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.583 -3.151 25259 5534 1 7 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.279 -2.372 25259 5535 1 7 . 1 1 159 159 ALA H H 159 8.086 8.086 8.279 -0.193 25259 5536 1 7 . 1 1 160 160 ASN N N 160 118.093 118.093 115.739 2.354 25259 5537 1 7 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.708 0.284 25259 5538 1 7 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.688 -3.111 25259 5539 1 7 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.298 -1.565 25259 5540 1 7 . 1 1 160 160 ASN H H 160 7.445 7.445 8.017 -0.572 25259 5541 1 7 . 1 1 161 161 GLY N N 161 108.365 108.365 105.682 2.683 25259 5542 1 7 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.907 -1.261 25259 5543 1 7 . 1 1 161 161 GLY H H 161 7.743 7.743 8.009 -0.266 25259 5544 1 7 . 1 1 162 162 ALA N N 162 123.928 123.928 123.302 0.626 25259 5545 1 7 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.000 -0.127 25259 5546 1 7 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.119 -1.593 25259 5547 1 7 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.287 -3.227 25259 5548 1 7 . 1 1 162 162 ALA H H 162 8.035 8.035 7.651 0.384 25259 5549 1 7 . 1 1 163 163 THR N N 163 113.286 113.286 110.915 2.371 25259 5550 1 7 . 1 1 163 163 THR HA H 163 4.703 4.703 4.764 -0.061 25259 5551 1 7 . 1 1 163 163 THR CA C 163 57.791 57.791 59.908 -2.117 25259 5552 1 7 . 1 1 163 163 THR CB C 163 68.974 68.974 71.353 -2.379 25259 5553 1 7 . 1 1 163 163 THR H H 163 8.451 8.451 8.570 -0.119 25259 5554 1 7 . 1 1 164 164 GLU N N 164 125.905 125.905 118.646 7.259 25259 5555 1 7 . 1 1 164 164 GLU HA H 164 5.060 5.060 5.139 -0.079 25259 5556 1 7 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.485 -0.900 25259 5557 1 7 . 1 1 164 164 GLU CB C 164 29.211 29.211 33.613 -4.402 25259 5558 1 7 . 1 1 164 164 GLU H H 164 8.716 8.716 8.374 0.342 25259 5559 1 8 . 1 1 2 2 PRO HA H 2 4.675 4.675 4.582 0.093 25259 5560 1 8 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.466 -1.658 25259 5561 1 8 . 1 1 2 2 PRO CB C 2 30.070 30.070 31.067 -0.997 25259 5562 1 8 . 1 1 3 3 ALA N N 3 126.741 126.741 125.760 0.981 25259 5563 1 8 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.904 -0.410 25259 5564 1 8 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.536 -1.334 25259 5565 1 8 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.425 -4.607 25259 5566 1 8 . 1 1 3 3 ALA H H 3 8.440 8.440 7.841 0.599 25259 5567 1 8 . 1 1 4 4 THR N N 4 116.015 116.015 112.701 3.314 25259 5568 1 8 . 1 1 4 4 THR HA H 4 4.393 4.393 4.711 -0.318 25259 5569 1 8 . 1 1 4 4 THR CA C 4 59.148 59.148 61.401 -2.253 25259 5570 1 8 . 1 1 4 4 THR CB C 4 67.580 67.580 70.326 -2.746 25259 5571 1 8 . 1 1 4 4 THR H H 4 8.050 8.050 9.097 -1.047 25259 5572 1 8 . 1 1 5 5 LYS N N 5 126.350 126.350 120.508 5.842 25259 5573 1 8 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.699 -0.194 25259 5574 1 8 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.432 -1.515 25259 5575 1 8 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.053 -3.369 25259 5576 1 8 . 1 1 5 5 LYS H H 5 8.332 8.332 8.388 -0.056 25259 5577 1 8 . 1 1 6 6 THR N N 6 118.124 118.124 113.897 4.227 25259 5578 1 8 . 1 1 6 6 THR HA H 6 4.440 4.440 4.687 -0.247 25259 5579 1 8 . 1 1 6 6 THR CA C 6 59.282 59.282 61.722 -2.440 25259 5580 1 8 . 1 1 6 6 THR CB C 6 67.685 67.685 69.724 -2.039 25259 5581 1 8 . 1 1 6 6 THR H H 6 8.283 8.283 8.317 -0.034 25259 5582 1 8 . 1 1 7 7 GLU N N 7 125.934 125.934 121.038 4.896 25259 5583 1 8 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.477 -0.133 25259 5584 1 8 . 1 1 7 7 GLU CA C 7 54.181 54.181 56.473 -2.292 25259 5585 1 8 . 1 1 7 7 GLU CB C 7 27.816 27.816 30.797 -2.981 25259 5586 1 8 . 1 1 7 7 GLU H H 7 8.487 8.487 8.459 0.028 25259 5587 1 8 . 1 1 8 8 LYS N N 8 123.945 123.945 119.414 4.531 25259 5588 1 8 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.603 -1.668 25259 5589 1 8 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.136 -3.571 25259 5590 1 8 . 1 1 8 8 LYS H H 8 8.278 8.278 7.900 0.378 25259 5591 1 8 . 1 1 9 9 ASP N N 9 123.624 123.624 119.878 3.746 25259 5592 1 8 . 1 1 9 9 ASP HA H 9 4.339 4.339 5.006 -0.667 25259 5593 1 8 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.915 -1.792 25259 5594 1 8 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.955 -4.022 25259 5595 1 8 . 1 1 9 9 ASP H H 9 8.277 8.277 8.465 -0.188 25259 5596 1 8 . 1 1 10 10 THR N N 10 116.812 116.812 118.273 -1.461 25259 5597 1 8 . 1 1 10 10 THR HA H 10 4.349 4.349 4.517 -0.168 25259 5598 1 8 . 1 1 10 10 THR CA C 10 59.634 59.634 62.184 -2.550 25259 5599 1 8 . 1 1 10 10 THR CB C 10 67.254 67.254 69.391 -2.137 25259 5600 1 8 . 1 1 10 10 THR H H 10 8.049 8.049 8.246 -0.197 25259 5601 1 8 . 1 1 11 11 LEU N N 11 126.610 126.610 126.701 -0.091 25259 5602 1 8 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.635 -0.243 25259 5603 1 8 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.503 -1.425 25259 5604 1 8 . 1 1 11 11 LEU CB C 11 39.633 39.633 43.757 -4.124 25259 5605 1 8 . 1 1 11 11 LEU H H 11 8.191 8.191 8.393 -0.202 25259 5606 1 8 . 1 1 12 12 GLN N N 12 123.274 123.274 123.412 -0.138 25259 5607 1 8 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.208 0.174 25259 5608 1 8 . 1 1 12 12 GLN CA C 12 53.574 53.574 57.037 -3.463 25259 5609 1 8 . 1 1 12 12 GLN CB C 12 26.803 26.803 29.079 -2.276 25259 5610 1 8 . 1 1 12 12 GLN H H 12 8.280 8.280 8.546 -0.266 25259 5611 1 8 . 1 1 13 13 SER N N 13 119.027 119.027 116.709 2.318 25259 5612 1 8 . 1 1 13 13 SER HA H 13 4.471 4.471 4.569 -0.098 25259 5613 1 8 . 1 1 13 13 SER CA C 13 55.869 55.869 57.955 -2.086 25259 5614 1 8 . 1 1 13 13 SER CB C 13 61.424 61.424 64.411 -2.987 25259 5615 1 8 . 1 1 13 13 SER H H 13 8.178 8.178 8.235 -0.057 25259 5616 1 8 . 1 1 14 14 ALA N N 14 128.314 128.314 126.669 1.645 25259 5617 1 8 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.613 -0.179 25259 5618 1 8 . 1 1 14 14 ALA CA C 14 49.696 49.696 52.283 -2.587 25259 5619 1 8 . 1 1 14 14 ALA CB C 14 17.081 17.081 17.722 -0.641 25259 5620 1 8 . 1 1 14 14 ALA H H 14 8.195 8.195 8.560 -0.365 25259 5621 1 8 . 1 1 15 15 LEU N N 15 125.175 125.175 121.666 3.509 25259 5622 1 8 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.775 -0.135 25259 5623 1 8 . 1 1 15 15 LEU CA C 15 50.604 50.604 52.742 -2.139 25259 5624 1 8 . 1 1 15 15 LEU CB C 15 39.467 39.467 44.535 -5.069 25259 5625 1 8 . 1 1 15 15 LEU H H 15 8.050 8.050 7.629 0.421 25259 5626 1 8 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.582 -0.078 25259 5627 1 8 . 1 1 16 16 PRO CA C 16 60.631 60.631 63.064 -2.433 25259 5628 1 8 . 1 1 16 16 PRO CB C 16 29.658 29.658 31.824 -2.166 25259 5629 1 8 . 1 1 17 17 VAL N N 17 123.223 123.223 117.001 6.222 25259 5630 1 8 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.433 -0.299 25259 5631 1 8 . 1 1 17 17 VAL CA C 17 59.827 59.827 59.817 0.010 25259 5632 1 8 . 1 1 17 17 VAL CB C 17 30.377 30.377 34.540 -4.163 25259 5633 1 8 . 1 1 17 17 VAL H H 17 8.134 8.134 7.783 0.351 25259 5634 1 8 . 1 1 18 18 ILE N N 18 127.777 127.777 117.488 10.289 25259 5635 1 8 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.259 -0.016 25259 5636 1 8 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.861 -3.539 25259 5637 1 8 . 1 1 18 18 ILE CB C 18 36.254 36.254 37.992 -1.738 25259 5638 1 8 . 1 1 18 18 ILE H H 18 8.187 8.187 8.090 0.097 25259 5639 1 8 . 1 1 19 19 GLU N N 19 128.148 128.148 123.292 4.856 25259 5640 1 8 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.598 -0.261 25259 5641 1 8 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.520 -1.429 25259 5642 1 8 . 1 1 19 19 GLU CB C 19 28.176 28.176 31.100 -2.924 25259 5643 1 8 . 1 1 19 19 GLU H H 19 8.475 8.475 8.710 -0.235 25259 5644 1 8 . 1 1 20 20 ASN N N 20 122.788 122.788 118.162 4.626 25259 5645 1 8 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.446 -0.751 25259 5646 1 8 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.556 -1.734 25259 5647 1 8 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.845 -4.479 25259 5648 1 8 . 1 1 20 20 ASN H H 20 8.477 8.477 8.911 -0.434 25259 5649 1 8 . 1 1 21 21 ALA N N 21 127.253 127.253 122.557 4.696 25259 5650 1 8 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.939 -0.619 25259 5651 1 8 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.660 -0.972 25259 5652 1 8 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.948 -4.035 25259 5653 1 8 . 1 1 21 21 ALA H H 21 8.325 8.325 8.767 -0.442 25259 5654 1 8 . 1 1 22 22 GLU N N 22 122.044 122.044 118.222 3.822 25259 5655 1 8 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.351 -0.058 25259 5656 1 8 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.053 -1.470 25259 5657 1 8 . 1 1 22 22 GLU CB C 22 27.285 27.285 30.027 -2.742 25259 5658 1 8 . 1 1 22 22 GLU H H 22 8.415 8.415 8.519 -0.104 25259 5659 1 8 . 1 1 23 23 LYS N N 23 123.622 123.622 120.102 3.520 25259 5660 1 8 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.630 -0.305 25259 5661 1 8 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.263 -1.767 25259 5662 1 8 . 1 1 23 23 LYS CB C 23 30.653 30.653 31.986 -1.333 25259 5663 1 8 . 1 1 23 23 LYS H H 23 8.127 8.127 8.313 -0.186 25259 5664 1 8 . 1 1 24 24 ASN N N 24 120.652 120.652 119.754 0.898 25259 5665 1 8 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.904 -0.063 25259 5666 1 8 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.036 -1.373 25259 5667 1 8 . 1 1 24 24 ASN CB C 24 36.775 36.775 40.780 -4.005 25259 5668 1 8 . 1 1 24 24 ASN H H 24 8.424 8.424 7.849 0.575 25259 5669 1 8 . 1 1 25 25 THR N N 25 117.102 117.102 115.064 2.038 25259 5670 1 8 . 1 1 25 25 THR HA H 25 4.367 4.367 4.426 -0.059 25259 5671 1 8 . 1 1 25 25 THR CA C 25 59.500 59.500 62.665 -3.165 25259 5672 1 8 . 1 1 25 25 THR CB C 25 67.610 67.610 69.005 -1.395 25259 5673 1 8 . 1 1 25 25 THR H H 25 7.852 7.852 8.295 -0.443 25259 5674 1 8 . 1 1 26 26 VAL N N 26 126.491 126.491 127.389 -0.898 25259 5675 1 8 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.563 -0.396 25259 5676 1 8 . 1 1 26 26 VAL CA C 26 60.193 60.193 60.828 -0.635 25259 5677 1 8 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.854 -5.249 25259 5678 1 8 . 1 1 26 26 VAL H H 26 8.080 8.080 8.506 -0.426 25259 5679 1 8 . 1 1 27 27 VAL N N 27 132.992 132.992 125.150 7.842 25259 5680 1 8 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.545 -0.464 25259 5681 1 8 . 1 1 27 27 VAL CA C 27 58.984 58.984 59.926 -0.942 25259 5682 1 8 . 1 1 27 27 VAL CB C 27 31.540 31.540 33.078 -1.538 25259 5683 1 8 . 1 1 27 27 VAL H H 27 8.830 8.830 8.950 -0.120 25259 5684 1 8 . 1 1 28 28 THR N N 28 123.576 123.576 118.278 5.298 25259 5685 1 8 . 1 1 28 28 THR HA H 28 5.553 5.553 4.783 0.770 25259 5686 1 8 . 1 1 28 28 THR CA C 28 58.738 58.738 61.297 -2.559 25259 5687 1 8 . 1 1 28 28 THR CB C 28 68.443 68.443 70.402 -1.959 25259 5688 1 8 . 1 1 28 28 THR H H 28 8.165 8.165 8.104 0.061 25259 5689 1 8 . 1 1 29 29 LYS N N 29 129.099 129.099 128.218 0.881 25259 5690 1 8 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.630 0.312 25259 5691 1 8 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.418 -3.639 25259 5692 1 8 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.523 0.574 25259 5693 1 8 . 1 1 29 29 LYS H H 29 9.273 9.273 9.027 0.246 25259 5694 1 8 . 1 1 30 30 THR N N 30 123.510 123.510 116.023 7.487 25259 5695 1 8 . 1 1 30 30 THR HA H 30 5.428 5.428 5.233 0.195 25259 5696 1 8 . 1 1 30 30 THR CA C 30 59.784 59.784 61.697 -1.913 25259 5697 1 8 . 1 1 30 30 THR CB C 30 67.818 67.818 71.931 -4.113 25259 5698 1 8 . 1 1 30 30 THR H H 30 8.993 8.993 8.201 0.792 25259 5699 1 8 . 1 1 31 31 LEU N N 31 128.293 128.293 122.470 5.823 25259 5700 1 8 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.968 0.252 25259 5701 1 8 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.309 -3.254 25259 5702 1 8 . 1 1 31 31 LEU CB C 31 43.399 43.399 46.429 -3.030 25259 5703 1 8 . 1 1 31 31 LEU H H 31 9.557 9.557 8.744 0.813 25259 5704 1 8 . 1 1 32 32 VAL N N 32 126.919 126.919 118.980 7.939 25259 5705 1 8 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.354 0.097 25259 5706 1 8 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.271 -1.607 25259 5707 1 8 . 1 1 32 32 VAL CB C 32 29.449 29.449 33.473 -4.024 25259 5708 1 8 . 1 1 32 32 VAL H H 32 9.364 9.364 8.433 0.931 25259 5709 1 8 . 1 1 33 33 LEU N N 33 133.503 133.503 128.807 4.696 25259 5710 1 8 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.536 0.020 25259 5711 1 8 . 1 1 33 33 LEU CA C 33 52.004 52.004 52.487 -0.483 25259 5712 1 8 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.947 -4.100 25259 5713 1 8 . 1 1 33 33 LEU H H 33 8.587 8.587 8.148 0.439 25259 5714 1 8 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.452 0.029 25259 5715 1 8 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.355 -1.910 25259 5716 1 8 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.505 -2.940 25259 5717 1 8 . 1 1 35 35 LYS N N 35 127.420 127.420 122.042 5.378 25259 5718 1 8 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.238 0.128 25259 5719 1 8 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.772 -1.653 25259 5720 1 8 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.962 -2.368 25259 5721 1 8 . 1 1 35 35 LYS H H 35 8.666 8.666 8.442 0.224 25259 5722 1 8 . 1 1 36 36 SER N N 36 122.222 122.222 124.025 -1.803 25259 5723 1 8 . 1 1 36 36 SER HA H 36 4.753 4.753 4.377 0.376 25259 5724 1 8 . 1 1 36 36 SER CA C 36 55.328 55.328 59.574 -4.246 25259 5725 1 8 . 1 1 36 36 SER CB C 36 61.728 61.728 62.040 -0.312 25259 5726 1 8 . 1 1 36 36 SER H H 36 8.771 8.771 9.093 -0.322 25259 5727 1 8 . 1 1 37 37 ASP N N 37 126.346 126.346 122.968 3.378 25259 5728 1 8 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.218 0.236 25259 5729 1 8 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.705 -3.089 25259 5730 1 8 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.317 -2.332 25259 5731 1 8 . 1 1 37 37 ASP H H 37 8.859 8.859 8.595 0.264 25259 5732 1 8 . 1 1 38 38 ASP N N 38 119.171 119.171 119.773 -0.602 25259 5733 1 8 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.769 -0.154 25259 5734 1 8 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.663 -3.875 25259 5735 1 8 . 1 1 38 38 ASP CB C 38 37.635 37.635 42.164 -4.529 25259 5736 1 8 . 1 1 38 38 ASP H H 38 7.944 7.944 8.312 -0.368 25259 5737 1 8 . 1 1 39 39 GLY N N 39 110.352 110.352 112.367 -2.015 25259 5738 1 8 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.935 -3.174 25259 5739 1 8 . 1 1 39 39 GLY H H 39 8.145 8.145 8.595 -0.450 25259 5740 1 8 . 1 1 40 40 SER N N 40 120.090 120.090 113.951 6.139 25259 5741 1 8 . 1 1 40 40 SER HA H 40 4.877 4.877 4.809 0.068 25259 5742 1 8 . 1 1 40 40 SER CA C 40 56.525 56.525 57.982 -1.457 25259 5743 1 8 . 1 1 40 40 SER CB C 40 62.245 62.245 66.209 -3.964 25259 5744 1 8 . 1 1 40 40 SER H H 40 8.344 8.344 7.664 0.680 25259 5745 1 8 . 1 1 41 41 GLN N N 41 122.551 122.551 121.342 1.209 25259 5746 1 8 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.872 0.055 25259 5747 1 8 . 1 1 41 41 GLN CA C 41 53.414 53.414 53.695 -0.281 25259 5748 1 8 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.122 -2.808 25259 5749 1 8 . 1 1 41 41 GLN H H 41 8.627 8.627 8.797 -0.170 25259 5750 1 8 . 1 1 42 42 GLN N N 42 131.724 131.724 119.151 12.573 25259 5751 1 8 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.969 0.642 25259 5752 1 8 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.586 -2.514 25259 5753 1 8 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.757 -2.438 25259 5754 1 8 . 1 1 42 42 GLN H H 42 9.189 9.189 8.599 0.590 25259 5755 1 8 . 1 1 43 43 THR N N 43 122.202 122.202 114.804 7.398 25259 5756 1 8 . 1 1 43 43 THR HA H 43 5.380 5.380 4.738 0.642 25259 5757 1 8 . 1 1 43 43 THR CA C 43 58.863 58.863 61.132 -2.269 25259 5758 1 8 . 1 1 43 43 THR CB C 43 68.893 68.893 72.344 -3.451 25259 5759 1 8 . 1 1 43 43 THR H H 43 9.139 9.139 8.310 0.829 25259 5760 1 8 . 1 1 44 44 GLN N N 44 127.190 127.190 122.528 4.662 25259 5761 1 8 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.246 0.388 25259 5762 1 8 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.888 -3.220 25259 5763 1 8 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.542 -3.632 25259 5764 1 8 . 1 1 44 44 GLN H H 44 9.760 9.760 8.691 1.069 25259 5765 1 8 . 1 1 45 45 THR N N 45 123.479 123.479 119.606 3.873 25259 5766 1 8 . 1 1 45 45 THR HA H 45 5.421 5.421 5.096 0.325 25259 5767 1 8 . 1 1 45 45 THR CA C 45 60.071 60.071 61.646 -1.575 25259 5768 1 8 . 1 1 45 45 THR CB C 45 67.541 67.541 70.812 -3.271 25259 5769 1 8 . 1 1 45 45 THR H H 45 9.518 9.518 9.178 0.341 25259 5770 1 8 . 1 1 46 46 ILE N N 46 133.908 133.908 128.195 5.713 25259 5771 1 8 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.792 0.211 25259 5772 1 8 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.760 -2.289 25259 5773 1 8 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.565 0.380 25259 5774 1 8 . 1 1 46 46 ILE H H 46 9.830 9.830 9.400 0.430 25259 5775 1 8 . 1 1 47 47 THR N N 47 124.701 124.701 124.597 0.104 25259 5776 1 8 . 1 1 47 47 THR HA H 47 6.048 6.048 5.277 0.771 25259 5777 1 8 . 1 1 47 47 THR CA C 47 58.551 58.551 62.108 -3.557 25259 5778 1 8 . 1 1 47 47 THR CB C 47 67.819 67.819 69.574 -1.755 25259 5779 1 8 . 1 1 47 47 THR H H 47 8.843 8.843 8.407 0.436 25259 5780 1 8 . 1 1 48 48 TYR N N 48 127.369 127.369 122.359 5.010 25259 5781 1 8 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.116 0.162 25259 5782 1 8 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.259 -2.530 25259 5783 1 8 . 1 1 48 48 TYR CB C 48 39.432 39.432 40.879 -1.447 25259 5784 1 8 . 1 1 48 48 TYR H H 48 9.638 9.638 8.617 1.021 25259 5785 1 8 . 1 1 49 49 LYS N N 49 122.138 122.138 117.314 4.824 25259 5786 1 8 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.423 0.233 25259 5787 1 8 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.751 -3.779 25259 5788 1 8 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.098 -0.495 25259 5789 1 8 . 1 1 49 49 LYS H H 49 8.560 8.560 8.769 -0.209 25259 5790 1 8 . 1 1 50 50 ASP N N 50 130.208 130.208 121.398 8.810 25259 5791 1 8 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.774 -0.470 25259 5792 1 8 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.697 0.063 25259 5793 1 8 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.662 -5.323 25259 5794 1 8 . 1 1 50 50 ASP H H 50 9.597 9.597 8.479 1.118 25259 5795 1 8 . 1 1 51 51 LYS N N 51 124.586 124.586 118.635 5.951 25259 5796 1 8 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.534 -0.003 25259 5797 1 8 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.435 -2.701 25259 5798 1 8 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.510 -4.114 25259 5799 1 8 . 1 1 51 51 LYS H H 51 8.450 8.450 8.099 0.351 25259 5800 1 8 . 1 1 52 52 THR N N 52 120.044 120.044 114.737 5.307 25259 5801 1 8 . 1 1 52 52 THR HA H 52 4.717 4.717 4.479 0.238 25259 5802 1 8 . 1 1 52 52 THR CA C 52 59.313 59.313 61.044 -1.731 25259 5803 1 8 . 1 1 52 52 THR CB C 52 68.815 68.815 71.390 -2.575 25259 5804 1 8 . 1 1 52 52 THR H H 52 8.658 8.658 7.653 1.005 25259 5805 1 8 . 1 1 53 53 PHE N N 53 128.987 128.987 123.248 5.739 25259 5806 1 8 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.309 -0.026 25259 5807 1 8 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.426 -1.438 25259 5808 1 8 . 1 1 53 53 PHE CB C 53 38.311 38.311 38.097 0.214 25259 5809 1 8 . 1 1 53 53 PHE H H 53 9.218 9.218 8.677 0.541 25259 5810 1 8 . 1 1 54 54 LEU N N 54 124.874 124.874 125.673 -0.799 25259 5811 1 8 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.362 0.567 25259 5812 1 8 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.343 -3.102 25259 5813 1 8 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.746 -2.229 25259 5814 1 8 . 1 1 54 54 LEU H H 54 9.391 9.391 8.936 0.455 25259 5815 1 8 . 1 1 55 55 SER N N 55 115.516 115.516 109.374 6.142 25259 5816 1 8 . 1 1 55 55 SER HA H 55 5.194 5.194 5.403 -0.209 25259 5817 1 8 . 1 1 55 55 SER CA C 55 55.818 55.818 56.965 -1.147 25259 5818 1 8 . 1 1 55 55 SER CB C 55 63.474 63.474 66.480 -3.006 25259 5819 1 8 . 1 1 55 55 SER H H 55 8.736 8.736 7.812 0.924 25259 5820 1 8 . 1 1 56 56 LEU N N 56 124.352 124.352 122.400 1.952 25259 5821 1 8 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.478 0.065 25259 5822 1 8 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.090 -2.454 25259 5823 1 8 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.098 -0.585 25259 5824 1 8 . 1 1 56 56 LEU H H 56 8.328 8.328 8.357 -0.029 25259 5825 1 8 . 1 1 57 57 ALA N N 57 131.450 131.450 129.853 1.597 25259 5826 1 8 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.518 -0.013 25259 5827 1 8 . 1 1 57 57 ALA CA C 57 48.202 48.202 49.679 -1.477 25259 5828 1 8 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.236 -2.272 25259 5829 1 8 . 1 1 57 57 ALA H H 57 9.208 9.208 9.107 0.101 25259 5830 1 8 . 1 1 58 58 ILE N N 58 126.248 126.248 122.471 3.777 25259 5831 1 8 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.840 -0.056 25259 5832 1 8 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.111 -1.864 25259 5833 1 8 . 1 1 58 58 ILE CB C 58 38.045 38.045 39.979 -1.934 25259 5834 1 8 . 1 1 58 58 ILE H H 58 9.597 9.597 8.808 0.789 25259 5835 1 8 . 1 1 59 59 GLN N N 59 132.065 132.065 126.440 5.625 25259 5836 1 8 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.741 0.506 25259 5837 1 8 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.661 -3.497 25259 5838 1 8 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.320 -0.659 25259 5839 1 8 . 1 1 59 59 GLN H H 59 9.389 9.389 8.310 1.079 25259 5840 1 8 . 1 1 60 60 GLN N N 60 130.314 130.314 120.464 9.850 25259 5841 1 8 . 1 1 60 60 GLN HA H 60 5.209 5.209 5.019 0.190 25259 5842 1 8 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.802 -2.781 25259 5843 1 8 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.259 -3.783 25259 5844 1 8 . 1 1 60 60 GLN H H 60 9.471 9.471 9.007 0.464 25259 5845 1 8 . 1 1 61 61 LYS N N 61 131.044 131.044 125.515 5.529 25259 5846 1 8 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.261 0.154 25259 5847 1 8 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.976 -2.856 25259 5848 1 8 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.352 -3.935 25259 5849 1 8 . 1 1 61 61 LYS H H 61 8.893 8.893 8.891 0.002 25259 5850 1 8 . 1 1 62 62 ARG N N 62 125.397 125.397 122.175 3.222 25259 5851 1 8 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.035 -0.032 25259 5852 1 8 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.066 -1.975 25259 5853 1 8 . 1 1 62 62 ARG CB C 62 29.878 29.878 32.532 -2.654 25259 5854 1 8 . 1 1 62 62 ARG H H 62 9.120 9.120 8.087 1.033 25259 5855 1 8 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.784 0.191 25259 5856 1 8 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.299 -2.802 25259 5857 1 8 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.282 -2.398 25259 5858 1 8 . 1 1 64 64 VAL N N 64 121.305 121.305 117.781 3.524 25259 5859 1 8 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.149 -0.125 25259 5860 1 8 . 1 1 64 64 VAL CA C 64 59.677 59.677 62.352 -2.675 25259 5861 1 8 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.145 -1.780 25259 5862 1 8 . 1 1 64 64 VAL H H 64 7.520 7.520 8.013 -0.493 25259 5863 1 8 . 1 1 65 65 SER N N 65 123.215 123.215 115.044 8.171 25259 5864 1 8 . 1 1 65 65 SER HA H 65 4.521 4.521 4.745 -0.225 25259 5865 1 8 . 1 1 65 65 SER CA C 65 54.897 54.897 57.377 -2.480 25259 5866 1 8 . 1 1 65 65 SER CB C 65 62.564 62.564 65.623 -3.059 25259 5867 1 8 . 1 1 65 65 SER H H 65 8.080 8.080 8.130 -0.050 25259 5868 1 8 . 1 1 66 66 ASP N N 66 123.802 123.802 122.930 0.872 25259 5869 1 8 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.455 -0.026 25259 5870 1 8 . 1 1 66 66 ASP CA C 66 55.378 55.378 57.671 -2.293 25259 5871 1 8 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.047 -3.009 25259 5872 1 8 . 1 1 66 66 ASP H H 66 8.900 8.900 8.763 0.137 25259 5873 1 8 . 1 1 67 67 GLU N N 67 121.943 121.943 119.250 2.693 25259 5874 1 8 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.067 0.122 25259 5875 1 8 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.074 -1.634 25259 5876 1 8 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.487 -2.702 25259 5877 1 8 . 1 1 67 67 GLU H H 67 8.717 8.717 8.658 0.059 25259 5878 1 8 . 1 1 68 68 LEU N N 68 125.458 125.458 120.152 5.306 25259 5879 1 8 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.175 0.168 25259 5880 1 8 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.056 -2.584 25259 5881 1 8 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.616 -2.212 25259 5882 1 8 . 1 1 68 68 LEU H H 68 7.820 7.820 7.581 0.239 25259 5883 1 8 . 1 1 69 69 LYS N N 69 123.868 123.868 119.511 4.357 25259 5884 1 8 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.037 -0.031 25259 5885 1 8 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.976 -2.359 25259 5886 1 8 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.165 -2.128 25259 5887 1 8 . 1 1 69 69 LYS H H 69 8.690 8.690 7.903 0.787 25259 5888 1 8 . 1 1 70 70 THR N N 70 117.109 117.109 116.113 0.996 25259 5889 1 8 . 1 1 70 70 THR HA H 70 4.088 4.088 3.986 0.102 25259 5890 1 8 . 1 1 70 70 THR CA C 70 63.879 63.879 67.436 -3.557 25259 5891 1 8 . 1 1 70 70 THR CB C 70 66.383 66.383 68.582 -2.199 25259 5892 1 8 . 1 1 70 70 THR H H 70 7.935 7.935 7.928 0.007 25259 5893 1 8 . 1 1 71 71 TYR N N 71 127.006 127.006 122.485 4.521 25259 5894 1 8 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.291 -0.086 25259 5895 1 8 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.931 -1.706 25259 5896 1 8 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.272 -1.727 25259 5897 1 8 . 1 1 71 71 TYR H H 71 7.683 7.683 7.681 0.002 25259 5898 1 8 . 1 1 72 72 ILE N N 72 125.064 125.064 119.997 5.067 25259 5899 1 8 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.800 -0.121 25259 5900 1 8 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.199 -2.304 25259 5901 1 8 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.754 -1.478 25259 5902 1 8 . 1 1 72 72 ILE H H 72 9.083 9.083 7.779 1.304 25259 5903 1 8 . 1 1 73 73 ASP N N 73 124.900 124.900 120.515 4.385 25259 5904 1 8 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.375 0.014 25259 5905 1 8 . 1 1 73 73 ASP CA C 73 55.038 55.038 57.367 -2.329 25259 5906 1 8 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.986 -2.880 25259 5907 1 8 . 1 1 73 73 ASP H H 73 8.751 8.751 8.134 0.617 25259 5908 1 8 . 1 1 74 74 GLN N N 74 117.025 117.025 116.236 0.789 25259 5909 1 8 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.985 0.153 25259 5910 1 8 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.769 -2.959 25259 5911 1 8 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.574 -2.010 25259 5912 1 8 . 1 1 74 74 GLN H H 74 7.447 7.447 7.952 -0.505 25259 5913 1 8 . 1 1 75 75 HIS N N 75 116.494 116.494 115.900 0.594 25259 5914 1 8 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.713 0.003 25259 5915 1 8 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.446 -2.380 25259 5916 1 8 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.206 -4.904 25259 5917 1 8 . 1 1 75 75 HIS H H 75 8.402 8.402 7.949 0.454 25259 5918 1 8 . 1 1 76 76 GLY N N 76 112.564 112.564 106.721 5.843 25259 5919 1 8 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.595 -2.699 25259 5920 1 8 . 1 1 76 76 GLY H H 76 9.091 9.091 7.921 1.170 25259 5921 1 8 . 1 1 77 77 VAL N N 77 124.763 124.763 120.679 4.084 25259 5922 1 8 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.780 -0.215 25259 5923 1 8 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.186 -0.235 25259 5924 1 8 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.256 -2.418 25259 5925 1 8 . 1 1 77 77 VAL H H 77 8.927 8.927 8.705 0.222 25259 5926 1 8 . 1 1 78 78 GLU N N 78 124.388 124.388 117.794 6.594 25259 5927 1 8 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.011 0.137 25259 5928 1 8 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.737 -1.421 25259 5929 1 8 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.019 -2.560 25259 5930 1 8 . 1 1 78 78 GLU H H 78 8.781 8.781 8.822 -0.041 25259 5931 1 8 . 1 1 79 79 GLU N N 79 121.887 121.887 119.259 2.628 25259 5932 1 8 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.369 -0.181 25259 5933 1 8 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.394 -1.849 25259 5934 1 8 . 1 1 79 79 GLU CB C 79 27.033 27.033 30.182 -3.149 25259 5935 1 8 . 1 1 79 79 GLU H H 79 9.231 9.231 7.789 1.442 25259 5936 1 8 . 1 1 80 80 THR N N 80 120.781 120.781 117.992 2.789 25259 5937 1 8 . 1 1 80 80 THR HA H 80 4.059 4.059 3.862 0.197 25259 5938 1 8 . 1 1 80 80 THR CA C 80 65.487 65.487 66.878 -1.391 25259 5939 1 8 . 1 1 80 80 THR CB C 80 64.369 64.369 68.787 -4.418 25259 5940 1 8 . 1 1 80 80 THR H H 80 7.858 7.858 8.401 -0.543 25259 5941 1 8 . 1 1 81 81 GLN N N 81 125.303 125.303 120.999 4.304 25259 5942 1 8 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.893 0.151 25259 5943 1 8 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.937 -2.968 25259 5944 1 8 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.433 -2.356 25259 5945 1 8 . 1 1 81 81 GLN H H 81 8.765 8.765 8.181 0.584 25259 5946 1 8 . 1 1 82 82 LYS N N 82 120.458 120.458 118.427 2.031 25259 5947 1 8 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.941 0.148 25259 5948 1 8 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.984 -1.672 25259 5949 1 8 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.828 -1.674 25259 5950 1 8 . 1 1 82 82 LYS H H 82 7.521 7.521 7.419 0.102 25259 5951 1 8 . 1 1 83 83 ALA N N 83 125.234 125.234 121.590 3.644 25259 5952 1 8 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.960 0.257 25259 5953 1 8 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.756 -2.314 25259 5954 1 8 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.910 -2.623 25259 5955 1 8 . 1 1 83 83 ALA H H 83 7.782 7.782 7.977 -0.195 25259 5956 1 8 . 1 1 84 84 LEU N N 84 123.348 123.348 119.045 4.303 25259 5957 1 8 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.855 0.203 25259 5958 1 8 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.785 -2.286 25259 5959 1 8 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.338 -2.030 25259 5960 1 8 . 1 1 84 84 LEU H H 84 8.590 8.590 7.809 0.781 25259 5961 1 8 . 1 1 85 85 LEU N N 85 122.872 122.872 119.906 2.966 25259 5962 1 8 . 1 1 85 85 LEU HA H 85 4.170 4.170 4.008 0.162 25259 5963 1 8 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.588 -2.192 25259 5964 1 8 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.517 -1.776 25259 5965 1 8 . 1 1 85 85 LEU H H 85 7.892 7.892 7.759 0.133 25259 5966 1 8 . 1 1 86 86 GLU N N 86 122.713 122.713 117.621 5.092 25259 5967 1 8 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.125 -0.040 25259 5968 1 8 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.398 -1.653 25259 5969 1 8 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.856 -2.953 25259 5970 1 8 . 1 1 86 86 GLU H H 86 8.124 8.124 7.990 0.134 25259 5971 1 8 . 1 1 87 87 ALA N N 87 123.163 123.163 123.062 0.101 25259 5972 1 8 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.099 0.042 25259 5973 1 8 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.689 -2.421 25259 5974 1 8 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.870 -3.238 25259 5975 1 8 . 1 1 87 87 ALA H H 87 7.765 7.765 7.122 0.643 25259 5976 1 8 . 1 1 88 88 GLU N N 88 121.945 121.945 118.729 3.216 25259 5977 1 8 . 1 1 88 88 GLU HA H 88 4.084 4.084 3.977 0.107 25259 5978 1 8 . 1 1 88 88 GLU CA C 88 56.935 56.935 59.424 -2.489 25259 5979 1 8 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.450 -1.423 25259 5980 1 8 . 1 1 88 88 GLU H H 88 7.846 7.846 8.568 -0.722 25259 5981 1 8 . 1 1 89 89 GLU N N 89 117.978 117.978 116.460 1.518 25259 5982 1 8 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.058 0.035 25259 5983 1 8 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.502 -3.288 25259 5984 1 8 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.564 -2.157 25259 5985 1 8 . 1 1 89 89 GLU H H 89 7.634 7.634 8.184 -0.550 25259 5986 1 8 . 1 1 90 90 LYS N N 90 117.519 117.519 113.553 3.966 25259 5987 1 8 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.510 -0.079 25259 5988 1 8 . 1 1 90 90 LYS CA C 90 53.018 53.018 54.974 -1.956 25259 5989 1 8 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.637 -1.606 25259 5990 1 8 . 1 1 90 90 LYS H H 90 7.247 7.247 7.683 -0.436 25259 5991 1 8 . 1 1 91 91 ASP N N 91 124.888 124.888 123.393 1.495 25259 5992 1 8 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.653 0.030 25259 5993 1 8 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.087 -2.888 25259 5994 1 8 . 1 1 91 91 ASP CB C 91 39.581 39.581 40.054 -0.473 25259 5995 1 8 . 1 1 91 91 ASP H H 91 7.370 7.370 7.836 -0.466 25259 5996 1 8 . 1 1 92 92 LYS N N 92 129.311 129.311 122.616 6.695 25259 5997 1 8 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.709 0.304 25259 5998 1 8 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.745 -2.530 25259 5999 1 8 . 1 1 92 92 LYS CB C 92 30.015 30.015 31.453 -1.438 25259 6000 1 8 . 1 1 92 92 LYS H H 92 8.795 8.795 8.357 0.438 25259 6001 1 8 . 1 1 93 93 SER N N 93 118.112 118.112 114.720 3.392 25259 6002 1 8 . 1 1 93 93 SER HA H 93 4.439 4.439 4.153 0.286 25259 6003 1 8 . 1 1 93 93 SER CA C 93 58.945 58.945 61.915 -2.970 25259 6004 1 8 . 1 1 93 93 SER CB C 93 60.278 60.278 63.297 -3.019 25259 6005 1 8 . 1 1 93 93 SER H H 93 8.488 8.488 8.175 0.312 25259 6006 1 8 . 1 1 94 94 ILE N N 94 128.950 128.950 121.026 7.924 25259 6007 1 8 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.572 -0.090 25259 6008 1 8 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.772 -2.423 25259 6009 1 8 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.487 -2.734 25259 6010 1 8 . 1 1 94 94 ILE H H 94 7.722 7.722 7.963 -0.241 25259 6011 1 8 . 1 1 95 95 ILE N N 95 123.598 123.598 121.030 2.568 25259 6012 1 8 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.562 0.033 25259 6013 1 8 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.112 -2.365 25259 6014 1 8 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.466 -1.494 25259 6015 1 8 . 1 1 95 95 ILE H H 95 8.378 8.378 7.835 0.543 25259 6016 1 8 . 1 1 96 96 GLU N N 96 118.317 118.317 117.377 0.940 25259 6017 1 8 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.970 0.014 25259 6018 1 8 . 1 1 96 96 GLU CA C 96 56.495 56.495 58.857 -2.362 25259 6019 1 8 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.021 -1.848 25259 6020 1 8 . 1 1 96 96 GLU H H 96 7.680 7.680 8.092 -0.412 25259 6021 1 8 . 1 1 97 97 ALA N N 97 124.797 124.797 120.837 3.960 25259 6022 1 8 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.980 -0.155 25259 6023 1 8 . 1 1 97 97 ALA CA C 97 52.297 52.297 53.763 -1.466 25259 6024 1 8 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.894 -2.905 25259 6025 1 8 . 1 1 97 97 ALA H H 97 7.383 7.383 7.391 -0.008 25259 6026 1 8 . 1 1 98 98 ARG N N 98 115.469 115.469 117.959 -2.490 25259 6027 1 8 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.314 -0.008 25259 6028 1 8 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.010 -1.520 25259 6029 1 8 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.876 -1.638 25259 6030 1 8 . 1 1 98 98 ARG H H 98 8.229 8.229 8.216 0.013 25259 6031 1 8 . 1 1 99 99 LYS N N 99 120.219 120.219 117.397 2.822 25259 6032 1 8 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.147 0.111 25259 6033 1 8 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.287 -2.046 25259 6034 1 8 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.243 -1.747 25259 6035 1 8 . 1 1 99 99 LYS H H 99 7.270 7.270 7.405 -0.135 25259 6036 1 8 . 1 1 100 100 LEU N N 100 123.800 123.800 121.895 1.905 25259 6037 1 8 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.326 0.015 25259 6038 1 8 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.351 -2.272 25259 6039 1 8 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.583 -3.452 25259 6040 1 8 . 1 1 100 100 LEU H H 100 7.837 7.837 7.688 0.149 25259 6041 1 8 . 1 1 101 101 ALA N N 101 130.512 130.512 125.400 5.112 25259 6042 1 8 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.398 -0.022 25259 6043 1 8 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.853 -2.449 25259 6044 1 8 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.739 -2.943 25259 6045 1 8 . 1 1 101 101 ALA H H 101 8.213 8.213 8.767 -0.554 25259 6046 1 8 . 1 1 102 102 GLY N N 102 110.659 110.659 105.526 5.133 25259 6047 1 8 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.271 -1.378 25259 6048 1 8 . 1 1 102 102 GLY H H 102 8.738 8.738 8.204 0.534 25259 6049 1 8 . 1 1 103 103 PHE N N 103 123.097 123.097 122.638 0.459 25259 6050 1 8 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.256 -0.036 25259 6051 1 8 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.453 -2.685 25259 6052 1 8 . 1 1 103 103 PHE CB C 103 40.574 40.574 41.462 -0.888 25259 6053 1 8 . 1 1 103 103 PHE H H 103 7.514 7.514 7.515 -0.001 25259 6054 1 8 . 1 1 104 104 LYS N N 104 130.652 130.652 127.894 2.758 25259 6055 1 8 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.410 -0.290 25259 6056 1 8 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.115 -1.136 25259 6057 1 8 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.163 -1.925 25259 6058 1 8 . 1 1 104 104 LYS H H 104 7.473 7.473 8.191 -0.718 25259 6059 1 8 . 1 1 105 105 LEU N N 105 127.372 127.372 122.861 4.511 25259 6060 1 8 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.843 0.153 25259 6061 1 8 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.807 -2.071 25259 6062 1 8 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.580 -1.616 25259 6063 1 8 . 1 1 105 105 LEU H H 105 8.393 8.393 8.097 0.296 25259 6064 1 8 . 1 1 106 106 GLU N N 106 129.358 129.358 123.168 6.190 25259 6065 1 8 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.759 0.085 25259 6066 1 8 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.104 -2.314 25259 6067 1 8 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.553 -1.925 25259 6068 1 8 . 1 1 106 106 GLU H H 106 8.849 8.849 9.098 -0.249 25259 6069 1 8 . 1 1 107 107 THR N N 107 131.118 131.118 113.466 17.652 25259 6070 1 8 . 1 1 107 107 THR HA H 107 5.110 5.110 4.809 0.301 25259 6071 1 8 . 1 1 107 107 THR CA C 107 59.832 59.832 61.155 -1.323 25259 6072 1 8 . 1 1 107 107 THR CB C 107 66.671 66.671 71.282 -4.611 25259 6073 1 8 . 1 1 107 107 THR H H 107 9.433 9.433 8.343 1.090 25259 6074 1 8 . 1 1 108 108 LYS N N 108 129.114 129.114 122.900 6.214 25259 6075 1 8 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.493 0.331 25259 6076 1 8 . 1 1 108 108 LYS CA C 108 52.194 52.194 56.389 -4.195 25259 6077 1 8 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.447 -1.058 25259 6078 1 8 . 1 1 108 108 LYS H H 108 9.410 9.410 8.427 0.983 25259 6079 1 8 . 1 1 109 109 LEU N N 109 129.323 129.323 127.235 2.088 25259 6080 1 8 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.396 0.308 25259 6081 1 8 . 1 1 109 109 LEU CA C 109 52.108 52.108 55.307 -3.199 25259 6082 1 8 . 1 1 109 109 LEU CB C 109 39.655 39.655 41.823 -2.168 25259 6083 1 8 . 1 1 109 109 LEU H H 109 8.862 8.862 8.633 0.229 25259 6084 1 8 . 1 1 110 110 LEU N N 110 129.123 129.123 127.336 1.787 25259 6085 1 8 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.167 0.056 25259 6086 1 8 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.559 -2.777 25259 6087 1 8 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.339 -1.678 25259 6088 1 8 . 1 1 110 110 LEU H H 110 8.373 8.373 8.517 -0.144 25259 6089 1 8 . 1 1 111 111 SER N N 111 114.587 114.587 110.079 4.508 25259 6090 1 8 . 1 1 111 111 SER HA H 111 4.557 4.557 4.614 -0.057 25259 6091 1 8 . 1 1 111 111 SER CA C 111 53.889 53.889 57.307 -3.418 25259 6092 1 8 . 1 1 111 111 SER CB C 111 61.830 61.830 64.839 -3.009 25259 6093 1 8 . 1 1 111 111 SER H H 111 8.400 8.400 7.574 0.826 25259 6094 1 8 . 1 1 112 112 ALA N N 112 118.269 118.269 122.351 -4.082 25259 6095 1 8 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.263 0.046 25259 6096 1 8 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.494 -3.280 25259 6097 1 8 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.565 -1.977 25259 6098 1 8 . 1 1 112 112 ALA H H 112 8.556 8.556 8.671 -0.115 25259 6099 1 8 . 1 1 113 113 THR N N 113 102.878 102.878 103.769 -0.891 25259 6100 1 8 . 1 1 113 113 THR HA H 113 4.662 4.662 4.561 0.101 25259 6101 1 8 . 1 1 113 113 THR CA C 113 58.689 58.689 61.220 -2.531 25259 6102 1 8 . 1 1 113 113 THR CB C 113 67.905 67.905 70.255 -2.350 25259 6103 1 8 . 1 1 113 113 THR H H 113 8.065 8.065 7.424 0.641 25259 6104 1 8 . 1 1 114 114 GLU N N 114 126.514 126.514 121.023 5.491 25259 6105 1 8 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.083 -0.069 25259 6106 1 8 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.768 -1.761 25259 6107 1 8 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.633 -1.720 25259 6108 1 8 . 1 1 114 114 GLU H H 114 7.357 7.357 7.643 -0.286 25259 6109 1 8 . 1 1 115 115 LEU N N 115 128.058 128.058 117.329 10.729 25259 6110 1 8 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.337 -0.415 25259 6111 1 8 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.092 -1.768 25259 6112 1 8 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.648 -2.509 25259 6113 1 8 . 1 1 115 115 LEU H H 115 8.930 8.930 8.346 0.584 25259 6114 1 8 . 1 1 116 116 GLN N N 116 126.540 126.540 120.819 5.721 25259 6115 1 8 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.127 0.588 25259 6116 1 8 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.782 -3.082 25259 6117 1 8 . 1 1 116 116 GLN CB C 116 32.292 32.292 32.714 -0.422 25259 6118 1 8 . 1 1 116 116 GLN H H 116 9.221 9.221 8.934 0.287 25259 6119 1 8 . 1 1 117 117 THR N N 117 125.213 125.213 124.057 1.156 25259 6120 1 8 . 1 1 117 117 THR HA H 117 5.353 5.353 5.056 0.297 25259 6121 1 8 . 1 1 117 117 THR CA C 117 58.926 58.926 61.446 -2.520 25259 6122 1 8 . 1 1 117 117 THR CB C 117 68.948 68.948 70.902 -1.954 25259 6123 1 8 . 1 1 117 117 THR H H 117 9.030 9.030 8.469 0.561 25259 6124 1 8 . 1 1 118 118 THR N N 118 127.799 127.799 118.479 9.320 25259 6125 1 8 . 1 1 118 118 THR HA H 118 5.527 5.527 5.152 0.375 25259 6126 1 8 . 1 1 118 118 THR CA C 118 59.201 59.201 61.747 -2.546 25259 6127 1 8 . 1 1 118 118 THR CB C 118 67.721 67.721 72.326 -4.605 25259 6128 1 8 . 1 1 118 118 THR H H 118 9.459 9.459 8.914 0.545 25259 6129 1 8 . 1 1 119 119 THR N N 119 129.258 129.258 121.336 7.922 25259 6130 1 8 . 1 1 119 119 THR HA H 119 4.885 4.885 4.696 0.189 25259 6131 1 8 . 1 1 119 119 THR CA C 119 58.463 58.463 61.441 -2.978 25259 6132 1 8 . 1 1 119 119 THR CB C 119 67.459 67.459 70.398 -2.939 25259 6133 1 8 . 1 1 119 119 THR H H 119 9.147 9.147 8.836 0.311 25259 6134 1 8 . 1 1 120 120 SER N N 120 123.389 123.389 121.476 1.913 25259 6135 1 8 . 1 1 120 120 SER HA H 120 5.328 5.328 5.031 0.297 25259 6136 1 8 . 1 1 120 120 SER CA C 120 54.386 54.386 56.152 -1.766 25259 6137 1 8 . 1 1 120 120 SER CB C 120 63.031 63.031 64.488 -1.457 25259 6138 1 8 . 1 1 120 120 SER H H 120 8.786 8.786 8.370 0.416 25259 6139 1 8 . 1 1 121 121 PHE N N 121 121.245 121.245 125.797 -4.552 25259 6140 1 8 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.823 0.289 25259 6141 1 8 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.721 -3.529 25259 6142 1 8 . 1 1 121 121 PHE CB C 121 40.265 40.265 39.043 1.222 25259 6143 1 8 . 1 1 121 121 PHE H H 121 8.831 8.831 8.909 -0.078 25259 6144 1 8 . 1 1 122 122 ASP N N 122 124.765 124.765 126.577 -1.812 25259 6145 1 8 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.864 -0.024 25259 6146 1 8 . 1 1 122 122 ASP CA C 122 49.837 49.837 52.555 -2.718 25259 6147 1 8 . 1 1 122 122 ASP CB C 122 38.485 38.485 39.375 -0.890 25259 6148 1 8 . 1 1 122 122 ASP H H 122 8.819 8.819 8.731 0.088 25259 6149 1 8 . 1 1 123 123 PHE N N 123 124.303 124.303 121.987 2.316 25259 6150 1 8 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.331 0.343 25259 6151 1 8 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.416 -2.618 25259 6152 1 8 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.441 -2.901 25259 6153 1 8 . 1 1 123 123 PHE H H 123 8.262 8.262 7.900 0.362 25259 6154 1 8 . 1 1 124 124 GLN N N 124 120.792 120.792 117.627 3.165 25259 6155 1 8 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.218 0.216 25259 6156 1 8 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.258 -2.175 25259 6157 1 8 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.003 -1.874 25259 6158 1 8 . 1 1 124 124 GLN H H 124 8.954 8.954 8.288 0.666 25259 6159 1 8 . 1 1 125 125 VAL N N 125 114.091 114.091 110.855 3.236 25259 6160 1 8 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.380 0.029 25259 6161 1 8 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.373 -3.075 25259 6162 1 8 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.663 -1.091 25259 6163 1 8 . 1 1 125 125 VAL H H 125 7.026 7.026 7.950 -0.924 25259 6164 1 8 . 1 1 126 126 LEU N N 126 125.158 125.158 122.879 2.279 25259 6165 1 8 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.452 0.023 25259 6166 1 8 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.041 -1.866 25259 6167 1 8 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.234 -1.181 25259 6168 1 8 . 1 1 126 126 LEU H H 126 8.106 8.106 7.871 0.235 25259 6169 1 8 . 1 1 127 127 ASP N N 127 130.026 130.026 127.447 2.579 25259 6170 1 8 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.789 0.052 25259 6171 1 8 . 1 1 127 127 ASP CA C 127 50.198 50.198 52.573 -2.375 25259 6172 1 8 . 1 1 127 127 ASP CB C 127 37.689 37.689 41.029 -3.340 25259 6173 1 8 . 1 1 127 127 ASP H H 127 9.129 9.129 8.721 0.408 25259 6174 1 8 . 1 1 128 128 VAL N N 128 128.833 128.833 126.954 1.879 25259 6175 1 8 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.618 -0.094 25259 6176 1 8 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.362 -2.694 25259 6177 1 8 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.779 -2.284 25259 6178 1 8 . 1 1 128 128 VAL H H 128 8.288 8.288 8.324 -0.036 25259 6179 1 8 . 1 1 129 129 LYS N N 129 123.914 123.914 119.399 4.515 25259 6180 1 8 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.225 -0.182 25259 6181 1 8 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.700 -1.911 25259 6182 1 8 . 1 1 129 129 LYS CB C 129 28.937 28.937 32.175 -3.238 25259 6183 1 8 . 1 1 129 129 LYS H H 129 8.226 8.226 7.894 0.332 25259 6184 1 8 . 1 1 130 130 LYS N N 130 121.888 121.888 118.530 3.358 25259 6185 1 8 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.215 -0.130 25259 6186 1 8 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.700 -1.554 25259 6187 1 8 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.058 -2.718 25259 6188 1 8 . 1 1 130 130 LYS H H 130 7.590 7.590 7.943 -0.353 25259 6189 1 8 . 1 1 131 131 ALA N N 131 123.088 123.088 122.513 0.575 25259 6190 1 8 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.057 -0.130 25259 6191 1 8 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.332 -2.930 25259 6192 1 8 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.226 -1.778 25259 6193 1 8 . 1 1 131 131 ALA H H 131 8.506 8.506 8.613 -0.107 25259 6194 1 8 . 1 1 132 132 SER N N 132 110.456 110.456 111.393 -0.937 25259 6195 1 8 . 1 1 132 132 SER HA H 132 4.117 4.117 4.095 0.022 25259 6196 1 8 . 1 1 132 132 SER CA C 132 58.289 58.289 60.825 -2.536 25259 6197 1 8 . 1 1 132 132 SER CB C 132 61.034 61.034 63.007 -1.973 25259 6198 1 8 . 1 1 132 132 SER H H 132 7.986 7.986 7.806 0.180 25259 6199 1 8 . 1 1 133 133 GLN N N 133 119.034 119.034 119.016 0.018 25259 6200 1 8 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.558 -0.156 25259 6201 1 8 . 1 1 133 133 GLN CA C 133 52.525 52.525 55.130 -2.605 25259 6202 1 8 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.413 -2.179 25259 6203 1 8 . 1 1 133 133 GLN H H 133 7.233 7.233 7.840 -0.607 25259 6204 1 8 . 1 1 134 134 LEU N N 134 123.291 123.291 118.976 4.315 25259 6205 1 8 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.479 -0.086 25259 6206 1 8 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.164 -1.848 25259 6207 1 8 . 1 1 134 134 LEU CB C 134 38.847 38.847 41.784 -2.937 25259 6208 1 8 . 1 1 134 134 LEU H H 134 7.411 7.411 7.384 0.027 25259 6209 1 8 . 1 1 135 135 GLU N N 135 128.446 128.446 118.155 10.291 25259 6210 1 8 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.772 0.174 25259 6211 1 8 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.188 -1.804 25259 6212 1 8 . 1 1 135 135 GLU CB C 135 27.296 27.296 27.715 -0.419 25259 6213 1 8 . 1 1 135 135 GLU H H 135 8.986 8.986 8.539 0.447 25259 6214 1 8 . 1 1 136 136 HIS N N 136 117.593 117.593 120.726 -3.133 25259 6215 1 8 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.288 0.095 25259 6216 1 8 . 1 1 136 136 HIS CA C 136 56.685 56.685 59.093 -2.408 25259 6217 1 8 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.883 -1.470 25259 6218 1 8 . 1 1 136 136 HIS H H 136 9.226 9.226 8.463 0.763 25259 6219 1 8 . 1 1 137 137 LEU N N 137 115.463 115.463 115.613 -0.150 25259 6220 1 8 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.637 -0.130 25259 6221 1 8 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.838 -2.890 25259 6222 1 8 . 1 1 137 137 LEU CB C 137 39.807 39.807 41.826 -2.019 25259 6223 1 8 . 1 1 137 137 LEU H H 137 7.090 7.090 8.295 -1.205 25259 6224 1 8 . 1 1 138 138 LYS N N 138 124.686 124.686 121.522 3.164 25259 6225 1 8 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.364 -0.195 25259 6226 1 8 . 1 1 138 138 LYS CA C 138 57.158 57.158 57.916 -0.758 25259 6227 1 8 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.349 -2.260 25259 6228 1 8 . 1 1 138 138 LYS H H 138 7.698 7.698 8.134 -0.436 25259 6229 1 8 . 1 1 139 139 ASN N N 139 118.077 118.077 115.429 2.648 25259 6230 1 8 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.581 0.092 25259 6231 1 8 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.146 -2.364 25259 6232 1 8 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.354 -2.537 25259 6233 1 8 . 1 1 139 139 ASN H H 139 8.485 8.485 8.133 0.352 25259 6234 1 8 . 1 1 140 140 ILE N N 140 120.880 120.880 120.014 0.866 25259 6235 1 8 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.214 -0.184 25259 6236 1 8 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.990 -1.425 25259 6237 1 8 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.642 -2.868 25259 6238 1 8 . 1 1 140 140 ILE H H 140 7.549 7.549 7.536 0.013 25259 6239 1 8 . 1 1 141 141 GLY N N 141 110.676 110.676 115.884 -5.208 25259 6240 1 8 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.817 -0.153 25259 6241 1 8 . 1 1 141 141 GLY H H 141 7.663 7.663 8.777 -1.114 25259 6242 1 8 . 1 1 142 142 LEU N N 142 123.857 123.857 122.782 1.075 25259 6243 1 8 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.816 -0.123 25259 6244 1 8 . 1 1 142 142 LEU CA C 142 55.193 55.193 58.034 -2.841 25259 6245 1 8 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.673 -1.064 25259 6246 1 8 . 1 1 142 142 LEU H H 142 8.496 8.496 7.532 0.964 25259 6247 1 8 . 1 1 143 143 GLU N N 143 118.407 118.407 116.726 1.681 25259 6248 1 8 . 1 1 143 143 GLU HA H 143 3.786 3.786 4.098 -0.312 25259 6249 1 8 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.418 -1.196 25259 6250 1 8 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.194 -2.681 25259 6251 1 8 . 1 1 143 143 GLU H H 143 8.672 8.672 8.557 0.115 25259 6252 1 8 . 1 1 144 144 ASN N N 144 118.477 118.477 117.378 1.099 25259 6253 1 8 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.498 -0.056 25259 6254 1 8 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.790 -2.078 25259 6255 1 8 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.951 -2.996 25259 6256 1 8 . 1 1 144 144 ASN H H 144 7.656 7.656 7.621 0.035 25259 6257 1 8 . 1 1 145 145 LEU N N 145 125.354 125.354 121.278 4.076 25259 6258 1 8 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.803 -0.006 25259 6259 1 8 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.512 -1.189 25259 6260 1 8 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.218 -2.645 25259 6261 1 8 . 1 1 145 145 LEU H H 145 7.758 7.758 8.017 -0.259 25259 6262 1 8 . 1 1 146 146 LEU N N 146 116.372 116.372 117.312 -0.940 25259 6263 1 8 . 1 1 146 146 LEU HA H 146 3.876 3.876 4.007 -0.131 25259 6264 1 8 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.095 -1.852 25259 6265 1 8 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.345 -1.448 25259 6266 1 8 . 1 1 146 146 LEU H H 146 7.242 7.242 7.370 -0.128 25259 6267 1 8 . 1 1 147 147 LYS N N 147 120.054 120.054 119.082 0.972 25259 6268 1 8 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.554 -0.242 25259 6269 1 8 . 1 1 147 147 LYS CA C 147 54.623 54.623 54.947 -0.324 25259 6270 1 8 . 1 1 147 147 LYS CB C 147 30.260 30.260 33.217 -2.957 25259 6271 1 8 . 1 1 147 147 LYS H H 147 7.185 7.185 8.487 -1.302 25259 6272 1 8 . 1 1 148 148 ASN N N 148 119.498 119.498 116.783 2.715 25259 6273 1 8 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.834 0.128 25259 6274 1 8 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.288 -2.514 25259 6275 1 8 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.819 -1.333 25259 6276 1 8 . 1 1 148 148 ASN H H 148 7.698 7.698 7.623 0.075 25259 6277 1 8 . 1 1 149 149 GLU N N 149 122.834 122.834 118.116 4.718 25259 6278 1 8 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.337 0.264 25259 6279 1 8 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.567 -2.348 25259 6280 1 8 . 1 1 149 149 GLU CB C 149 26.810 26.810 28.918 -2.108 25259 6281 1 8 . 1 1 149 149 GLU H H 149 8.767 8.767 8.675 0.092 25259 6282 1 8 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.390 1.218 25259 6283 1 8 . 1 1 150 150 PRO CA C 150 63.242 63.242 63.902 -0.660 25259 6284 1 8 . 1 1 150 150 PRO CB C 150 28.095 28.095 30.834 -2.739 25259 6285 1 8 . 1 1 151 151 SER N N 151 112.839 112.839 109.740 3.099 25259 6286 1 8 . 1 1 151 151 SER HA H 151 3.835 3.835 4.516 -0.681 25259 6287 1 8 . 1 1 151 151 SER CA C 151 59.270 59.270 57.369 1.901 25259 6288 1 8 . 1 1 151 151 SER CB C 151 59.451 59.451 62.720 -3.269 25259 6289 1 8 . 1 1 151 151 SER H H 151 8.519 8.519 7.645 0.874 25259 6290 1 8 . 1 1 152 152 LYS N N 152 126.710 126.710 122.040 4.670 25259 6291 1 8 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.257 -0.009 25259 6292 1 8 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.399 -3.634 25259 6293 1 8 . 1 1 152 152 LYS CB C 152 30.257 30.257 33.215 -2.958 25259 6294 1 8 . 1 1 152 152 LYS H H 152 7.006 7.006 7.839 -0.833 25259 6295 1 8 . 1 1 153 153 TYR N N 153 123.239 123.239 117.591 5.648 25259 6296 1 8 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.351 -0.093 25259 6297 1 8 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.894 0.415 25259 6298 1 8 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.352 -1.018 25259 6299 1 8 . 1 1 153 153 TYR H H 153 8.058 8.058 8.708 -0.650 25259 6300 1 8 . 1 1 154 154 ILE N N 154 120.253 120.253 120.813 -0.560 25259 6301 1 8 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.093 0.280 25259 6302 1 8 . 1 1 154 154 ILE CA C 154 63.114 63.114 64.695 -1.581 25259 6303 1 8 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.144 -1.196 25259 6304 1 8 . 1 1 154 154 ILE H H 154 8.193 8.193 7.636 0.557 25259 6305 1 8 . 1 1 155 155 SER N N 155 117.178 117.178 115.134 2.044 25259 6306 1 8 . 1 1 155 155 SER HA H 155 4.091 4.091 3.976 0.115 25259 6307 1 8 . 1 1 155 155 SER CA C 155 59.961 59.961 62.166 -2.205 25259 6308 1 8 . 1 1 155 155 SER CB C 155 60.148 60.148 62.872 -2.724 25259 6309 1 8 . 1 1 155 155 SER H H 155 8.020 8.020 7.913 0.107 25259 6310 1 8 . 1 1 156 156 ASP N N 156 125.479 125.479 121.218 4.261 25259 6311 1 8 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.397 0.030 25259 6312 1 8 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.716 -1.956 25259 6313 1 8 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.776 -2.904 25259 6314 1 8 . 1 1 156 156 ASP H H 156 8.638 8.638 7.874 0.764 25259 6315 1 8 . 1 1 157 157 ARG N N 157 121.542 121.542 119.121 2.421 25259 6316 1 8 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.016 0.095 25259 6317 1 8 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.777 -2.849 25259 6318 1 8 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.778 -1.962 25259 6319 1 8 . 1 1 157 157 ARG H H 157 7.888 7.888 7.826 0.062 25259 6320 1 8 . 1 1 158 158 LEU N N 158 124.257 124.257 120.248 4.009 25259 6321 1 8 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.132 0.139 25259 6322 1 8 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.274 -3.061 25259 6323 1 8 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.517 -2.572 25259 6324 1 8 . 1 1 158 158 LEU H H 158 8.442 8.442 7.746 0.696 25259 6325 1 8 . 1 1 159 159 ALA N N 159 124.146 124.146 121.562 2.584 25259 6326 1 8 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.030 0.302 25259 6327 1 8 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.726 -3.294 25259 6328 1 8 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.383 -2.476 25259 6329 1 8 . 1 1 159 159 ALA H H 159 8.086 8.086 8.562 -0.476 25259 6330 1 8 . 1 1 160 160 ASN N N 160 118.093 118.093 115.958 2.135 25259 6331 1 8 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.671 0.321 25259 6332 1 8 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.342 -2.765 25259 6333 1 8 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.014 -1.280 25259 6334 1 8 . 1 1 160 160 ASN H H 160 7.445 7.445 7.720 -0.275 25259 6335 1 8 . 1 1 161 161 GLY N N 161 108.365 108.365 107.006 1.359 25259 6336 1 8 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.025 -1.379 25259 6337 1 8 . 1 1 161 161 GLY H H 161 7.743 7.743 7.882 -0.139 25259 6338 1 8 . 1 1 162 162 ALA N N 162 123.928 123.928 122.635 1.293 25259 6339 1 8 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.045 -0.172 25259 6340 1 8 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.406 -1.880 25259 6341 1 8 . 1 1 162 162 ALA CB C 162 18.060 18.060 22.140 -4.080 25259 6342 1 8 . 1 1 162 162 ALA H H 162 8.035 8.035 7.604 0.431 25259 6343 1 8 . 1 1 163 163 THR N N 163 113.286 113.286 112.339 0.947 25259 6344 1 8 . 1 1 163 163 THR HA H 163 4.703 4.703 4.745 -0.042 25259 6345 1 8 . 1 1 163 163 THR CA C 163 57.791 57.791 60.690 -2.898 25259 6346 1 8 . 1 1 163 163 THR CB C 163 68.974 68.974 71.413 -2.439 25259 6347 1 8 . 1 1 163 163 THR H H 163 8.451 8.451 8.820 -0.369 25259 6348 1 8 . 1 1 164 164 GLU N N 164 125.905 125.905 119.896 6.009 25259 6349 1 8 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.981 0.079 25259 6350 1 8 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.582 -0.997 25259 6351 1 8 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.881 -3.670 25259 6352 1 8 . 1 1 164 164 GLU H H 164 8.716 8.716 8.508 0.208 25259 6353 1 9 . 1 1 2 2 PRO HA H 2 4.675 4.675 4.720 -0.045 25259 6354 1 9 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.251 -2.443 25259 6355 1 9 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.298 -3.228 25259 6356 1 9 . 1 1 3 3 ALA N N 3 126.741 126.741 124.079 2.662 25259 6357 1 9 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.443 0.051 25259 6358 1 9 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.678 -1.476 25259 6359 1 9 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.348 -3.530 25259 6360 1 9 . 1 1 3 3 ALA H H 3 8.440 8.440 7.893 0.547 25259 6361 1 9 . 1 1 4 4 THR N N 4 116.015 116.015 117.164 -1.149 25259 6362 1 9 . 1 1 4 4 THR HA H 4 4.393 4.393 4.365 0.028 25259 6363 1 9 . 1 1 4 4 THR CA C 4 59.148 59.148 63.092 -3.944 25259 6364 1 9 . 1 1 4 4 THR CB C 4 67.580 67.580 68.893 -1.313 25259 6365 1 9 . 1 1 4 4 THR H H 4 8.050 8.050 8.167 -0.117 25259 6366 1 9 . 1 1 5 5 LYS N N 5 126.350 126.350 126.957 -0.607 25259 6367 1 9 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.600 -0.095 25259 6368 1 9 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.263 -1.346 25259 6369 1 9 . 1 1 5 5 LYS CB C 5 30.684 30.684 35.237 -4.553 25259 6370 1 9 . 1 1 5 5 LYS H H 5 8.332 8.332 8.345 -0.013 25259 6371 1 9 . 1 1 6 6 THR N N 6 118.124 118.124 116.235 1.889 25259 6372 1 9 . 1 1 6 6 THR HA H 6 4.440 4.440 4.405 0.035 25259 6373 1 9 . 1 1 6 6 THR CA C 6 59.282 59.282 61.685 -2.403 25259 6374 1 9 . 1 1 6 6 THR CB C 6 67.685 67.685 69.564 -1.879 25259 6375 1 9 . 1 1 6 6 THR H H 6 8.283 8.283 8.343 -0.060 25259 6376 1 9 . 1 1 7 7 GLU N N 7 125.934 125.934 122.978 2.956 25259 6377 1 9 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.440 -0.096 25259 6378 1 9 . 1 1 7 7 GLU CA C 7 54.181 54.181 56.251 -2.070 25259 6379 1 9 . 1 1 7 7 GLU CB C 7 27.816 27.816 30.309 -2.493 25259 6380 1 9 . 1 1 7 7 GLU H H 7 8.487 8.487 8.629 -0.142 25259 6381 1 9 . 1 1 8 8 LYS N N 8 123.945 123.945 119.214 4.731 25259 6382 1 9 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.451 -1.516 25259 6383 1 9 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.619 -4.054 25259 6384 1 9 . 1 1 8 8 LYS H H 8 8.278 8.278 8.718 -0.440 25259 6385 1 9 . 1 1 9 9 ASP N N 9 123.624 123.624 120.341 3.283 25259 6386 1 9 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.780 -0.441 25259 6387 1 9 . 1 1 9 9 ASP CA C 9 52.123 52.123 54.503 -2.380 25259 6388 1 9 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.559 -3.626 25259 6389 1 9 . 1 1 9 9 ASP H H 9 8.277 8.277 8.581 -0.304 25259 6390 1 9 . 1 1 10 10 THR N N 10 116.812 116.812 112.967 3.845 25259 6391 1 9 . 1 1 10 10 THR HA H 10 4.349 4.349 4.295 0.054 25259 6392 1 9 . 1 1 10 10 THR CA C 10 59.634 59.634 62.479 -2.845 25259 6393 1 9 . 1 1 10 10 THR CB C 10 67.254 67.254 69.827 -2.573 25259 6394 1 9 . 1 1 10 10 THR H H 10 8.049 8.049 8.256 -0.207 25259 6395 1 9 . 1 1 11 11 LEU N N 11 126.610 126.610 127.519 -0.909 25259 6396 1 9 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.666 -0.274 25259 6397 1 9 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.977 -1.899 25259 6398 1 9 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.653 -3.020 25259 6399 1 9 . 1 1 11 11 LEU H H 11 8.191 8.191 8.642 -0.451 25259 6400 1 9 . 1 1 12 12 GLN N N 12 123.274 123.274 123.111 0.163 25259 6401 1 9 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.551 -0.169 25259 6402 1 9 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.742 -1.168 25259 6403 1 9 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.048 -4.245 25259 6404 1 9 . 1 1 12 12 GLN H H 12 8.280 8.280 8.538 -0.258 25259 6405 1 9 . 1 1 13 13 SER N N 13 119.027 119.027 116.840 2.187 25259 6406 1 9 . 1 1 13 13 SER HA H 13 4.471 4.471 4.475 -0.004 25259 6407 1 9 . 1 1 13 13 SER CA C 13 55.869 55.869 58.309 -2.440 25259 6408 1 9 . 1 1 13 13 SER CB C 13 61.424 61.424 62.238 -0.814 25259 6409 1 9 . 1 1 13 13 SER H H 13 8.178 8.178 8.473 -0.295 25259 6410 1 9 . 1 1 14 14 ALA N N 14 128.314 128.314 128.912 -0.598 25259 6411 1 9 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.735 -0.301 25259 6412 1 9 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.638 -1.942 25259 6413 1 9 . 1 1 14 14 ALA CB C 14 17.081 17.081 20.264 -3.183 25259 6414 1 9 . 1 1 14 14 ALA H H 14 8.195 8.195 8.239 -0.044 25259 6415 1 9 . 1 1 15 15 LEU N N 15 125.175 125.175 119.207 5.968 25259 6416 1 9 . 1 1 15 15 LEU HA H 15 4.640 4.640 5.134 -0.494 25259 6417 1 9 . 1 1 15 15 LEU CA C 15 50.604 50.604 52.885 -2.281 25259 6418 1 9 . 1 1 15 15 LEU CB C 15 39.467 39.467 42.397 -2.930 25259 6419 1 9 . 1 1 15 15 LEU H H 15 8.050 8.050 8.606 -0.556 25259 6420 1 9 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.626 -0.122 25259 6421 1 9 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.871 -2.240 25259 6422 1 9 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.864 -3.207 25259 6423 1 9 . 1 1 17 17 VAL N N 17 123.223 123.223 118.938 4.285 25259 6424 1 9 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.374 -0.240 25259 6425 1 9 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.261 -1.434 25259 6426 1 9 . 1 1 17 17 VAL CB C 17 30.377 30.377 32.333 -1.956 25259 6427 1 9 . 1 1 17 17 VAL H H 17 8.134 8.134 8.013 0.121 25259 6428 1 9 . 1 1 18 18 ILE N N 18 127.777 127.777 122.007 5.770 25259 6429 1 9 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.479 -0.236 25259 6430 1 9 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.928 -2.606 25259 6431 1 9 . 1 1 18 18 ILE CB C 18 36.254 36.254 38.784 -2.530 25259 6432 1 9 . 1 1 18 18 ILE H H 18 8.187 8.187 8.244 -0.057 25259 6433 1 9 . 1 1 19 19 GLU N N 19 128.148 128.148 127.574 0.574 25259 6434 1 9 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.544 -0.207 25259 6435 1 9 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.933 -1.842 25259 6436 1 9 . 1 1 19 19 GLU CB C 19 28.176 28.176 31.902 -3.726 25259 6437 1 9 . 1 1 19 19 GLU H H 19 8.475 8.475 8.589 -0.114 25259 6438 1 9 . 1 1 20 20 ASN N N 20 122.788 122.788 119.150 3.638 25259 6439 1 9 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.938 -0.243 25259 6440 1 9 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.823 -2.001 25259 6441 1 9 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.160 -3.795 25259 6442 1 9 . 1 1 20 20 ASN H H 20 8.477 8.477 8.413 0.064 25259 6443 1 9 . 1 1 21 21 ALA N N 21 127.253 127.253 124.610 2.643 25259 6444 1 9 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.643 -0.322 25259 6445 1 9 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.355 -0.667 25259 6446 1 9 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.972 -4.059 25259 6447 1 9 . 1 1 21 21 ALA H H 21 8.325 8.325 8.385 -0.060 25259 6448 1 9 . 1 1 22 22 GLU N N 22 122.044 122.044 122.713 -0.669 25259 6449 1 9 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.264 0.029 25259 6450 1 9 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.608 -2.025 25259 6451 1 9 . 1 1 22 22 GLU CB C 22 27.285 27.285 28.103 -0.818 25259 6452 1 9 . 1 1 22 22 GLU H H 22 8.415 8.415 8.775 -0.360 25259 6453 1 9 . 1 1 23 23 LYS N N 23 123.622 123.622 121.693 1.929 25259 6454 1 9 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.428 -0.103 25259 6455 1 9 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.234 -1.738 25259 6456 1 9 . 1 1 23 23 LYS CB C 23 30.653 30.653 32.973 -2.320 25259 6457 1 9 . 1 1 23 23 LYS H H 23 8.127 8.127 7.937 0.190 25259 6458 1 9 . 1 1 24 24 ASN N N 24 120.652 120.652 121.021 -0.369 25259 6459 1 9 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.986 -0.145 25259 6460 1 9 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.727 -2.064 25259 6461 1 9 . 1 1 24 24 ASN CB C 24 36.775 36.775 40.012 -3.237 25259 6462 1 9 . 1 1 24 24 ASN H H 24 8.424 8.424 8.269 0.155 25259 6463 1 9 . 1 1 25 25 THR N N 25 117.102 117.102 115.286 1.816 25259 6464 1 9 . 1 1 25 25 THR HA H 25 4.367 4.367 4.499 -0.132 25259 6465 1 9 . 1 1 25 25 THR CA C 25 59.500 59.500 60.935 -1.435 25259 6466 1 9 . 1 1 25 25 THR CB C 25 67.610 67.610 70.823 -3.213 25259 6467 1 9 . 1 1 25 25 THR H H 25 7.852 7.852 8.329 -0.477 25259 6468 1 9 . 1 1 26 26 VAL N N 26 126.491 126.491 124.500 1.991 25259 6469 1 9 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.172 -0.005 25259 6470 1 9 . 1 1 26 26 VAL CA C 26 60.193 60.193 62.987 -2.794 25259 6471 1 9 . 1 1 26 26 VAL CB C 26 29.605 29.605 31.736 -2.131 25259 6472 1 9 . 1 1 26 26 VAL H H 26 8.080 8.080 8.375 -0.295 25259 6473 1 9 . 1 1 27 27 VAL N N 27 132.992 132.992 124.578 8.414 25259 6474 1 9 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.558 -0.477 25259 6475 1 9 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.006 -1.022 25259 6476 1 9 . 1 1 27 27 VAL CB C 27 31.540 31.540 34.898 -3.357 25259 6477 1 9 . 1 1 27 27 VAL H H 27 8.830 8.830 8.789 0.041 25259 6478 1 9 . 1 1 28 28 THR N N 28 123.576 123.576 115.749 7.827 25259 6479 1 9 . 1 1 28 28 THR HA H 28 5.553 5.553 4.799 0.754 25259 6480 1 9 . 1 1 28 28 THR CA C 28 58.738 58.738 61.577 -2.839 25259 6481 1 9 . 1 1 28 28 THR CB C 28 68.443 68.443 70.258 -1.815 25259 6482 1 9 . 1 1 28 28 THR H H 28 8.165 8.165 7.942 0.223 25259 6483 1 9 . 1 1 29 29 LYS N N 29 129.099 129.099 126.562 2.537 25259 6484 1 9 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.622 0.320 25259 6485 1 9 . 1 1 29 29 LYS CA C 29 51.779 51.779 54.656 -2.877 25259 6486 1 9 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.914 0.182 25259 6487 1 9 . 1 1 29 29 LYS H H 29 9.273 9.273 8.912 0.361 25259 6488 1 9 . 1 1 30 30 THR N N 30 123.510 123.510 118.590 4.920 25259 6489 1 9 . 1 1 30 30 THR HA H 30 5.428 5.428 4.853 0.575 25259 6490 1 9 . 1 1 30 30 THR CA C 30 59.784 59.784 61.994 -2.210 25259 6491 1 9 . 1 1 30 30 THR CB C 30 67.818 67.818 69.528 -1.710 25259 6492 1 9 . 1 1 30 30 THR H H 30 8.993 8.993 8.334 0.659 25259 6493 1 9 . 1 1 31 31 LEU N N 31 128.293 128.293 128.078 0.215 25259 6494 1 9 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.813 0.407 25259 6495 1 9 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.926 -3.871 25259 6496 1 9 . 1 1 31 31 LEU CB C 31 43.399 43.399 43.282 0.117 25259 6497 1 9 . 1 1 31 31 LEU H H 31 9.557 9.557 9.146 0.411 25259 6498 1 9 . 1 1 32 32 VAL N N 32 126.919 126.919 126.410 0.509 25259 6499 1 9 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.127 0.324 25259 6500 1 9 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.981 -2.317 25259 6501 1 9 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.957 -1.508 25259 6502 1 9 . 1 1 32 32 VAL H H 32 9.364 9.364 8.738 0.626 25259 6503 1 9 . 1 1 33 33 LEU N N 33 133.503 133.503 128.916 4.587 25259 6504 1 9 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.435 0.121 25259 6505 1 9 . 1 1 33 33 LEU CA C 33 52.004 52.004 53.785 -1.781 25259 6506 1 9 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.378 -4.531 25259 6507 1 9 . 1 1 33 33 LEU H H 33 8.587 8.587 7.932 0.655 25259 6508 1 9 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.473 0.008 25259 6509 1 9 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.524 -2.079 25259 6510 1 9 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.168 -2.603 25259 6511 1 9 . 1 1 35 35 LYS N N 35 127.420 127.420 119.838 7.582 25259 6512 1 9 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.298 0.068 25259 6513 1 9 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.150 -2.030 25259 6514 1 9 . 1 1 35 35 LYS CB C 35 30.594 30.594 33.042 -2.449 25259 6515 1 9 . 1 1 35 35 LYS H H 35 8.666 8.666 8.304 0.362 25259 6516 1 9 . 1 1 36 36 SER N N 36 122.222 122.222 116.969 5.253 25259 6517 1 9 . 1 1 36 36 SER HA H 36 4.753 4.753 4.468 0.285 25259 6518 1 9 . 1 1 36 36 SER CA C 36 55.328 55.328 58.873 -3.545 25259 6519 1 9 . 1 1 36 36 SER CB C 36 61.728 61.728 64.230 -2.502 25259 6520 1 9 . 1 1 36 36 SER H H 36 8.771 8.771 8.862 -0.091 25259 6521 1 9 . 1 1 37 37 ASP N N 37 126.346 126.346 119.896 6.450 25259 6522 1 9 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.546 -0.092 25259 6523 1 9 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.047 -1.431 25259 6524 1 9 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.796 -2.811 25259 6525 1 9 . 1 1 37 37 ASP H H 37 8.859 8.859 8.724 0.135 25259 6526 1 9 . 1 1 38 38 ASP N N 38 119.171 119.171 118.293 0.878 25259 6527 1 9 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.809 -0.194 25259 6528 1 9 . 1 1 38 38 ASP CA C 38 50.788 50.788 53.557 -2.769 25259 6529 1 9 . 1 1 38 38 ASP CB C 38 37.635 37.635 40.679 -3.044 25259 6530 1 9 . 1 1 38 38 ASP H H 38 7.944 7.944 7.693 0.251 25259 6531 1 9 . 1 1 39 39 GLY N N 39 110.352 110.352 107.165 3.187 25259 6532 1 9 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.632 -2.871 25259 6533 1 9 . 1 1 39 39 GLY H H 39 8.145 8.145 8.094 0.051 25259 6534 1 9 . 1 1 40 40 SER N N 40 120.090 120.090 115.030 5.060 25259 6535 1 9 . 1 1 40 40 SER HA H 40 4.877 4.877 5.029 -0.152 25259 6536 1 9 . 1 1 40 40 SER CA C 40 56.525 56.525 57.622 -1.097 25259 6537 1 9 . 1 1 40 40 SER CB C 40 62.245 62.245 65.799 -3.554 25259 6538 1 9 . 1 1 40 40 SER H H 40 8.344 8.344 7.688 0.656 25259 6539 1 9 . 1 1 41 41 GLN N N 41 122.551 122.551 125.655 -3.104 25259 6540 1 9 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.456 0.471 25259 6541 1 9 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.403 -1.989 25259 6542 1 9 . 1 1 41 41 GLN CB C 41 30.314 30.314 31.366 -1.052 25259 6543 1 9 . 1 1 41 41 GLN H H 41 8.627 8.627 8.944 -0.317 25259 6544 1 9 . 1 1 42 42 GLN N N 42 131.724 131.724 117.559 14.165 25259 6545 1 9 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.720 0.891 25259 6546 1 9 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.891 -2.819 25259 6547 1 9 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.329 -2.010 25259 6548 1 9 . 1 1 42 42 GLN H H 42 9.189 9.189 8.598 0.591 25259 6549 1 9 . 1 1 43 43 THR N N 43 122.202 122.202 115.636 6.566 25259 6550 1 9 . 1 1 43 43 THR HA H 43 5.380 5.380 5.087 0.293 25259 6551 1 9 . 1 1 43 43 THR CA C 43 58.863 58.863 60.884 -2.021 25259 6552 1 9 . 1 1 43 43 THR CB C 43 68.893 68.893 71.987 -3.094 25259 6553 1 9 . 1 1 43 43 THR H H 43 9.139 9.139 8.441 0.698 25259 6554 1 9 . 1 1 44 44 GLN N N 44 127.190 127.190 120.569 6.621 25259 6555 1 9 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.164 0.470 25259 6556 1 9 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.475 -2.807 25259 6557 1 9 . 1 1 44 44 GLN CB C 44 28.910 28.910 33.670 -4.761 25259 6558 1 9 . 1 1 44 44 GLN H H 44 9.760 9.760 8.891 0.869 25259 6559 1 9 . 1 1 45 45 THR N N 45 123.479 123.479 119.220 4.259 25259 6560 1 9 . 1 1 45 45 THR HA H 45 5.421 5.421 5.190 0.231 25259 6561 1 9 . 1 1 45 45 THR CA C 45 60.071 60.071 61.406 -1.335 25259 6562 1 9 . 1 1 45 45 THR CB C 45 67.541 67.541 70.504 -2.963 25259 6563 1 9 . 1 1 45 45 THR H H 45 9.518 9.518 8.817 0.701 25259 6564 1 9 . 1 1 46 46 ILE N N 46 133.908 133.908 129.036 4.872 25259 6565 1 9 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.691 0.312 25259 6566 1 9 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.433 -1.962 25259 6567 1 9 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.743 0.202 25259 6568 1 9 . 1 1 46 46 ILE H H 46 9.830 9.830 8.906 0.924 25259 6569 1 9 . 1 1 47 47 THR N N 47 124.701 124.701 125.190 -0.489 25259 6570 1 9 . 1 1 47 47 THR HA H 47 6.048 6.048 5.124 0.924 25259 6571 1 9 . 1 1 47 47 THR CA C 47 58.551 58.551 61.865 -3.314 25259 6572 1 9 . 1 1 47 47 THR CB C 47 67.819 67.819 69.030 -1.211 25259 6573 1 9 . 1 1 47 47 THR H H 47 8.843 8.843 8.450 0.393 25259 6574 1 9 . 1 1 48 48 TYR N N 48 127.369 127.369 121.826 5.543 25259 6575 1 9 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.136 0.142 25259 6576 1 9 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.187 -2.458 25259 6577 1 9 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.568 -2.136 25259 6578 1 9 . 1 1 48 48 TYR H H 48 9.638 9.638 8.502 1.136 25259 6579 1 9 . 1 1 49 49 LYS N N 49 122.138 122.138 117.246 4.892 25259 6580 1 9 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.874 -0.218 25259 6581 1 9 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.830 -2.858 25259 6582 1 9 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.944 -1.341 25259 6583 1 9 . 1 1 49 49 LYS H H 49 8.560 8.560 8.803 -0.243 25259 6584 1 9 . 1 1 50 50 ASP N N 50 130.208 130.208 120.194 10.014 25259 6585 1 9 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.758 -0.454 25259 6586 1 9 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.160 -0.400 25259 6587 1 9 . 1 1 50 50 ASP CB C 50 37.339 37.339 43.493 -6.154 25259 6588 1 9 . 1 1 50 50 ASP H H 50 9.597 9.597 8.406 1.191 25259 6589 1 9 . 1 1 51 51 LYS N N 51 124.586 124.586 117.032 7.554 25259 6590 1 9 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.354 0.177 25259 6591 1 9 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.149 -2.415 25259 6592 1 9 . 1 1 51 51 LYS CB C 51 30.395 30.395 33.774 -3.379 25259 6593 1 9 . 1 1 51 51 LYS H H 51 8.450 8.450 8.154 0.296 25259 6594 1 9 . 1 1 52 52 THR N N 52 120.044 120.044 115.307 4.737 25259 6595 1 9 . 1 1 52 52 THR HA H 52 4.717 4.717 4.510 0.207 25259 6596 1 9 . 1 1 52 52 THR CA C 52 59.313 59.313 61.202 -1.889 25259 6597 1 9 . 1 1 52 52 THR CB C 52 68.815 68.815 71.541 -2.726 25259 6598 1 9 . 1 1 52 52 THR H H 52 8.658 8.658 7.653 1.005 25259 6599 1 9 . 1 1 53 53 PHE N N 53 128.987 128.987 123.623 5.364 25259 6600 1 9 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.546 -0.263 25259 6601 1 9 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.286 -1.297 25259 6602 1 9 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.923 0.388 25259 6603 1 9 . 1 1 53 53 PHE H H 53 9.218 9.218 8.645 0.573 25259 6604 1 9 . 1 1 54 54 LEU N N 54 124.874 124.874 126.063 -1.189 25259 6605 1 9 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.393 0.536 25259 6606 1 9 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.266 -3.025 25259 6607 1 9 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.956 -2.439 25259 6608 1 9 . 1 1 54 54 LEU H H 54 9.391 9.391 8.712 0.679 25259 6609 1 9 . 1 1 55 55 SER N N 55 115.516 115.516 108.772 6.744 25259 6610 1 9 . 1 1 55 55 SER HA H 55 5.194 5.194 5.154 0.040 25259 6611 1 9 . 1 1 55 55 SER CA C 55 55.818 55.818 57.495 -1.677 25259 6612 1 9 . 1 1 55 55 SER CB C 55 63.474 63.474 67.176 -3.702 25259 6613 1 9 . 1 1 55 55 SER H H 55 8.736 8.736 7.709 1.027 25259 6614 1 9 . 1 1 56 56 LEU N N 56 124.352 124.352 122.183 2.169 25259 6615 1 9 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.401 0.142 25259 6616 1 9 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.149 -2.512 25259 6617 1 9 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.361 -0.848 25259 6618 1 9 . 1 1 56 56 LEU H H 56 8.328 8.328 8.470 -0.142 25259 6619 1 9 . 1 1 57 57 ALA N N 57 131.450 131.450 129.918 1.532 25259 6620 1 9 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.135 0.370 25259 6621 1 9 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.125 -1.923 25259 6622 1 9 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.209 -2.245 25259 6623 1 9 . 1 1 57 57 ALA H H 57 9.208 9.208 8.877 0.331 25259 6624 1 9 . 1 1 58 58 ILE N N 58 126.248 126.248 126.923 -0.675 25259 6625 1 9 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.215 0.569 25259 6626 1 9 . 1 1 58 58 ILE CA C 58 58.247 58.247 62.387 -4.140 25259 6627 1 9 . 1 1 58 58 ILE CB C 58 38.045 38.045 38.182 -0.137 25259 6628 1 9 . 1 1 58 58 ILE H H 58 9.597 9.597 8.297 1.300 25259 6629 1 9 . 1 1 59 59 GLN N N 59 132.065 132.065 127.046 5.019 25259 6630 1 9 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.781 0.466 25259 6631 1 9 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.722 -3.558 25259 6632 1 9 . 1 1 59 59 GLN CB C 59 29.661 29.661 31.435 -1.774 25259 6633 1 9 . 1 1 59 59 GLN H H 59 9.389 9.389 8.489 0.900 25259 6634 1 9 . 1 1 60 60 GLN N N 60 130.314 130.314 121.168 9.146 25259 6635 1 9 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.723 0.486 25259 6636 1 9 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.060 -3.039 25259 6637 1 9 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.230 -3.755 25259 6638 1 9 . 1 1 60 60 GLN H H 60 9.471 9.471 9.165 0.306 25259 6639 1 9 . 1 1 61 61 LYS N N 61 131.044 131.044 127.126 3.918 25259 6640 1 9 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.033 0.382 25259 6641 1 9 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.107 -2.987 25259 6642 1 9 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.543 -3.126 25259 6643 1 9 . 1 1 61 61 LYS H H 61 8.893 8.893 8.785 0.108 25259 6644 1 9 . 1 1 62 62 ARG N N 62 125.397 125.397 122.812 2.585 25259 6645 1 9 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.102 -0.099 25259 6646 1 9 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.848 -2.757 25259 6647 1 9 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.574 -1.696 25259 6648 1 9 . 1 1 62 62 ARG H H 62 9.120 9.120 8.030 1.090 25259 6649 1 9 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.871 0.104 25259 6650 1 9 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.421 -2.924 25259 6651 1 9 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.426 -2.542 25259 6652 1 9 . 1 1 64 64 VAL N N 64 121.305 121.305 116.423 4.882 25259 6653 1 9 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.436 -0.412 25259 6654 1 9 . 1 1 64 64 VAL CA C 64 59.677 59.677 60.337 -0.659 25259 6655 1 9 . 1 1 64 64 VAL CB C 64 30.365 30.365 33.140 -2.775 25259 6656 1 9 . 1 1 64 64 VAL H H 64 7.520 7.520 7.833 -0.313 25259 6657 1 9 . 1 1 65 65 SER N N 65 123.215 123.215 114.371 8.844 25259 6658 1 9 . 1 1 65 65 SER HA H 65 4.521 4.521 4.739 -0.218 25259 6659 1 9 . 1 1 65 65 SER CA C 65 54.897 54.897 57.117 -2.220 25259 6660 1 9 . 1 1 65 65 SER CB C 65 62.564 62.564 65.892 -3.328 25259 6661 1 9 . 1 1 65 65 SER H H 65 8.080 8.080 8.055 0.025 25259 6662 1 9 . 1 1 66 66 ASP N N 66 123.802 123.802 122.782 1.020 25259 6663 1 9 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.472 -0.043 25259 6664 1 9 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.542 -1.164 25259 6665 1 9 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.919 -2.881 25259 6666 1 9 . 1 1 66 66 ASP H H 66 8.900 8.900 8.750 0.150 25259 6667 1 9 . 1 1 67 67 GLU N N 67 121.943 121.943 119.705 2.238 25259 6668 1 9 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.038 0.151 25259 6669 1 9 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.208 -1.768 25259 6670 1 9 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.502 -2.717 25259 6671 1 9 . 1 1 67 67 GLU H H 67 8.717 8.717 8.568 0.149 25259 6672 1 9 . 1 1 68 68 LEU N N 68 125.458 125.458 118.486 6.972 25259 6673 1 9 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.403 -0.060 25259 6674 1 9 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.102 -1.630 25259 6675 1 9 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.831 -2.427 25259 6676 1 9 . 1 1 68 68 LEU H H 68 7.820 7.820 7.920 -0.100 25259 6677 1 9 . 1 1 69 69 LYS N N 69 123.868 123.868 120.902 2.966 25259 6678 1 9 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.072 -0.066 25259 6679 1 9 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.797 -2.180 25259 6680 1 9 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.825 -1.788 25259 6681 1 9 . 1 1 69 69 LYS H H 69 8.690 8.690 7.686 1.004 25259 6682 1 9 . 1 1 70 70 THR N N 70 117.109 117.109 116.428 0.681 25259 6683 1 9 . 1 1 70 70 THR HA H 70 4.088 4.088 4.024 0.064 25259 6684 1 9 . 1 1 70 70 THR CA C 70 63.879 63.879 66.772 -2.893 25259 6685 1 9 . 1 1 70 70 THR CB C 70 66.383 66.383 68.695 -2.312 25259 6686 1 9 . 1 1 70 70 THR H H 70 7.935 7.935 8.260 -0.325 25259 6687 1 9 . 1 1 71 71 TYR N N 71 127.006 127.006 122.646 4.360 25259 6688 1 9 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.276 -0.071 25259 6689 1 9 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.989 -1.764 25259 6690 1 9 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.414 -1.869 25259 6691 1 9 . 1 1 71 71 TYR H H 71 7.683 7.683 7.601 0.082 25259 6692 1 9 . 1 1 72 72 ILE N N 72 125.064 125.064 120.640 4.424 25259 6693 1 9 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.679 0.000 25259 6694 1 9 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.343 -2.448 25259 6695 1 9 . 1 1 72 72 ILE CB C 72 36.276 36.276 38.091 -1.815 25259 6696 1 9 . 1 1 72 72 ILE H H 72 9.083 9.083 7.905 1.178 25259 6697 1 9 . 1 1 73 73 ASP N N 73 124.900 124.900 119.234 5.666 25259 6698 1 9 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.351 0.038 25259 6699 1 9 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.922 -1.884 25259 6700 1 9 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.952 -2.845 25259 6701 1 9 . 1 1 73 73 ASP H H 73 8.751 8.751 8.204 0.547 25259 6702 1 9 . 1 1 74 74 GLN N N 74 117.025 117.025 116.354 0.671 25259 6703 1 9 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.970 0.168 25259 6704 1 9 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.046 -3.236 25259 6705 1 9 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.387 -1.823 25259 6706 1 9 . 1 1 74 74 GLN H H 74 7.447 7.447 7.736 -0.289 25259 6707 1 9 . 1 1 75 75 HIS N N 75 116.494 116.494 114.110 2.384 25259 6708 1 9 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.604 0.112 25259 6709 1 9 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.385 -2.319 25259 6710 1 9 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.465 -5.163 25259 6711 1 9 . 1 1 75 75 HIS H H 75 8.402 8.402 7.597 0.805 25259 6712 1 9 . 1 1 76 76 GLY N N 76 112.564 112.564 105.638 6.926 25259 6713 1 9 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.758 -2.862 25259 6714 1 9 . 1 1 76 76 GLY H H 76 9.091 9.091 7.718 1.373 25259 6715 1 9 . 1 1 77 77 VAL N N 77 124.763 124.763 121.693 3.070 25259 6716 1 9 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.664 -0.099 25259 6717 1 9 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.393 -0.442 25259 6718 1 9 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.101 -2.263 25259 6719 1 9 . 1 1 77 77 VAL H H 77 8.927 8.927 8.645 0.282 25259 6720 1 9 . 1 1 78 78 GLU N N 78 124.388 124.388 118.938 5.450 25259 6721 1 9 . 1 1 78 78 GLU HA H 78 4.148 4.148 3.977 0.171 25259 6722 1 9 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.910 -1.594 25259 6723 1 9 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.272 -2.813 25259 6724 1 9 . 1 1 78 78 GLU H H 78 8.781 8.781 8.663 0.118 25259 6725 1 9 . 1 1 79 79 GLU N N 79 121.887 121.887 117.367 4.520 25259 6726 1 9 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.174 0.014 25259 6727 1 9 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.729 -2.184 25259 6728 1 9 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.309 -2.276 25259 6729 1 9 . 1 1 79 79 GLU H H 79 9.231 9.231 7.875 1.356 25259 6730 1 9 . 1 1 80 80 THR N N 80 120.781 120.781 117.257 3.524 25259 6731 1 9 . 1 1 80 80 THR HA H 80 4.059 4.059 3.858 0.201 25259 6732 1 9 . 1 1 80 80 THR CA C 80 65.487 65.487 66.859 -1.372 25259 6733 1 9 . 1 1 80 80 THR CB C 80 64.369 64.369 68.434 -4.065 25259 6734 1 9 . 1 1 80 80 THR H H 80 7.858 7.858 8.211 -0.353 25259 6735 1 9 . 1 1 81 81 GLN N N 81 125.303 125.303 120.853 4.450 25259 6736 1 9 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.923 0.121 25259 6737 1 9 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.224 -2.255 25259 6738 1 9 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.514 -2.437 25259 6739 1 9 . 1 1 81 81 GLN H H 81 8.765 8.765 7.817 0.948 25259 6740 1 9 . 1 1 82 82 LYS N N 82 120.458 120.458 119.838 0.620 25259 6741 1 9 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.948 0.141 25259 6742 1 9 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.869 -1.557 25259 6743 1 9 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.874 -1.720 25259 6744 1 9 . 1 1 82 82 LYS H H 82 7.521 7.521 7.702 -0.181 25259 6745 1 9 . 1 1 83 83 ALA N N 83 125.234 125.234 121.839 3.395 25259 6746 1 9 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.848 0.369 25259 6747 1 9 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.603 -2.161 25259 6748 1 9 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.296 -2.009 25259 6749 1 9 . 1 1 83 83 ALA H H 83 7.782 7.782 7.749 0.033 25259 6750 1 9 . 1 1 84 84 LEU N N 84 123.348 123.348 118.044 5.304 25259 6751 1 9 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.861 0.197 25259 6752 1 9 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.804 -2.305 25259 6753 1 9 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.434 -2.126 25259 6754 1 9 . 1 1 84 84 LEU H H 84 8.590 8.590 7.684 0.906 25259 6755 1 9 . 1 1 85 85 LEU N N 85 122.872 122.872 118.528 4.344 25259 6756 1 9 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.972 0.198 25259 6757 1 9 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.488 -2.092 25259 6758 1 9 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.638 -2.897 25259 6759 1 9 . 1 1 85 85 LEU H H 85 7.892 7.892 7.568 0.324 25259 6760 1 9 . 1 1 86 86 GLU N N 86 122.713 122.713 118.816 3.897 25259 6761 1 9 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.006 0.079 25259 6762 1 9 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.084 -2.339 25259 6763 1 9 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.435 -2.532 25259 6764 1 9 . 1 1 86 86 GLU H H 86 8.124 8.124 8.045 0.079 25259 6765 1 9 . 1 1 87 87 ALA N N 87 123.163 123.163 121.202 1.961 25259 6766 1 9 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.111 0.030 25259 6767 1 9 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.627 -2.359 25259 6768 1 9 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.394 -2.762 25259 6769 1 9 . 1 1 87 87 ALA H H 87 7.765 7.765 7.522 0.243 25259 6770 1 9 . 1 1 88 88 GLU N N 88 121.945 121.945 116.648 5.297 25259 6771 1 9 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.160 -0.076 25259 6772 1 9 . 1 1 88 88 GLU CA C 88 56.935 56.935 57.864 -0.929 25259 6773 1 9 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.761 -1.734 25259 6774 1 9 . 1 1 88 88 GLU H H 88 7.846 7.846 7.807 0.039 25259 6775 1 9 . 1 1 89 89 GLU N N 89 117.978 117.978 118.965 -0.987 25259 6776 1 9 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.100 -0.007 25259 6777 1 9 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.670 -3.456 25259 6778 1 9 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.212 -1.805 25259 6779 1 9 . 1 1 89 89 GLU H H 89 7.634 7.634 7.680 -0.046 25259 6780 1 9 . 1 1 90 90 LYS N N 90 117.519 117.519 116.764 0.755 25259 6781 1 9 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.423 0.008 25259 6782 1 9 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.533 -2.515 25259 6783 1 9 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.691 -1.660 25259 6784 1 9 . 1 1 90 90 LYS H H 90 7.247 7.247 7.484 -0.237 25259 6785 1 9 . 1 1 91 91 ASP N N 91 124.888 124.888 123.212 1.676 25259 6786 1 9 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.716 -0.033 25259 6787 1 9 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.328 -3.129 25259 6788 1 9 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.981 -3.400 25259 6789 1 9 . 1 1 91 91 ASP H H 91 7.370 7.370 7.522 -0.152 25259 6790 1 9 . 1 1 92 92 LYS N N 92 129.311 129.311 128.031 1.280 25259 6791 1 9 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.964 0.049 25259 6792 1 9 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.716 -2.500 25259 6793 1 9 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.624 -2.609 25259 6794 1 9 . 1 1 92 92 LYS H H 92 8.795 8.795 8.879 -0.084 25259 6795 1 9 . 1 1 93 93 SER N N 93 118.112 118.112 114.084 4.028 25259 6796 1 9 . 1 1 93 93 SER HA H 93 4.439 4.439 4.153 0.286 25259 6797 1 9 . 1 1 93 93 SER CA C 93 58.945 58.945 61.711 -2.766 25259 6798 1 9 . 1 1 93 93 SER CB C 93 60.278 60.278 62.745 -2.467 25259 6799 1 9 . 1 1 93 93 SER H H 93 8.488 8.488 7.951 0.537 25259 6800 1 9 . 1 1 94 94 ILE N N 94 128.950 128.950 123.087 5.863 25259 6801 1 9 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.606 -0.124 25259 6802 1 9 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.222 -1.873 25259 6803 1 9 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.818 -3.065 25259 6804 1 9 . 1 1 94 94 ILE H H 94 7.722 7.722 7.550 0.172 25259 6805 1 9 . 1 1 95 95 ILE N N 95 123.598 123.598 119.862 3.736 25259 6806 1 9 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.582 0.013 25259 6807 1 9 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.565 -2.818 25259 6808 1 9 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.547 -1.575 25259 6809 1 9 . 1 1 95 95 ILE H H 95 8.378 8.378 8.178 0.200 25259 6810 1 9 . 1 1 96 96 GLU N N 96 118.317 118.317 117.966 0.351 25259 6811 1 9 . 1 1 96 96 GLU HA H 96 3.984 3.984 4.021 -0.037 25259 6812 1 9 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.029 -2.534 25259 6813 1 9 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.279 -2.106 25259 6814 1 9 . 1 1 96 96 GLU H H 96 7.680 7.680 7.550 0.130 25259 6815 1 9 . 1 1 97 97 ALA N N 97 124.797 124.797 122.581 2.216 25259 6816 1 9 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.732 0.093 25259 6817 1 9 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.548 -2.251 25259 6818 1 9 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.431 -2.442 25259 6819 1 9 . 1 1 97 97 ALA H H 97 7.383 7.383 7.677 -0.294 25259 6820 1 9 . 1 1 98 98 ARG N N 98 115.469 115.469 115.413 0.056 25259 6821 1 9 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.336 -0.030 25259 6822 1 9 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.998 -1.508 25259 6823 1 9 . 1 1 98 98 ARG CB C 98 28.238 28.238 30.000 -1.762 25259 6824 1 9 . 1 1 98 98 ARG H H 98 8.229 8.229 8.106 0.123 25259 6825 1 9 . 1 1 99 99 LYS N N 99 120.219 120.219 117.685 2.534 25259 6826 1 9 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.163 0.095 25259 6827 1 9 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.117 -1.876 25259 6828 1 9 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.321 -1.825 25259 6829 1 9 . 1 1 99 99 LYS H H 99 7.270 7.270 7.479 -0.209 25259 6830 1 9 . 1 1 100 100 LEU N N 100 123.800 123.800 120.085 3.715 25259 6831 1 9 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.566 -0.225 25259 6832 1 9 . 1 1 100 100 LEU CA C 100 52.079 52.079 53.672 -1.593 25259 6833 1 9 . 1 1 100 100 LEU CB C 100 39.131 39.131 43.240 -4.109 25259 6834 1 9 . 1 1 100 100 LEU H H 100 7.837 7.837 7.680 0.157 25259 6835 1 9 . 1 1 101 101 ALA N N 101 130.512 130.512 126.892 3.620 25259 6836 1 9 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.406 -0.030 25259 6837 1 9 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.919 -2.515 25259 6838 1 9 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.288 -2.492 25259 6839 1 9 . 1 1 101 101 ALA H H 101 8.213 8.213 8.835 -0.622 25259 6840 1 9 . 1 1 102 102 GLY N N 102 110.659 110.659 105.604 5.055 25259 6841 1 9 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.109 -1.216 25259 6842 1 9 . 1 1 102 102 GLY H H 102 8.738 8.738 7.644 1.094 25259 6843 1 9 . 1 1 103 103 PHE N N 103 123.097 123.097 123.229 -0.132 25259 6844 1 9 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.585 -0.365 25259 6845 1 9 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.238 -2.470 25259 6846 1 9 . 1 1 103 103 PHE CB C 103 40.574 40.574 41.804 -1.230 25259 6847 1 9 . 1 1 103 103 PHE H H 103 7.514 7.514 7.602 -0.088 25259 6848 1 9 . 1 1 104 104 LYS N N 104 130.652 130.652 124.570 6.082 25259 6849 1 9 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.271 -0.151 25259 6850 1 9 . 1 1 104 104 LYS CA C 104 52.979 52.979 53.848 -0.869 25259 6851 1 9 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.788 -2.551 25259 6852 1 9 . 1 1 104 104 LYS H H 104 7.473 7.473 8.172 -0.699 25259 6853 1 9 . 1 1 105 105 LEU N N 105 127.372 127.372 121.461 5.911 25259 6854 1 9 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.930 0.066 25259 6855 1 9 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.418 -1.682 25259 6856 1 9 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.868 -1.904 25259 6857 1 9 . 1 1 105 105 LEU H H 105 8.393 8.393 8.024 0.369 25259 6858 1 9 . 1 1 106 106 GLU N N 106 129.358 129.358 121.488 7.870 25259 6859 1 9 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.720 0.124 25259 6860 1 9 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.342 -2.552 25259 6861 1 9 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.369 -1.741 25259 6862 1 9 . 1 1 106 106 GLU H H 106 8.849 8.849 8.693 0.156 25259 6863 1 9 . 1 1 107 107 THR N N 107 131.118 131.118 114.753 16.365 25259 6864 1 9 . 1 1 107 107 THR HA H 107 5.110 5.110 4.764 0.346 25259 6865 1 9 . 1 1 107 107 THR CA C 107 59.832 59.832 60.868 -1.036 25259 6866 1 9 . 1 1 107 107 THR CB C 107 66.671 66.671 71.359 -4.688 25259 6867 1 9 . 1 1 107 107 THR H H 107 9.433 9.433 8.328 1.105 25259 6868 1 9 . 1 1 108 108 LYS N N 108 129.114 129.114 123.715 5.399 25259 6869 1 9 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.581 0.243 25259 6870 1 9 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.328 -3.134 25259 6871 1 9 . 1 1 108 108 LYS CB C 108 34.388 34.388 36.181 -1.793 25259 6872 1 9 . 1 1 108 108 LYS H H 108 9.410 9.410 9.130 0.280 25259 6873 1 9 . 1 1 109 109 LEU N N 109 129.323 129.323 125.889 3.434 25259 6874 1 9 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.615 0.089 25259 6875 1 9 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.173 -2.065 25259 6876 1 9 . 1 1 109 109 LEU CB C 109 39.655 39.655 43.444 -3.789 25259 6877 1 9 . 1 1 109 109 LEU H H 109 8.862 8.862 8.582 0.280 25259 6878 1 9 . 1 1 110 110 LEU N N 110 129.123 129.123 125.951 3.172 25259 6879 1 9 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.720 -0.497 25259 6880 1 9 . 1 1 110 110 LEU CA C 110 53.782 53.782 55.293 -1.511 25259 6881 1 9 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.987 -2.326 25259 6882 1 9 . 1 1 110 110 LEU H H 110 8.373 8.373 8.575 -0.202 25259 6883 1 9 . 1 1 111 111 SER N N 111 114.587 114.587 112.014 2.573 25259 6884 1 9 . 1 1 111 111 SER HA H 111 4.557 4.557 4.621 -0.064 25259 6885 1 9 . 1 1 111 111 SER CA C 111 53.889 53.889 57.592 -3.703 25259 6886 1 9 . 1 1 111 111 SER CB C 111 61.830 61.830 64.192 -2.362 25259 6887 1 9 . 1 1 111 111 SER H H 111 8.400 8.400 7.721 0.679 25259 6888 1 9 . 1 1 112 112 ALA N N 112 118.269 118.269 121.948 -3.679 25259 6889 1 9 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.275 0.034 25259 6890 1 9 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.634 -3.420 25259 6891 1 9 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.430 -1.842 25259 6892 1 9 . 1 1 112 112 ALA H H 112 8.556 8.556 8.635 -0.079 25259 6893 1 9 . 1 1 113 113 THR N N 113 102.878 102.878 103.649 -0.771 25259 6894 1 9 . 1 1 113 113 THR HA H 113 4.662 4.662 4.476 0.186 25259 6895 1 9 . 1 1 113 113 THR CA C 113 58.689 58.689 61.407 -2.718 25259 6896 1 9 . 1 1 113 113 THR CB C 113 67.905 67.905 69.490 -1.585 25259 6897 1 9 . 1 1 113 113 THR H H 113 8.065 8.065 7.720 0.345 25259 6898 1 9 . 1 1 114 114 GLU N N 114 126.514 126.514 120.514 6.000 25259 6899 1 9 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.940 0.074 25259 6900 1 9 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.163 -2.156 25259 6901 1 9 . 1 1 114 114 GLU CB C 114 32.913 32.913 33.923 -1.010 25259 6902 1 9 . 1 1 114 114 GLU H H 114 7.357 7.357 7.623 -0.266 25259 6903 1 9 . 1 1 115 115 LEU N N 115 128.058 128.058 121.031 7.027 25259 6904 1 9 . 1 1 115 115 LEU HA H 115 4.922 4.922 4.909 0.013 25259 6905 1 9 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.861 -1.538 25259 6906 1 9 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.478 -1.339 25259 6907 1 9 . 1 1 115 115 LEU H H 115 8.930 8.930 8.837 0.093 25259 6908 1 9 . 1 1 116 116 GLN N N 116 126.540 126.540 117.543 8.997 25259 6909 1 9 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.151 0.564 25259 6910 1 9 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.534 -2.834 25259 6911 1 9 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.469 -1.177 25259 6912 1 9 . 1 1 116 116 GLN H H 116 9.221 9.221 8.860 0.361 25259 6913 1 9 . 1 1 117 117 THR N N 117 125.213 125.213 119.922 5.291 25259 6914 1 9 . 1 1 117 117 THR HA H 117 5.353 5.353 5.129 0.224 25259 6915 1 9 . 1 1 117 117 THR CA C 117 58.926 58.926 61.135 -2.209 25259 6916 1 9 . 1 1 117 117 THR CB C 117 68.948 68.948 72.608 -3.659 25259 6917 1 9 . 1 1 117 117 THR H H 117 9.030 9.030 8.890 0.140 25259 6918 1 9 . 1 1 118 118 THR N N 118 127.799 127.799 118.257 9.542 25259 6919 1 9 . 1 1 118 118 THR HA H 118 5.527 5.527 5.195 0.332 25259 6920 1 9 . 1 1 118 118 THR CA C 118 59.201 59.201 61.373 -2.172 25259 6921 1 9 . 1 1 118 118 THR CB C 118 67.721 67.721 71.911 -4.190 25259 6922 1 9 . 1 1 118 118 THR H H 118 9.459 9.459 9.032 0.427 25259 6923 1 9 . 1 1 119 119 THR N N 119 129.258 129.258 121.361 7.897 25259 6924 1 9 . 1 1 119 119 THR HA H 119 4.885 4.885 4.757 0.128 25259 6925 1 9 . 1 1 119 119 THR CA C 119 58.463 58.463 61.164 -2.701 25259 6926 1 9 . 1 1 119 119 THR CB C 119 67.459 67.459 70.436 -2.977 25259 6927 1 9 . 1 1 119 119 THR H H 119 9.147 9.147 9.079 0.068 25259 6928 1 9 . 1 1 120 120 SER N N 120 123.389 123.389 120.119 3.270 25259 6929 1 9 . 1 1 120 120 SER HA H 120 5.328 5.328 4.763 0.565 25259 6930 1 9 . 1 1 120 120 SER CA C 120 54.386 54.386 56.794 -2.408 25259 6931 1 9 . 1 1 120 120 SER CB C 120 63.031 63.031 65.427 -2.396 25259 6932 1 9 . 1 1 120 120 SER H H 120 8.786 8.786 8.570 0.216 25259 6933 1 9 . 1 1 121 121 PHE N N 121 121.245 121.245 121.656 -0.411 25259 6934 1 9 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.937 0.175 25259 6935 1 9 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.080 -2.888 25259 6936 1 9 . 1 1 121 121 PHE CB C 121 40.265 40.265 40.307 -0.042 25259 6937 1 9 . 1 1 121 121 PHE H H 121 8.831 8.831 8.829 0.002 25259 6938 1 9 . 1 1 122 122 ASP N N 122 124.765 124.765 125.916 -1.151 25259 6939 1 9 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.843 -0.003 25259 6940 1 9 . 1 1 122 122 ASP CA C 122 49.837 49.837 52.554 -2.717 25259 6941 1 9 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.391 -1.906 25259 6942 1 9 . 1 1 122 122 ASP H H 122 8.819 8.819 9.068 -0.249 25259 6943 1 9 . 1 1 123 123 PHE N N 123 124.303 124.303 121.692 2.611 25259 6944 1 9 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.420 0.254 25259 6945 1 9 . 1 1 123 123 PHE CA C 123 57.798 57.798 59.222 -1.424 25259 6946 1 9 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.266 -2.726 25259 6947 1 9 . 1 1 123 123 PHE H H 123 8.262 8.262 7.911 0.351 25259 6948 1 9 . 1 1 124 124 GLN N N 124 120.792 120.792 117.701 3.091 25259 6949 1 9 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.257 0.177 25259 6950 1 9 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.191 -2.108 25259 6951 1 9 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.970 -1.841 25259 6952 1 9 . 1 1 124 124 GLN H H 124 8.954 8.954 8.245 0.709 25259 6953 1 9 . 1 1 125 125 VAL N N 125 114.091 114.091 115.963 -1.872 25259 6954 1 9 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.221 0.188 25259 6955 1 9 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.308 -3.010 25259 6956 1 9 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.477 -0.905 25259 6957 1 9 . 1 1 125 125 VAL H H 125 7.026 7.026 7.785 -0.759 25259 6958 1 9 . 1 1 126 126 LEU N N 126 125.158 125.158 122.905 2.253 25259 6959 1 9 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.511 -0.036 25259 6960 1 9 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.837 -2.662 25259 6961 1 9 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.908 -0.854 25259 6962 1 9 . 1 1 126 126 LEU H H 126 8.106 8.106 7.989 0.117 25259 6963 1 9 . 1 1 127 127 ASP N N 127 130.026 130.026 124.672 5.354 25259 6964 1 9 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.784 0.057 25259 6965 1 9 . 1 1 127 127 ASP CA C 127 50.198 50.198 52.859 -2.661 25259 6966 1 9 . 1 1 127 127 ASP CB C 127 37.689 37.689 41.233 -3.544 25259 6967 1 9 . 1 1 127 127 ASP H H 127 9.129 9.129 8.558 0.571 25259 6968 1 9 . 1 1 128 128 VAL N N 128 128.833 128.833 127.643 1.190 25259 6969 1 9 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.565 -0.041 25259 6970 1 9 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.077 -2.409 25259 6971 1 9 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.933 -2.438 25259 6972 1 9 . 1 1 128 128 VAL H H 128 8.288 8.288 8.641 -0.353 25259 6973 1 9 . 1 1 129 129 LYS N N 129 123.914 123.914 119.169 4.745 25259 6974 1 9 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.970 0.073 25259 6975 1 9 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.924 -2.135 25259 6976 1 9 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.973 -3.036 25259 6977 1 9 . 1 1 129 129 LYS H H 129 8.226 8.226 7.693 0.533 25259 6978 1 9 . 1 1 130 130 LYS N N 130 121.888 121.888 117.790 4.098 25259 6979 1 9 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.131 -0.046 25259 6980 1 9 . 1 1 130 130 LYS CA C 130 56.146 56.146 58.532 -2.386 25259 6981 1 9 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.008 -2.668 25259 6982 1 9 . 1 1 130 130 LYS H H 130 7.590 7.590 8.183 -0.593 25259 6983 1 9 . 1 1 131 131 ALA N N 131 123.088 123.088 122.792 0.296 25259 6984 1 9 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.033 -0.106 25259 6985 1 9 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.034 -2.632 25259 6986 1 9 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.161 -1.714 25259 6987 1 9 . 1 1 131 131 ALA H H 131 8.506 8.506 8.484 0.022 25259 6988 1 9 . 1 1 132 132 SER N N 132 110.456 110.456 112.216 -1.760 25259 6989 1 9 . 1 1 132 132 SER HA H 132 4.117 4.117 4.149 -0.032 25259 6990 1 9 . 1 1 132 132 SER CA C 132 58.289 58.289 60.365 -2.076 25259 6991 1 9 . 1 1 132 132 SER CB C 132 61.034 61.034 63.179 -2.145 25259 6992 1 9 . 1 1 132 132 SER H H 132 7.986 7.986 7.819 0.167 25259 6993 1 9 . 1 1 133 133 GLN N N 133 119.034 119.034 119.125 -0.091 25259 6994 1 9 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.333 0.069 25259 6995 1 9 . 1 1 133 133 GLN CA C 133 52.525 52.525 55.198 -2.673 25259 6996 1 9 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.661 -1.427 25259 6997 1 9 . 1 1 133 133 GLN H H 133 7.233 7.233 7.820 -0.587 25259 6998 1 9 . 1 1 134 134 LEU N N 134 123.291 123.291 118.729 4.562 25259 6999 1 9 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.549 -0.156 25259 7000 1 9 . 1 1 134 134 LEU CA C 134 52.316 52.316 52.250 0.066 25259 7001 1 9 . 1 1 134 134 LEU CB C 134 38.847 38.847 43.671 -4.824 25259 7002 1 9 . 1 1 134 134 LEU H H 134 7.411 7.411 7.396 0.015 25259 7003 1 9 . 1 1 135 135 GLU N N 135 128.446 128.446 118.724 9.722 25259 7004 1 9 . 1 1 135 135 GLU HA H 135 3.946 3.946 4.082 -0.136 25259 7005 1 9 . 1 1 135 135 GLU CA C 135 57.384 57.384 58.921 -1.537 25259 7006 1 9 . 1 1 135 135 GLU CB C 135 27.296 27.296 30.277 -2.981 25259 7007 1 9 . 1 1 135 135 GLU H H 135 8.986 8.986 8.764 0.222 25259 7008 1 9 . 1 1 136 136 HIS N N 136 117.593 117.593 118.067 -0.474 25259 7009 1 9 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.405 -0.022 25259 7010 1 9 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.810 -2.125 25259 7011 1 9 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.615 -1.202 25259 7012 1 9 . 1 1 136 136 HIS H H 136 9.226 9.226 8.586 0.640 25259 7013 1 9 . 1 1 137 137 LEU N N 137 115.463 115.463 116.190 -0.727 25259 7014 1 9 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.564 -0.057 25259 7015 1 9 . 1 1 137 137 LEU CA C 137 51.948 51.948 55.056 -3.108 25259 7016 1 9 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.208 -2.401 25259 7017 1 9 . 1 1 137 137 LEU H H 137 7.090 7.090 8.061 -0.971 25259 7018 1 9 . 1 1 138 138 LYS N N 138 124.686 124.686 121.667 3.019 25259 7019 1 9 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.020 0.149 25259 7020 1 9 . 1 1 138 138 LYS CA C 138 57.158 57.158 59.062 -1.904 25259 7021 1 9 . 1 1 138 138 LYS CB C 138 30.088 30.088 31.977 -1.889 25259 7022 1 9 . 1 1 138 138 LYS H H 138 7.698 7.698 7.708 -0.010 25259 7023 1 9 . 1 1 139 139 ASN N N 139 118.077 118.077 115.066 3.011 25259 7024 1 9 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.623 0.050 25259 7025 1 9 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.262 -2.480 25259 7026 1 9 . 1 1 139 139 ASN CB C 139 35.817 35.817 39.349 -3.532 25259 7027 1 9 . 1 1 139 139 ASN H H 139 8.485 8.485 8.302 0.183 25259 7028 1 9 . 1 1 140 140 ILE N N 140 120.880 120.880 120.118 0.762 25259 7029 1 9 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.084 -0.054 25259 7030 1 9 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.602 -2.036 25259 7031 1 9 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.331 -2.557 25259 7032 1 9 . 1 1 140 140 ILE H H 140 7.549 7.549 7.534 0.015 25259 7033 1 9 . 1 1 141 141 GLY N N 141 110.676 110.676 113.228 -2.552 25259 7034 1 9 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.959 -0.294 25259 7035 1 9 . 1 1 141 141 GLY H H 141 7.663 7.663 8.580 -0.917 25259 7036 1 9 . 1 1 142 142 LEU N N 142 123.857 123.857 121.611 2.246 25259 7037 1 9 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.690 0.003 25259 7038 1 9 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.447 -2.254 25259 7039 1 9 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.694 -1.085 25259 7040 1 9 . 1 1 142 142 LEU H H 142 8.496 8.496 8.003 0.493 25259 7041 1 9 . 1 1 143 143 GLU N N 143 118.407 118.407 119.000 -0.593 25259 7042 1 9 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.875 -0.089 25259 7043 1 9 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.078 -1.856 25259 7044 1 9 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.219 -2.706 25259 7045 1 9 . 1 1 143 143 GLU H H 143 8.672 8.672 8.322 0.350 25259 7046 1 9 . 1 1 144 144 ASN N N 144 118.477 118.477 116.625 1.852 25259 7047 1 9 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.490 -0.048 25259 7048 1 9 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.628 -1.916 25259 7049 1 9 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.244 -2.289 25259 7050 1 9 . 1 1 144 144 ASN H H 144 7.656 7.656 8.327 -0.671 25259 7051 1 9 . 1 1 145 145 LEU N N 145 125.354 125.354 121.259 4.095 25259 7052 1 9 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.760 0.037 25259 7053 1 9 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.383 -1.060 25259 7054 1 9 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.892 -2.319 25259 7055 1 9 . 1 1 145 145 LEU H H 145 7.758 7.758 7.046 0.712 25259 7056 1 9 . 1 1 146 146 LEU N N 146 116.372 116.372 115.970 0.402 25259 7057 1 9 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.955 -0.079 25259 7058 1 9 . 1 1 146 146 LEU CA C 146 53.243 53.243 54.996 -1.753 25259 7059 1 9 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.709 -1.812 25259 7060 1 9 . 1 1 146 146 LEU H H 146 7.242 7.242 7.551 -0.309 25259 7061 1 9 . 1 1 147 147 LYS N N 147 120.054 120.054 118.951 1.103 25259 7062 1 9 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.495 -0.183 25259 7063 1 9 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.183 -0.560 25259 7064 1 9 . 1 1 147 147 LYS CB C 147 30.260 30.260 33.129 -2.869 25259 7065 1 9 . 1 1 147 147 LYS H H 147 7.185 7.185 7.872 -0.687 25259 7066 1 9 . 1 1 148 148 ASN N N 148 119.498 119.498 116.660 2.838 25259 7067 1 9 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.847 0.115 25259 7068 1 9 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.195 -2.421 25259 7069 1 9 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.084 -0.598 25259 7070 1 9 . 1 1 148 148 ASN H H 148 7.698 7.698 7.572 0.126 25259 7071 1 9 . 1 1 149 149 GLU N N 149 122.834 122.834 118.935 3.899 25259 7072 1 9 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.388 0.213 25259 7073 1 9 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.334 -2.115 25259 7074 1 9 . 1 1 149 149 GLU CB C 149 26.810 26.810 28.838 -2.029 25259 7075 1 9 . 1 1 149 149 GLU H H 149 8.767 8.767 8.670 0.097 25259 7076 1 9 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.894 0.714 25259 7077 1 9 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.379 -1.137 25259 7078 1 9 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.135 -3.040 25259 7079 1 9 . 1 1 151 151 SER N N 151 112.839 112.839 110.829 2.010 25259 7080 1 9 . 1 1 151 151 SER HA H 151 3.835 3.835 4.615 -0.780 25259 7081 1 9 . 1 1 151 151 SER CA C 151 59.270 59.270 57.774 1.496 25259 7082 1 9 . 1 1 151 151 SER CB C 151 59.451 59.451 63.180 -3.729 25259 7083 1 9 . 1 1 151 151 SER H H 151 8.519 8.519 7.901 0.618 25259 7084 1 9 . 1 1 152 152 LYS N N 152 126.710 126.710 124.744 1.966 25259 7085 1 9 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.074 0.174 25259 7086 1 9 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.428 -3.663 25259 7087 1 9 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.708 -2.451 25259 7088 1 9 . 1 1 152 152 LYS H H 152 7.006 7.006 7.600 -0.594 25259 7089 1 9 . 1 1 153 153 TYR N N 153 123.239 123.239 117.371 5.868 25259 7090 1 9 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.428 -0.170 25259 7091 1 9 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.609 0.700 25259 7092 1 9 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.241 -0.907 25259 7093 1 9 . 1 1 153 153 TYR H H 153 8.058 8.058 7.800 0.258 25259 7094 1 9 . 1 1 154 154 ILE N N 154 120.253 120.253 120.781 -0.528 25259 7095 1 9 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.261 0.112 25259 7096 1 9 . 1 1 154 154 ILE CA C 154 63.114 63.114 64.898 -1.784 25259 7097 1 9 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.001 -1.053 25259 7098 1 9 . 1 1 154 154 ILE H H 154 8.193 8.193 7.826 0.367 25259 7099 1 9 . 1 1 155 155 SER N N 155 117.178 117.178 114.971 2.207 25259 7100 1 9 . 1 1 155 155 SER HA H 155 4.091 4.091 4.053 0.038 25259 7101 1 9 . 1 1 155 155 SER CA C 155 59.961 59.961 62.410 -2.449 25259 7102 1 9 . 1 1 155 155 SER CB C 155 60.148 60.148 62.969 -2.821 25259 7103 1 9 . 1 1 155 155 SER H H 155 8.020 8.020 7.905 0.115 25259 7104 1 9 . 1 1 156 156 ASP N N 156 125.479 125.479 121.088 4.391 25259 7105 1 9 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.404 0.023 25259 7106 1 9 . 1 1 156 156 ASP CA C 156 54.760 54.760 57.174 -2.414 25259 7107 1 9 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.038 -3.165 25259 7108 1 9 . 1 1 156 156 ASP H H 156 8.638 8.638 7.602 1.036 25259 7109 1 9 . 1 1 157 157 ARG N N 157 121.542 121.542 119.667 1.875 25259 7110 1 9 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.959 0.152 25259 7111 1 9 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.761 -2.833 25259 7112 1 9 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.738 -1.922 25259 7113 1 9 . 1 1 157 157 ARG H H 157 7.888 7.888 7.988 -0.100 25259 7114 1 9 . 1 1 158 158 LEU N N 158 124.257 124.257 119.314 4.943 25259 7115 1 9 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.272 -0.001 25259 7116 1 9 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.113 -2.900 25259 7117 1 9 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.038 -2.093 25259 7118 1 9 . 1 1 158 158 LEU H H 158 8.442 8.442 7.661 0.781 25259 7119 1 9 . 1 1 159 159 ALA N N 159 124.146 124.146 117.995 6.151 25259 7120 1 9 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.188 0.144 25259 7121 1 9 . 1 1 159 159 ALA CA C 159 51.432 51.432 53.375 -1.943 25259 7122 1 9 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.673 -2.766 25259 7123 1 9 . 1 1 159 159 ALA H H 159 8.086 8.086 7.711 0.375 25259 7124 1 9 . 1 1 160 160 ASN N N 160 118.093 118.093 116.956 1.137 25259 7125 1 9 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.741 0.251 25259 7126 1 9 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.967 -2.390 25259 7127 1 9 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.717 -0.984 25259 7128 1 9 . 1 1 160 160 ASN H H 160 7.445 7.445 7.712 -0.267 25259 7129 1 9 . 1 1 161 161 GLY N N 161 108.365 108.365 107.554 0.811 25259 7130 1 9 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.069 -1.423 25259 7131 1 9 . 1 1 161 161 GLY H H 161 7.743 7.743 7.898 -0.155 25259 7132 1 9 . 1 1 162 162 ALA N N 162 123.928 123.928 122.780 1.148 25259 7133 1 9 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.159 -0.286 25259 7134 1 9 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.024 -1.498 25259 7135 1 9 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.149 -3.089 25259 7136 1 9 . 1 1 162 162 ALA H H 162 8.035 8.035 7.556 0.479 25259 7137 1 9 . 1 1 163 163 THR N N 163 113.286 113.286 110.351 2.935 25259 7138 1 9 . 1 1 163 163 THR HA H 163 4.703 4.703 4.666 0.037 25259 7139 1 9 . 1 1 163 163 THR CA C 163 57.791 57.791 60.346 -2.555 25259 7140 1 9 . 1 1 163 163 THR CB C 163 68.974 68.974 71.399 -2.425 25259 7141 1 9 . 1 1 163 163 THR H H 163 8.451 8.451 8.387 0.064 25259 7142 1 9 . 1 1 164 164 GLU N N 164 125.905 125.905 119.455 6.450 25259 7143 1 9 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.987 0.073 25259 7144 1 9 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.574 -0.989 25259 7145 1 9 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.889 -3.678 25259 7146 1 9 . 1 1 164 164 GLU H H 164 8.716 8.716 8.467 0.249 25259 7147 1 10 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.225 -0.550 25259 7148 1 10 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.930 -2.122 25259 7149 1 10 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.452 -3.382 25259 7150 1 10 . 1 1 3 3 ALA N N 3 126.741 126.741 121.730 5.011 25259 7151 1 10 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.628 -0.134 25259 7152 1 10 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.772 -1.570 25259 7153 1 10 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.370 -3.552 25259 7154 1 10 . 1 1 3 3 ALA H H 3 8.440 8.440 8.194 0.246 25259 7155 1 10 . 1 1 4 4 THR N N 4 116.015 116.015 113.023 2.992 25259 7156 1 10 . 1 1 4 4 THR HA H 4 4.393 4.393 4.547 -0.154 25259 7157 1 10 . 1 1 4 4 THR CA C 4 59.148 59.148 61.557 -2.409 25259 7158 1 10 . 1 1 4 4 THR CB C 4 67.580 67.580 70.015 -2.435 25259 7159 1 10 . 1 1 4 4 THR H H 4 8.050 8.050 8.040 0.010 25259 7160 1 10 . 1 1 5 5 LYS N N 5 126.350 126.350 121.034 5.316 25259 7161 1 10 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.719 -0.214 25259 7162 1 10 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.478 -1.561 25259 7163 1 10 . 1 1 5 5 LYS CB C 5 30.684 30.684 33.945 -3.261 25259 7164 1 10 . 1 1 5 5 LYS H H 5 8.332 8.332 8.662 -0.330 25259 7165 1 10 . 1 1 6 6 THR N N 6 118.124 118.124 112.962 5.162 25259 7166 1 10 . 1 1 6 6 THR HA H 6 4.440 4.440 4.600 -0.160 25259 7167 1 10 . 1 1 6 6 THR CA C 6 59.282 59.282 61.848 -2.566 25259 7168 1 10 . 1 1 6 6 THR CB C 6 67.685 67.685 69.958 -2.273 25259 7169 1 10 . 1 1 6 6 THR H H 6 8.283 8.283 8.327 -0.044 25259 7170 1 10 . 1 1 7 7 GLU N N 7 125.934 125.934 120.362 5.572 25259 7171 1 10 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.536 -0.192 25259 7172 1 10 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.365 -1.185 25259 7173 1 10 . 1 1 7 7 GLU CB C 7 27.816 27.816 30.662 -2.846 25259 7174 1 10 . 1 1 7 7 GLU H H 7 8.487 8.487 8.843 -0.356 25259 7175 1 10 . 1 1 8 8 LYS N N 8 123.945 123.945 120.793 3.152 25259 7176 1 10 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.485 -1.550 25259 7177 1 10 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.374 -2.809 25259 7178 1 10 . 1 1 8 8 LYS H H 8 8.278 8.278 8.252 0.026 25259 7179 1 10 . 1 1 9 9 ASP N N 9 123.624 123.624 120.772 2.852 25259 7180 1 10 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.793 -0.454 25259 7181 1 10 . 1 1 9 9 ASP CA C 9 52.123 52.123 54.086 -1.963 25259 7182 1 10 . 1 1 9 9 ASP CB C 9 38.933 38.933 41.653 -2.720 25259 7183 1 10 . 1 1 9 9 ASP H H 9 8.277 8.277 8.412 -0.135 25259 7184 1 10 . 1 1 10 10 THR N N 10 116.812 116.812 112.699 4.113 25259 7185 1 10 . 1 1 10 10 THR HA H 10 4.349 4.349 4.629 -0.280 25259 7186 1 10 . 1 1 10 10 THR CA C 10 59.634 59.634 61.496 -1.862 25259 7187 1 10 . 1 1 10 10 THR CB C 10 67.254 67.254 70.512 -3.258 25259 7188 1 10 . 1 1 10 10 THR H H 10 8.049 8.049 8.023 0.026 25259 7189 1 10 . 1 1 11 11 LEU N N 11 126.610 126.610 123.684 2.926 25259 7190 1 10 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.419 -0.027 25259 7191 1 10 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.644 -1.566 25259 7192 1 10 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.497 -2.864 25259 7193 1 10 . 1 1 11 11 LEU H H 11 8.191 8.191 8.619 -0.428 25259 7194 1 10 . 1 1 12 12 GLN N N 12 123.274 123.274 119.768 3.506 25259 7195 1 10 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.492 -0.110 25259 7196 1 10 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.352 -1.778 25259 7197 1 10 . 1 1 12 12 GLN CB C 12 26.803 26.803 29.320 -2.518 25259 7198 1 10 . 1 1 12 12 GLN H H 12 8.280 8.280 8.528 -0.248 25259 7199 1 10 . 1 1 13 13 SER N N 13 119.027 119.027 115.277 3.750 25259 7200 1 10 . 1 1 13 13 SER HA H 13 4.471 4.471 4.825 -0.354 25259 7201 1 10 . 1 1 13 13 SER CA C 13 55.869 55.869 57.972 -2.103 25259 7202 1 10 . 1 1 13 13 SER CB C 13 61.424 61.424 64.389 -2.966 25259 7203 1 10 . 1 1 13 13 SER H H 13 8.178 8.178 8.342 -0.164 25259 7204 1 10 . 1 1 14 14 ALA N N 14 128.314 128.314 122.658 5.656 25259 7205 1 10 . 1 1 14 14 ALA HA H 14 4.434 4.434 5.172 -0.738 25259 7206 1 10 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.023 -1.327 25259 7207 1 10 . 1 1 14 14 ALA CB C 14 17.081 17.081 20.117 -3.036 25259 7208 1 10 . 1 1 14 14 ALA H H 14 8.195 8.195 8.755 -0.560 25259 7209 1 10 . 1 1 15 15 LEU N N 15 125.175 125.175 117.237 7.938 25259 7210 1 10 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.850 -0.210 25259 7211 1 10 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.063 -2.459 25259 7212 1 10 . 1 1 15 15 LEU CB C 15 39.467 39.467 41.869 -2.402 25259 7213 1 10 . 1 1 15 15 LEU H H 15 8.050 8.050 8.176 -0.126 25259 7214 1 10 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.708 -0.204 25259 7215 1 10 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.776 -2.145 25259 7216 1 10 . 1 1 16 16 PRO CB C 16 29.658 29.658 33.273 -3.615 25259 7217 1 10 . 1 1 17 17 VAL N N 17 123.223 123.223 119.427 3.796 25259 7218 1 10 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.454 -0.320 25259 7219 1 10 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.164 -1.337 25259 7220 1 10 . 1 1 17 17 VAL CB C 17 30.377 30.377 34.043 -3.666 25259 7221 1 10 . 1 1 17 17 VAL H H 17 8.134 8.134 8.306 -0.172 25259 7222 1 10 . 1 1 18 18 ILE N N 18 127.777 127.777 124.047 3.730 25259 7223 1 10 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.572 -0.329 25259 7224 1 10 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.679 -2.357 25259 7225 1 10 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.422 -4.168 25259 7226 1 10 . 1 1 18 18 ILE H H 18 8.187 8.187 8.527 -0.340 25259 7227 1 10 . 1 1 19 19 GLU N N 19 128.148 128.148 124.692 3.456 25259 7228 1 10 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.665 -0.328 25259 7229 1 10 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.321 -1.230 25259 7230 1 10 . 1 1 19 19 GLU CB C 19 28.176 28.176 31.857 -3.681 25259 7231 1 10 . 1 1 19 19 GLU H H 19 8.475 8.475 8.334 0.141 25259 7232 1 10 . 1 1 20 20 ASN N N 20 122.788 122.788 120.106 2.682 25259 7233 1 10 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.749 -0.054 25259 7234 1 10 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.657 -2.836 25259 7235 1 10 . 1 1 20 20 ASN CB C 20 36.366 36.366 38.913 -2.547 25259 7236 1 10 . 1 1 20 20 ASN H H 20 8.477 8.477 8.617 -0.140 25259 7237 1 10 . 1 1 21 21 ALA N N 21 127.253 127.253 126.512 0.741 25259 7238 1 10 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.447 -0.126 25259 7239 1 10 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.561 -0.873 25259 7240 1 10 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.743 -3.830 25259 7241 1 10 . 1 1 21 21 ALA H H 21 8.325 8.325 8.232 0.093 25259 7242 1 10 . 1 1 22 22 GLU N N 22 122.044 122.044 120.178 1.866 25259 7243 1 10 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.249 0.044 25259 7244 1 10 . 1 1 22 22 GLU CA C 22 54.583 54.583 57.332 -2.749 25259 7245 1 10 . 1 1 22 22 GLU CB C 22 27.285 27.285 29.231 -1.946 25259 7246 1 10 . 1 1 22 22 GLU H H 22 8.415 8.415 8.407 0.008 25259 7247 1 10 . 1 1 23 23 LYS N N 23 123.622 123.622 123.541 0.081 25259 7248 1 10 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.490 -0.165 25259 7249 1 10 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.266 -0.770 25259 7250 1 10 . 1 1 23 23 LYS CB C 23 30.653 30.653 35.117 -4.465 25259 7251 1 10 . 1 1 23 23 LYS H H 23 8.127 8.127 8.068 0.059 25259 7252 1 10 . 1 1 24 24 ASN N N 24 120.652 120.652 119.117 1.535 25259 7253 1 10 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.666 0.175 25259 7254 1 10 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.576 -2.913 25259 7255 1 10 . 1 1 24 24 ASN CB C 24 36.775 36.775 38.912 -2.137 25259 7256 1 10 . 1 1 24 24 ASN H H 24 8.424 8.424 8.507 -0.083 25259 7257 1 10 . 1 1 25 25 THR N N 25 117.102 117.102 113.660 3.442 25259 7258 1 10 . 1 1 25 25 THR HA H 25 4.367 4.367 4.254 0.113 25259 7259 1 10 . 1 1 25 25 THR CA C 25 59.500 59.500 62.297 -2.797 25259 7260 1 10 . 1 1 25 25 THR CB C 25 67.610 67.610 69.479 -1.869 25259 7261 1 10 . 1 1 25 25 THR H H 25 7.852 7.852 8.464 -0.612 25259 7262 1 10 . 1 1 26 26 VAL N N 26 126.491 126.491 127.267 -0.776 25259 7263 1 10 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.393 -0.226 25259 7264 1 10 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.932 -1.739 25259 7265 1 10 . 1 1 26 26 VAL CB C 26 29.605 29.605 32.836 -3.231 25259 7266 1 10 . 1 1 26 26 VAL H H 26 8.080 8.080 8.359 -0.279 25259 7267 1 10 . 1 1 27 27 VAL N N 27 132.992 132.992 126.638 6.354 25259 7268 1 10 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.618 -0.537 25259 7269 1 10 . 1 1 27 27 VAL CA C 27 58.984 58.984 59.807 -0.823 25259 7270 1 10 . 1 1 27 27 VAL CB C 27 31.540 31.540 34.239 -2.699 25259 7271 1 10 . 1 1 27 27 VAL H H 27 8.830 8.830 8.985 -0.155 25259 7272 1 10 . 1 1 28 28 THR N N 28 123.576 123.576 115.570 8.006 25259 7273 1 10 . 1 1 28 28 THR HA H 28 5.553 5.553 4.519 1.034 25259 7274 1 10 . 1 1 28 28 THR CA C 28 58.738 58.738 61.232 -2.494 25259 7275 1 10 . 1 1 28 28 THR CB C 28 68.443 68.443 70.320 -1.877 25259 7276 1 10 . 1 1 28 28 THR H H 28 8.165 8.165 7.992 0.173 25259 7277 1 10 . 1 1 29 29 LYS N N 29 129.099 129.099 126.563 2.536 25259 7278 1 10 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.642 0.300 25259 7279 1 10 . 1 1 29 29 LYS CA C 29 51.779 51.779 54.915 -3.136 25259 7280 1 10 . 1 1 29 29 LYS CB C 29 35.096 35.096 36.335 -1.239 25259 7281 1 10 . 1 1 29 29 LYS H H 29 9.273 9.273 8.601 0.672 25259 7282 1 10 . 1 1 30 30 THR N N 30 123.510 123.510 121.794 1.716 25259 7283 1 10 . 1 1 30 30 THR HA H 30 5.428 5.428 4.914 0.514 25259 7284 1 10 . 1 1 30 30 THR CA C 30 59.784 59.784 62.299 -2.515 25259 7285 1 10 . 1 1 30 30 THR CB C 30 67.818 67.818 70.350 -2.532 25259 7286 1 10 . 1 1 30 30 THR H H 30 8.993 8.993 9.393 -0.400 25259 7287 1 10 . 1 1 31 31 LEU N N 31 128.293 128.293 128.351 -0.058 25259 7288 1 10 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.855 0.365 25259 7289 1 10 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.612 -3.557 25259 7290 1 10 . 1 1 31 31 LEU CB C 31 43.399 43.399 42.534 0.865 25259 7291 1 10 . 1 1 31 31 LEU H H 31 9.557 9.557 9.041 0.516 25259 7292 1 10 . 1 1 32 32 VAL N N 32 126.919 126.919 126.135 0.784 25259 7293 1 10 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.113 0.338 25259 7294 1 10 . 1 1 32 32 VAL CA C 32 59.664 59.664 62.165 -2.501 25259 7295 1 10 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.689 -1.240 25259 7296 1 10 . 1 1 32 32 VAL H H 32 9.364 9.364 8.694 0.670 25259 7297 1 10 . 1 1 33 33 LEU N N 33 133.503 133.503 129.478 4.025 25259 7298 1 10 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.427 0.129 25259 7299 1 10 . 1 1 33 33 LEU CA C 33 52.004 52.004 54.222 -2.218 25259 7300 1 10 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.522 -4.675 25259 7301 1 10 . 1 1 33 33 LEU H H 33 8.587 8.587 7.911 0.676 25259 7302 1 10 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.442 0.039 25259 7303 1 10 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.510 -2.065 25259 7304 1 10 . 1 1 34 34 PRO CB C 34 29.565 29.565 31.873 -2.308 25259 7305 1 10 . 1 1 35 35 LYS N N 35 127.420 127.420 119.266 8.154 25259 7306 1 10 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.442 -0.076 25259 7307 1 10 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.637 -1.518 25259 7308 1 10 . 1 1 35 35 LYS CB C 35 30.594 30.594 33.104 -2.510 25259 7309 1 10 . 1 1 35 35 LYS H H 35 8.666 8.666 8.389 0.277 25259 7310 1 10 . 1 1 36 36 SER N N 36 122.222 122.222 114.213 8.009 25259 7311 1 10 . 1 1 36 36 SER HA H 36 4.753 4.753 4.711 0.042 25259 7312 1 10 . 1 1 36 36 SER CA C 36 55.328 55.328 57.174 -1.846 25259 7313 1 10 . 1 1 36 36 SER CB C 36 61.728 61.728 65.586 -3.858 25259 7314 1 10 . 1 1 36 36 SER H H 36 8.771 8.771 8.009 0.762 25259 7315 1 10 . 1 1 37 37 ASP N N 37 126.346 126.346 120.996 5.350 25259 7316 1 10 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.446 0.008 25259 7317 1 10 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.472 -1.857 25259 7318 1 10 . 1 1 37 37 ASP CB C 37 37.985 37.985 41.117 -3.132 25259 7319 1 10 . 1 1 37 37 ASP H H 37 8.859 8.859 8.576 0.283 25259 7320 1 10 . 1 1 38 38 ASP N N 38 119.171 119.171 118.140 1.031 25259 7321 1 10 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.839 -0.224 25259 7322 1 10 . 1 1 38 38 ASP CA C 38 50.788 50.788 52.908 -2.120 25259 7323 1 10 . 1 1 38 38 ASP CB C 38 37.635 37.635 40.733 -3.098 25259 7324 1 10 . 1 1 38 38 ASP H H 38 7.944 7.944 7.540 0.404 25259 7325 1 10 . 1 1 39 39 GLY N N 39 110.352 110.352 109.035 1.317 25259 7326 1 10 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.553 -2.792 25259 7327 1 10 . 1 1 39 39 GLY H H 39 8.145 8.145 7.989 0.156 25259 7328 1 10 . 1 1 40 40 SER N N 40 120.090 120.090 116.240 3.850 25259 7329 1 10 . 1 1 40 40 SER HA H 40 4.877 4.877 4.911 -0.034 25259 7330 1 10 . 1 1 40 40 SER CA C 40 56.525 56.525 57.514 -0.989 25259 7331 1 10 . 1 1 40 40 SER CB C 40 62.245 62.245 64.447 -2.202 25259 7332 1 10 . 1 1 40 40 SER H H 40 8.344 8.344 7.625 0.719 25259 7333 1 10 . 1 1 41 41 GLN N N 41 122.551 122.551 126.340 -3.789 25259 7334 1 10 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.675 0.252 25259 7335 1 10 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.166 -0.752 25259 7336 1 10 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.137 -2.823 25259 7337 1 10 . 1 1 41 41 GLN H H 41 8.627 8.627 8.523 0.104 25259 7338 1 10 . 1 1 42 42 GLN N N 42 131.724 131.724 118.565 13.159 25259 7339 1 10 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.695 0.916 25259 7340 1 10 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.944 -2.872 25259 7341 1 10 . 1 1 42 42 GLN CB C 42 30.319 30.319 31.972 -1.653 25259 7342 1 10 . 1 1 42 42 GLN H H 42 9.189 9.189 8.598 0.591 25259 7343 1 10 . 1 1 43 43 THR N N 43 122.202 122.202 113.982 8.220 25259 7344 1 10 . 1 1 43 43 THR HA H 43 5.380 5.380 5.124 0.256 25259 7345 1 10 . 1 1 43 43 THR CA C 43 58.863 58.863 61.191 -2.328 25259 7346 1 10 . 1 1 43 43 THR CB C 43 68.893 68.893 72.572 -3.679 25259 7347 1 10 . 1 1 43 43 THR H H 43 9.139 9.139 8.315 0.824 25259 7348 1 10 . 1 1 44 44 GLN N N 44 127.190 127.190 121.577 5.613 25259 7349 1 10 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.016 0.618 25259 7350 1 10 . 1 1 44 44 GLN CA C 44 51.668 51.668 55.266 -3.598 25259 7351 1 10 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.794 -3.884 25259 7352 1 10 . 1 1 44 44 GLN H H 44 9.760 9.760 8.818 0.942 25259 7353 1 10 . 1 1 45 45 THR N N 45 123.479 123.479 121.615 1.864 25259 7354 1 10 . 1 1 45 45 THR HA H 45 5.421 5.421 5.083 0.338 25259 7355 1 10 . 1 1 45 45 THR CA C 45 60.071 60.071 63.157 -3.086 25259 7356 1 10 . 1 1 45 45 THR CB C 45 67.541 67.541 69.911 -2.370 25259 7357 1 10 . 1 1 45 45 THR H H 45 9.518 9.518 8.511 1.007 25259 7358 1 10 . 1 1 46 46 ILE N N 46 133.908 133.908 126.916 6.992 25259 7359 1 10 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.913 0.090 25259 7360 1 10 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.487 -2.016 25259 7361 1 10 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.885 0.060 25259 7362 1 10 . 1 1 46 46 ILE H H 46 9.830 9.830 9.262 0.568 25259 7363 1 10 . 1 1 47 47 THR N N 47 124.701 124.701 124.093 0.608 25259 7364 1 10 . 1 1 47 47 THR HA H 47 6.048 6.048 4.748 1.300 25259 7365 1 10 . 1 1 47 47 THR CA C 47 58.551 58.551 62.629 -4.078 25259 7366 1 10 . 1 1 47 47 THR CB C 47 67.819 67.819 69.201 -1.381 25259 7367 1 10 . 1 1 47 47 THR H H 47 8.843 8.843 8.571 0.272 25259 7368 1 10 . 1 1 48 48 TYR N N 48 127.369 127.369 122.110 5.259 25259 7369 1 10 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.568 -0.290 25259 7370 1 10 . 1 1 48 48 TYR CA C 48 53.729 53.729 55.484 -1.755 25259 7371 1 10 . 1 1 48 48 TYR CB C 48 39.432 39.432 42.283 -2.851 25259 7372 1 10 . 1 1 48 48 TYR H H 48 9.638 9.638 8.283 1.355 25259 7373 1 10 . 1 1 49 49 LYS N N 49 122.138 122.138 120.981 1.157 25259 7374 1 10 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.900 -0.244 25259 7375 1 10 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.914 -2.942 25259 7376 1 10 . 1 1 49 49 LYS CB C 49 33.603 33.603 35.815 -2.212 25259 7377 1 10 . 1 1 49 49 LYS H H 49 8.560 8.560 8.571 -0.011 25259 7378 1 10 . 1 1 50 50 ASP N N 50 130.208 130.208 128.572 1.636 25259 7379 1 10 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.317 -0.013 25259 7380 1 10 . 1 1 50 50 ASP CA C 50 54.760 54.760 57.662 -2.902 25259 7381 1 10 . 1 1 50 50 ASP CB C 50 37.339 37.339 40.165 -2.826 25259 7382 1 10 . 1 1 50 50 ASP H H 50 9.597 9.597 9.247 0.350 25259 7383 1 10 . 1 1 51 51 LYS N N 51 124.586 124.586 118.665 5.921 25259 7384 1 10 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.391 0.140 25259 7385 1 10 . 1 1 51 51 LYS CA C 51 53.734 53.734 55.184 -1.450 25259 7386 1 10 . 1 1 51 51 LYS CB C 51 30.395 30.395 33.974 -3.579 25259 7387 1 10 . 1 1 51 51 LYS H H 51 8.450 8.450 8.172 0.278 25259 7388 1 10 . 1 1 52 52 THR N N 52 120.044 120.044 117.459 2.585 25259 7389 1 10 . 1 1 52 52 THR HA H 52 4.717 4.717 4.655 0.062 25259 7390 1 10 . 1 1 52 52 THR CA C 52 59.313 59.313 61.183 -1.870 25259 7391 1 10 . 1 1 52 52 THR CB C 52 68.815 68.815 71.067 -2.252 25259 7392 1 10 . 1 1 52 52 THR H H 52 8.658 8.658 8.106 0.552 25259 7393 1 10 . 1 1 53 53 PHE N N 53 128.987 128.987 126.540 2.447 25259 7394 1 10 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.574 -0.291 25259 7395 1 10 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.623 -1.634 25259 7396 1 10 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.481 0.830 25259 7397 1 10 . 1 1 53 53 PHE H H 53 9.218 9.218 8.909 0.309 25259 7398 1 10 . 1 1 54 54 LEU N N 54 124.874 124.874 124.198 0.676 25259 7399 1 10 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.468 0.461 25259 7400 1 10 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.644 -2.402 25259 7401 1 10 . 1 1 54 54 LEU CB C 54 40.517 40.517 43.007 -2.490 25259 7402 1 10 . 1 1 54 54 LEU H H 54 9.391 9.391 8.755 0.636 25259 7403 1 10 . 1 1 55 55 SER N N 55 115.516 115.516 109.266 6.250 25259 7404 1 10 . 1 1 55 55 SER HA H 55 5.194 5.194 4.828 0.366 25259 7405 1 10 . 1 1 55 55 SER CA C 55 55.818 55.818 58.024 -2.206 25259 7406 1 10 . 1 1 55 55 SER CB C 55 63.474 63.474 66.065 -2.591 25259 7407 1 10 . 1 1 55 55 SER H H 55 8.736 8.736 7.849 0.887 25259 7408 1 10 . 1 1 56 56 LEU N N 56 124.352 124.352 121.100 3.252 25259 7409 1 10 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.382 0.161 25259 7410 1 10 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.221 -2.584 25259 7411 1 10 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.958 -1.445 25259 7412 1 10 . 1 1 56 56 LEU H H 56 8.328 8.328 8.713 -0.385 25259 7413 1 10 . 1 1 57 57 ALA N N 57 131.450 131.450 126.056 5.394 25259 7414 1 10 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.403 0.102 25259 7415 1 10 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.277 -2.075 25259 7416 1 10 . 1 1 57 57 ALA CB C 57 18.964 18.964 22.825 -3.861 25259 7417 1 10 . 1 1 57 57 ALA H H 57 9.208 9.208 8.923 0.285 25259 7418 1 10 . 1 1 58 58 ILE N N 58 126.248 126.248 119.824 6.424 25259 7419 1 10 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.693 0.091 25259 7420 1 10 . 1 1 58 58 ILE CA C 58 58.247 58.247 61.096 -2.849 25259 7421 1 10 . 1 1 58 58 ILE CB C 58 38.045 38.045 41.061 -3.016 25259 7422 1 10 . 1 1 58 58 ILE H H 58 9.597 9.597 9.024 0.573 25259 7423 1 10 . 1 1 59 59 GLN N N 59 132.065 132.065 127.081 4.984 25259 7424 1 10 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.422 0.825 25259 7425 1 10 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.806 -3.642 25259 7426 1 10 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.505 -0.844 25259 7427 1 10 . 1 1 59 59 GLN H H 59 9.389 9.389 8.897 0.492 25259 7428 1 10 . 1 1 60 60 GLN N N 60 130.314 130.314 116.620 13.694 25259 7429 1 10 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.686 0.523 25259 7430 1 10 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.278 -3.257 25259 7431 1 10 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.511 -4.035 25259 7432 1 10 . 1 1 60 60 GLN H H 60 9.471 9.471 8.308 1.163 25259 7433 1 10 . 1 1 61 61 LYS N N 61 131.044 131.044 123.682 7.362 25259 7434 1 10 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.164 0.251 25259 7435 1 10 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.951 -2.831 25259 7436 1 10 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.990 -3.573 25259 7437 1 10 . 1 1 61 61 LYS H H 61 8.893 8.893 8.639 0.254 25259 7438 1 10 . 1 1 62 62 ARG N N 62 125.397 125.397 122.612 2.785 25259 7439 1 10 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.141 -0.138 25259 7440 1 10 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.551 -2.461 25259 7441 1 10 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.765 -1.887 25259 7442 1 10 . 1 1 62 62 ARG H H 62 9.120 9.120 8.159 0.961 25259 7443 1 10 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.885 0.090 25259 7444 1 10 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.402 -2.905 25259 7445 1 10 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.364 -2.480 25259 7446 1 10 . 1 1 64 64 VAL N N 64 121.305 121.305 115.491 5.814 25259 7447 1 10 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.370 -0.346 25259 7448 1 10 . 1 1 64 64 VAL CA C 64 59.677 59.677 60.800 -1.123 25259 7449 1 10 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.999 -2.634 25259 7450 1 10 . 1 1 64 64 VAL H H 64 7.520 7.520 7.928 -0.408 25259 7451 1 10 . 1 1 65 65 SER N N 65 123.215 123.215 114.478 8.737 25259 7452 1 10 . 1 1 65 65 SER HA H 65 4.521 4.521 4.766 -0.245 25259 7453 1 10 . 1 1 65 65 SER CA C 65 54.897 54.897 57.238 -2.341 25259 7454 1 10 . 1 1 65 65 SER CB C 65 62.564 62.564 66.069 -3.505 25259 7455 1 10 . 1 1 65 65 SER H H 65 8.080 8.080 8.086 -0.006 25259 7456 1 10 . 1 1 66 66 ASP N N 66 123.802 123.802 122.016 1.786 25259 7457 1 10 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.423 0.006 25259 7458 1 10 . 1 1 66 66 ASP CA C 66 55.378 55.378 57.012 -1.634 25259 7459 1 10 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.775 -2.737 25259 7460 1 10 . 1 1 66 66 ASP H H 66 8.900 8.900 8.835 0.065 25259 7461 1 10 . 1 1 67 67 GLU N N 67 121.943 121.943 119.446 2.497 25259 7462 1 10 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.020 0.169 25259 7463 1 10 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.128 -1.688 25259 7464 1 10 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.463 -2.678 25259 7465 1 10 . 1 1 67 67 GLU H H 67 8.717 8.717 8.575 0.142 25259 7466 1 10 . 1 1 68 68 LEU N N 68 125.458 125.458 117.474 7.984 25259 7467 1 10 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.455 -0.112 25259 7468 1 10 . 1 1 68 68 LEU CA C 68 54.472 54.472 55.565 -1.093 25259 7469 1 10 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.779 -2.375 25259 7470 1 10 . 1 1 68 68 LEU H H 68 7.820 7.820 8.037 -0.217 25259 7471 1 10 . 1 1 69 69 LYS N N 69 123.868 123.868 120.698 3.170 25259 7472 1 10 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.043 -0.037 25259 7473 1 10 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.869 -2.252 25259 7474 1 10 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.011 -1.974 25259 7475 1 10 . 1 1 69 69 LYS H H 69 8.690 8.690 7.534 1.156 25259 7476 1 10 . 1 1 70 70 THR N N 70 117.109 117.109 116.366 0.743 25259 7477 1 10 . 1 1 70 70 THR HA H 70 4.088 4.088 3.891 0.197 25259 7478 1 10 . 1 1 70 70 THR CA C 70 63.879 63.879 67.419 -3.540 25259 7479 1 10 . 1 1 70 70 THR CB C 70 66.383 66.383 68.825 -2.442 25259 7480 1 10 . 1 1 70 70 THR H H 70 7.935 7.935 7.828 0.107 25259 7481 1 10 . 1 1 71 71 TYR N N 71 127.006 127.006 122.086 4.920 25259 7482 1 10 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.321 -0.116 25259 7483 1 10 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.845 -1.620 25259 7484 1 10 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.337 -1.792 25259 7485 1 10 . 1 1 71 71 TYR H H 71 7.683 7.683 7.952 -0.269 25259 7486 1 10 . 1 1 72 72 ILE N N 72 125.064 125.064 120.637 4.427 25259 7487 1 10 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.772 -0.093 25259 7488 1 10 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.487 -2.591 25259 7489 1 10 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.919 -1.643 25259 7490 1 10 . 1 1 72 72 ILE H H 72 9.083 9.083 7.799 1.284 25259 7491 1 10 . 1 1 73 73 ASP N N 73 124.900 124.900 119.454 5.446 25259 7492 1 10 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.395 -0.006 25259 7493 1 10 . 1 1 73 73 ASP CA C 73 55.038 55.038 57.110 -2.072 25259 7494 1 10 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.971 -2.864 25259 7495 1 10 . 1 1 73 73 ASP H H 73 8.751 8.751 8.062 0.689 25259 7496 1 10 . 1 1 74 74 GLN N N 74 117.025 117.025 117.314 -0.289 25259 7497 1 10 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.946 0.192 25259 7498 1 10 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.934 -3.124 25259 7499 1 10 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.058 -1.494 25259 7500 1 10 . 1 1 74 74 GLN H H 74 7.447 7.447 8.226 -0.779 25259 7501 1 10 . 1 1 75 75 HIS N N 75 116.494 116.494 113.574 2.920 25259 7502 1 10 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.760 -0.044 25259 7503 1 10 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.776 -2.710 25259 7504 1 10 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.993 -4.691 25259 7505 1 10 . 1 1 75 75 HIS H H 75 8.402 8.402 8.086 0.316 25259 7506 1 10 . 1 1 76 76 GLY N N 76 112.564 112.564 106.060 6.504 25259 7507 1 10 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.925 -3.029 25259 7508 1 10 . 1 1 76 76 GLY H H 76 9.091 9.091 7.647 1.444 25259 7509 1 10 . 1 1 77 77 VAL N N 77 124.763 124.763 121.767 2.996 25259 7510 1 10 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.780 -0.215 25259 7511 1 10 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.311 -0.360 25259 7512 1 10 . 1 1 77 77 VAL CB C 77 29.838 29.838 31.898 -2.060 25259 7513 1 10 . 1 1 77 77 VAL H H 77 8.927 8.927 8.758 0.169 25259 7514 1 10 . 1 1 78 78 GLU N N 78 124.388 124.388 119.260 5.128 25259 7515 1 10 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.010 0.138 25259 7516 1 10 . 1 1 78 78 GLU CA C 78 58.316 58.316 60.108 -1.792 25259 7517 1 10 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.283 -2.824 25259 7518 1 10 . 1 1 78 78 GLU H H 78 8.781 8.781 8.731 0.050 25259 7519 1 10 . 1 1 79 79 GLU N N 79 121.887 121.887 118.271 3.616 25259 7520 1 10 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.103 0.085 25259 7521 1 10 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.409 -2.864 25259 7522 1 10 . 1 1 79 79 GLU CB C 79 27.033 27.033 28.955 -1.922 25259 7523 1 10 . 1 1 79 79 GLU H H 79 9.231 9.231 8.577 0.654 25259 7524 1 10 . 1 1 80 80 THR N N 80 120.781 120.781 117.285 3.496 25259 7525 1 10 . 1 1 80 80 THR HA H 80 4.059 4.059 3.799 0.260 25259 7526 1 10 . 1 1 80 80 THR CA C 80 65.487 65.487 66.945 -1.458 25259 7527 1 10 . 1 1 80 80 THR CB C 80 64.369 64.369 68.603 -4.234 25259 7528 1 10 . 1 1 80 80 THR H H 80 7.858 7.858 8.562 -0.704 25259 7529 1 10 . 1 1 81 81 GLN N N 81 125.303 125.303 121.311 3.992 25259 7530 1 10 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.889 0.155 25259 7531 1 10 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.240 -2.271 25259 7532 1 10 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.567 -2.490 25259 7533 1 10 . 1 1 81 81 GLN H H 81 8.765 8.765 7.648 1.117 25259 7534 1 10 . 1 1 82 82 LYS N N 82 120.458 120.458 119.677 0.781 25259 7535 1 10 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.850 0.239 25259 7536 1 10 . 1 1 82 82 LYS CA C 82 57.312 57.312 59.308 -1.996 25259 7537 1 10 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.935 -1.781 25259 7538 1 10 . 1 1 82 82 LYS H H 82 7.521 7.521 7.632 -0.111 25259 7539 1 10 . 1 1 83 83 ALA N N 83 125.234 125.234 122.081 3.153 25259 7540 1 10 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.860 0.357 25259 7541 1 10 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.898 -2.456 25259 7542 1 10 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.989 -2.703 25259 7543 1 10 . 1 1 83 83 ALA H H 83 7.782 7.782 8.116 -0.334 25259 7544 1 10 . 1 1 84 84 LEU N N 84 123.348 123.348 119.430 3.918 25259 7545 1 10 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.878 0.180 25259 7546 1 10 . 1 1 84 84 LEU CA C 84 55.499 55.499 58.333 -2.834 25259 7547 1 10 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.525 -2.217 25259 7548 1 10 . 1 1 84 84 LEU H H 84 8.590 8.590 7.801 0.789 25259 7549 1 10 . 1 1 85 85 LEU N N 85 122.872 122.872 118.628 4.244 25259 7550 1 10 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.878 0.292 25259 7551 1 10 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.838 -2.442 25259 7552 1 10 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.517 -1.776 25259 7553 1 10 . 1 1 85 85 LEU H H 85 7.892 7.892 7.702 0.190 25259 7554 1 10 . 1 1 86 86 GLU N N 86 122.713 122.713 118.218 4.495 25259 7555 1 10 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.959 0.126 25259 7556 1 10 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.087 -2.342 25259 7557 1 10 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.727 -2.824 25259 7558 1 10 . 1 1 86 86 GLU H H 86 8.124 8.124 8.313 -0.189 25259 7559 1 10 . 1 1 87 87 ALA N N 87 123.163 123.163 121.008 2.155 25259 7560 1 10 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.162 -0.021 25259 7561 1 10 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.717 -2.449 25259 7562 1 10 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.439 -2.807 25259 7563 1 10 . 1 1 87 87 ALA H H 87 7.765 7.765 7.529 0.236 25259 7564 1 10 . 1 1 88 88 GLU N N 88 121.945 121.945 118.389 3.556 25259 7565 1 10 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.077 0.007 25259 7566 1 10 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.837 -1.902 25259 7567 1 10 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.083 -1.056 25259 7568 1 10 . 1 1 88 88 GLU H H 88 7.846 7.846 7.930 -0.084 25259 7569 1 10 . 1 1 89 89 GLU N N 89 117.978 117.978 116.099 1.879 25259 7570 1 10 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.209 -0.116 25259 7571 1 10 . 1 1 89 89 GLU CA C 89 55.214 55.214 57.718 -2.504 25259 7572 1 10 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.222 -1.815 25259 7573 1 10 . 1 1 89 89 GLU H H 89 7.634 7.634 7.719 -0.085 25259 7574 1 10 . 1 1 90 90 LYS N N 90 117.519 117.519 116.394 1.125 25259 7575 1 10 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.426 0.005 25259 7576 1 10 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.393 -2.375 25259 7577 1 10 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.972 -1.942 25259 7578 1 10 . 1 1 90 90 LYS H H 90 7.247 7.247 7.373 -0.126 25259 7579 1 10 . 1 1 91 91 ASP N N 91 124.888 124.888 123.223 1.665 25259 7580 1 10 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.632 0.051 25259 7581 1 10 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.322 -2.123 25259 7582 1 10 . 1 1 91 91 ASP CB C 91 39.581 39.581 41.802 -2.221 25259 7583 1 10 . 1 1 91 91 ASP H H 91 7.370 7.370 7.533 -0.163 25259 7584 1 10 . 1 1 92 92 LYS N N 92 129.311 129.311 126.649 2.662 25259 7585 1 10 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.870 0.143 25259 7586 1 10 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.634 -2.418 25259 7587 1 10 . 1 1 92 92 LYS CB C 92 30.015 30.015 31.999 -1.984 25259 7588 1 10 . 1 1 92 92 LYS H H 92 8.795 8.795 8.426 0.369 25259 7589 1 10 . 1 1 93 93 SER N N 93 118.112 118.112 114.764 3.348 25259 7590 1 10 . 1 1 93 93 SER HA H 93 4.439 4.439 4.527 -0.088 25259 7591 1 10 . 1 1 93 93 SER CA C 93 58.945 58.945 60.039 -1.094 25259 7592 1 10 . 1 1 93 93 SER CB C 93 60.278 60.278 63.449 -3.171 25259 7593 1 10 . 1 1 93 93 SER H H 93 8.488 8.488 7.951 0.537 25259 7594 1 10 . 1 1 94 94 ILE N N 94 128.950 128.950 122.024 6.926 25259 7595 1 10 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.667 -0.185 25259 7596 1 10 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.221 -1.871 25259 7597 1 10 . 1 1 94 94 ILE CB C 94 34.753 34.753 38.646 -3.893 25259 7598 1 10 . 1 1 94 94 ILE H H 94 7.722 7.722 7.727 -0.005 25259 7599 1 10 . 1 1 95 95 ILE N N 95 123.598 123.598 121.742 1.856 25259 7600 1 10 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.519 0.076 25259 7601 1 10 . 1 1 95 95 ILE CA C 95 62.747 62.747 66.332 -3.585 25259 7602 1 10 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.628 -1.656 25259 7603 1 10 . 1 1 95 95 ILE H H 95 8.378 8.378 8.444 -0.066 25259 7604 1 10 . 1 1 96 96 GLU N N 96 118.317 118.317 119.254 -0.937 25259 7605 1 10 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.977 0.007 25259 7606 1 10 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.017 -2.522 25259 7607 1 10 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.382 -2.209 25259 7608 1 10 . 1 1 96 96 GLU H H 96 7.680 7.680 8.408 -0.728 25259 7609 1 10 . 1 1 97 97 ALA N N 97 124.797 124.797 121.253 3.544 25259 7610 1 10 . 1 1 97 97 ALA HA H 97 3.825 3.825 4.113 -0.288 25259 7611 1 10 . 1 1 97 97 ALA CA C 97 52.297 52.297 53.593 -1.296 25259 7612 1 10 . 1 1 97 97 ALA CB C 97 14.989 14.989 18.441 -3.452 25259 7613 1 10 . 1 1 97 97 ALA H H 97 7.383 7.383 7.402 -0.019 25259 7614 1 10 . 1 1 98 98 ARG N N 98 115.469 115.469 118.087 -2.618 25259 7615 1 10 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.333 -0.027 25259 7616 1 10 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.341 -1.851 25259 7617 1 10 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.981 -1.743 25259 7618 1 10 . 1 1 98 98 ARG H H 98 8.229 8.229 8.170 0.059 25259 7619 1 10 . 1 1 99 99 LYS N N 99 120.219 120.219 117.081 3.138 25259 7620 1 10 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.086 0.172 25259 7621 1 10 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.979 -2.738 25259 7622 1 10 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.406 -1.910 25259 7623 1 10 . 1 1 99 99 LYS H H 99 7.270 7.270 7.567 -0.297 25259 7624 1 10 . 1 1 100 100 LEU N N 100 123.800 123.800 118.741 5.059 25259 7625 1 10 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.318 0.023 25259 7626 1 10 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.434 -2.355 25259 7627 1 10 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.529 -3.398 25259 7628 1 10 . 1 1 100 100 LEU H H 100 7.837 7.837 7.556 0.281 25259 7629 1 10 . 1 1 101 101 ALA N N 101 130.512 130.512 122.244 8.268 25259 7630 1 10 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.596 -0.220 25259 7631 1 10 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.179 -1.775 25259 7632 1 10 . 1 1 101 101 ALA CB C 101 15.796 15.796 19.694 -3.898 25259 7633 1 10 . 1 1 101 101 ALA H H 101 8.213 8.213 8.780 -0.567 25259 7634 1 10 . 1 1 102 102 GLY N N 102 110.659 110.659 106.343 4.316 25259 7635 1 10 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.465 -1.572 25259 7636 1 10 . 1 1 102 102 GLY H H 102 8.738 8.738 8.281 0.457 25259 7637 1 10 . 1 1 103 103 PHE N N 103 123.097 123.097 121.169 1.928 25259 7638 1 10 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.489 -0.269 25259 7639 1 10 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.238 -2.470 25259 7640 1 10 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.946 -2.372 25259 7641 1 10 . 1 1 103 103 PHE H H 103 7.514 7.514 7.769 -0.255 25259 7642 1 10 . 1 1 104 104 LYS N N 104 130.652 130.652 124.322 6.330 25259 7643 1 10 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.184 -0.064 25259 7644 1 10 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.236 -1.257 25259 7645 1 10 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.999 -2.762 25259 7646 1 10 . 1 1 104 104 LYS H H 104 7.473 7.473 8.592 -1.119 25259 7647 1 10 . 1 1 105 105 LEU N N 105 127.372 127.372 123.089 4.283 25259 7648 1 10 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.010 -0.014 25259 7649 1 10 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.071 -2.335 25259 7650 1 10 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.568 -1.604 25259 7651 1 10 . 1 1 105 105 LEU H H 105 8.393 8.393 8.080 0.313 25259 7652 1 10 . 1 1 106 106 GLU N N 106 129.358 129.358 123.910 5.448 25259 7653 1 10 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.659 0.185 25259 7654 1 10 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.575 -2.784 25259 7655 1 10 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.559 -1.931 25259 7656 1 10 . 1 1 106 106 GLU H H 106 8.849 8.849 8.472 0.377 25259 7657 1 10 . 1 1 107 107 THR N N 107 131.118 131.118 119.724 11.394 25259 7658 1 10 . 1 1 107 107 THR HA H 107 5.110 5.110 5.028 0.082 25259 7659 1 10 . 1 1 107 107 THR CA C 107 59.832 59.832 60.812 -0.980 25259 7660 1 10 . 1 1 107 107 THR CB C 107 66.671 66.671 70.835 -4.164 25259 7661 1 10 . 1 1 107 107 THR H H 107 9.433 9.433 8.352 1.081 25259 7662 1 10 . 1 1 108 108 LYS N N 108 129.114 129.114 123.304 5.810 25259 7663 1 10 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.657 0.167 25259 7664 1 10 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.743 -2.549 25259 7665 1 10 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.795 -1.407 25259 7666 1 10 . 1 1 108 108 LYS H H 108 9.410 9.410 9.042 0.368 25259 7667 1 10 . 1 1 109 109 LEU N N 109 129.323 129.323 124.348 4.975 25259 7668 1 10 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.540 0.164 25259 7669 1 10 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.526 -2.418 25259 7670 1 10 . 1 1 109 109 LEU CB C 109 39.655 39.655 43.011 -3.356 25259 7671 1 10 . 1 1 109 109 LEU H H 109 8.862 8.862 8.596 0.266 25259 7672 1 10 . 1 1 110 110 LEU N N 110 129.123 129.123 128.133 0.990 25259 7673 1 10 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.218 0.005 25259 7674 1 10 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.787 -3.005 25259 7675 1 10 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.651 -1.990 25259 7676 1 10 . 1 1 110 110 LEU H H 110 8.373 8.373 8.899 -0.526 25259 7677 1 10 . 1 1 111 111 SER N N 111 114.587 114.587 111.196 3.391 25259 7678 1 10 . 1 1 111 111 SER HA H 111 4.557 4.557 4.625 -0.068 25259 7679 1 10 . 1 1 111 111 SER CA C 111 53.889 53.889 57.786 -3.897 25259 7680 1 10 . 1 1 111 111 SER CB C 111 61.830 61.830 65.247 -3.417 25259 7681 1 10 . 1 1 111 111 SER H H 111 8.400 8.400 7.806 0.594 25259 7682 1 10 . 1 1 112 112 ALA N N 112 118.269 118.269 123.902 -5.633 25259 7683 1 10 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.217 0.092 25259 7684 1 10 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.303 -3.089 25259 7685 1 10 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.545 -1.957 25259 7686 1 10 . 1 1 112 112 ALA H H 112 8.556 8.556 8.620 -0.064 25259 7687 1 10 . 1 1 113 113 THR N N 113 102.878 102.878 103.338 -0.460 25259 7688 1 10 . 1 1 113 113 THR HA H 113 4.662 4.662 4.497 0.165 25259 7689 1 10 . 1 1 113 113 THR CA C 113 58.689 58.689 61.824 -3.135 25259 7690 1 10 . 1 1 113 113 THR CB C 113 67.905 67.905 69.390 -1.485 25259 7691 1 10 . 1 1 113 113 THR H H 113 8.065 8.065 7.763 0.302 25259 7692 1 10 . 1 1 114 114 GLU N N 114 126.514 126.514 120.843 5.671 25259 7693 1 10 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.139 -0.125 25259 7694 1 10 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.720 -1.713 25259 7695 1 10 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.555 -1.642 25259 7696 1 10 . 1 1 114 114 GLU H H 114 7.357 7.357 7.730 -0.373 25259 7697 1 10 . 1 1 115 115 LEU N N 115 128.058 128.058 117.900 10.158 25259 7698 1 10 . 1 1 115 115 LEU HA H 115 4.922 4.922 4.995 -0.073 25259 7699 1 10 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.289 -1.965 25259 7700 1 10 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.922 -1.783 25259 7701 1 10 . 1 1 115 115 LEU H H 115 8.930 8.930 8.604 0.326 25259 7702 1 10 . 1 1 116 116 GLN N N 116 126.540 126.540 120.019 6.521 25259 7703 1 10 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.032 0.683 25259 7704 1 10 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.293 -2.593 25259 7705 1 10 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.221 -0.929 25259 7706 1 10 . 1 1 116 116 GLN H H 116 9.221 9.221 8.544 0.677 25259 7707 1 10 . 1 1 117 117 THR N N 117 125.213 125.213 120.277 4.936 25259 7708 1 10 . 1 1 117 117 THR HA H 117 5.353 5.353 5.390 -0.037 25259 7709 1 10 . 1 1 117 117 THR CA C 117 58.926 58.926 60.626 -1.700 25259 7710 1 10 . 1 1 117 117 THR CB C 117 68.948 68.948 72.389 -3.441 25259 7711 1 10 . 1 1 117 117 THR H H 117 9.030 9.030 8.220 0.810 25259 7712 1 10 . 1 1 118 118 THR N N 118 127.799 127.799 118.195 9.604 25259 7713 1 10 . 1 1 118 118 THR HA H 118 5.527 5.527 4.953 0.574 25259 7714 1 10 . 1 1 118 118 THR CA C 118 59.201 59.201 61.873 -2.672 25259 7715 1 10 . 1 1 118 118 THR CB C 118 67.721 67.721 71.501 -3.780 25259 7716 1 10 . 1 1 118 118 THR H H 118 9.459 9.459 8.439 1.020 25259 7717 1 10 . 1 1 119 119 THR N N 119 129.258 129.258 123.688 5.570 25259 7718 1 10 . 1 1 119 119 THR HA H 119 4.885 4.885 4.681 0.204 25259 7719 1 10 . 1 1 119 119 THR CA C 119 58.463 58.463 62.022 -3.558 25259 7720 1 10 . 1 1 119 119 THR CB C 119 67.459 67.459 69.502 -2.043 25259 7721 1 10 . 1 1 119 119 THR H H 119 9.147 9.147 9.001 0.146 25259 7722 1 10 . 1 1 120 120 SER N N 120 123.389 123.389 120.327 3.062 25259 7723 1 10 . 1 1 120 120 SER HA H 120 5.328 5.328 5.179 0.149 25259 7724 1 10 . 1 1 120 120 SER CA C 120 54.386 54.386 56.100 -1.714 25259 7725 1 10 . 1 1 120 120 SER CB C 120 63.031 63.031 65.058 -2.027 25259 7726 1 10 . 1 1 120 120 SER H H 120 8.786 8.786 8.573 0.213 25259 7727 1 10 . 1 1 121 121 PHE N N 121 121.245 121.245 119.934 1.311 25259 7728 1 10 . 1 1 121 121 PHE HA H 121 5.112 5.112 5.232 -0.120 25259 7729 1 10 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.445 -3.253 25259 7730 1 10 . 1 1 121 121 PHE CB C 121 40.265 40.265 43.541 -3.276 25259 7731 1 10 . 1 1 121 121 PHE H H 121 8.831 8.831 9.329 -0.498 25259 7732 1 10 . 1 1 122 122 ASP N N 122 124.765 124.765 121.441 3.324 25259 7733 1 10 . 1 1 122 122 ASP HA H 122 4.840 4.840 5.097 -0.257 25259 7734 1 10 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.012 -3.175 25259 7735 1 10 . 1 1 122 122 ASP CB C 122 38.485 38.485 42.409 -3.924 25259 7736 1 10 . 1 1 122 122 ASP H H 122 8.819 8.819 8.747 0.072 25259 7737 1 10 . 1 1 123 123 PHE N N 123 124.303 124.303 123.068 1.235 25259 7738 1 10 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.371 0.303 25259 7739 1 10 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.100 -2.302 25259 7740 1 10 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.697 -3.156 25259 7741 1 10 . 1 1 123 123 PHE H H 123 8.262 8.262 8.353 -0.091 25259 7742 1 10 . 1 1 124 124 GLN N N 124 120.792 120.792 117.521 3.271 25259 7743 1 10 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.272 0.162 25259 7744 1 10 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.147 -2.064 25259 7745 1 10 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.299 -2.170 25259 7746 1 10 . 1 1 124 124 GLN H H 124 8.954 8.954 8.587 0.367 25259 7747 1 10 . 1 1 125 125 VAL N N 125 114.091 114.091 111.542 2.549 25259 7748 1 10 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.376 0.033 25259 7749 1 10 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.023 -2.725 25259 7750 1 10 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.660 -1.088 25259 7751 1 10 . 1 1 125 125 VAL H H 125 7.026 7.026 7.773 -0.747 25259 7752 1 10 . 1 1 126 126 LEU N N 126 125.158 125.158 123.515 1.643 25259 7753 1 10 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.293 0.182 25259 7754 1 10 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.788 -2.613 25259 7755 1 10 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.970 -0.916 25259 7756 1 10 . 1 1 126 126 LEU H H 126 8.106 8.106 7.870 0.236 25259 7757 1 10 . 1 1 127 127 ASP N N 127 130.026 130.026 128.493 1.533 25259 7758 1 10 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.653 0.188 25259 7759 1 10 . 1 1 127 127 ASP CA C 127 50.198 50.198 54.355 -4.157 25259 7760 1 10 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.123 -1.434 25259 7761 1 10 . 1 1 127 127 ASP H H 127 9.129 9.129 8.670 0.459 25259 7762 1 10 . 1 1 128 128 VAL N N 128 128.833 128.833 122.807 6.026 25259 7763 1 10 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.596 -0.072 25259 7764 1 10 . 1 1 128 128 VAL CA C 128 63.668 63.668 65.922 -2.254 25259 7765 1 10 . 1 1 128 128 VAL CB C 128 29.495 29.495 32.022 -2.527 25259 7766 1 10 . 1 1 128 128 VAL H H 128 8.288 8.288 7.740 0.548 25259 7767 1 10 . 1 1 129 129 LYS N N 129 123.914 123.914 118.573 5.341 25259 7768 1 10 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.210 -0.167 25259 7769 1 10 . 1 1 129 129 LYS CA C 129 56.789 56.789 59.039 -2.250 25259 7770 1 10 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.531 -2.594 25259 7771 1 10 . 1 1 129 129 LYS H H 129 8.226 8.226 8.418 -0.192 25259 7772 1 10 . 1 1 130 130 LYS N N 130 121.888 121.888 118.267 3.621 25259 7773 1 10 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.166 -0.081 25259 7774 1 10 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.807 -1.661 25259 7775 1 10 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.337 -1.997 25259 7776 1 10 . 1 1 130 130 LYS H H 130 7.590 7.590 7.691 -0.101 25259 7777 1 10 . 1 1 131 131 ALA N N 131 123.088 123.088 122.305 0.783 25259 7778 1 10 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.053 -0.126 25259 7779 1 10 . 1 1 131 131 ALA CA C 131 52.402 52.402 54.813 -2.411 25259 7780 1 10 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.241 -1.794 25259 7781 1 10 . 1 1 131 131 ALA H H 131 8.506 8.506 8.265 0.241 25259 7782 1 10 . 1 1 132 132 SER N N 132 110.456 110.456 110.747 -0.291 25259 7783 1 10 . 1 1 132 132 SER HA H 132 4.117 4.117 4.357 -0.240 25259 7784 1 10 . 1 1 132 132 SER CA C 132 58.289 58.289 58.980 -0.691 25259 7785 1 10 . 1 1 132 132 SER CB C 132 61.034 61.034 63.196 -2.162 25259 7786 1 10 . 1 1 132 132 SER H H 132 7.986 7.986 7.561 0.425 25259 7787 1 10 . 1 1 133 133 GLN N N 133 119.034 119.034 117.721 1.313 25259 7788 1 10 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.542 -0.140 25259 7789 1 10 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.870 -2.345 25259 7790 1 10 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.713 -1.479 25259 7791 1 10 . 1 1 133 133 GLN H H 133 7.233 7.233 7.759 -0.526 25259 7792 1 10 . 1 1 134 134 LEU N N 134 123.291 123.291 120.065 3.226 25259 7793 1 10 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.632 -0.239 25259 7794 1 10 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.097 -0.781 25259 7795 1 10 . 1 1 134 134 LEU CB C 134 38.847 38.847 44.946 -6.099 25259 7796 1 10 . 1 1 134 134 LEU H H 134 7.411 7.411 7.416 -0.005 25259 7797 1 10 . 1 1 135 135 GLU N N 135 128.446 128.446 123.284 5.162 25259 7798 1 10 . 1 1 135 135 GLU HA H 135 3.946 3.946 4.152 -0.206 25259 7799 1 10 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.311 -1.927 25259 7800 1 10 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.605 -2.309 25259 7801 1 10 . 1 1 135 135 GLU H H 135 8.986 8.986 9.085 -0.099 25259 7802 1 10 . 1 1 136 136 HIS N N 136 117.593 117.593 118.588 -0.995 25259 7803 1 10 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.389 -0.006 25259 7804 1 10 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.755 -2.070 25259 7805 1 10 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.875 -1.462 25259 7806 1 10 . 1 1 136 136 HIS H H 136 9.226 9.226 8.405 0.821 25259 7807 1 10 . 1 1 137 137 LEU N N 137 115.463 115.463 116.984 -1.521 25259 7808 1 10 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.558 -0.051 25259 7809 1 10 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.601 -2.653 25259 7810 1 10 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.410 -2.603 25259 7811 1 10 . 1 1 137 137 LEU H H 137 7.090 7.090 7.687 -0.597 25259 7812 1 10 . 1 1 138 138 LYS N N 138 124.686 124.686 121.212 3.474 25259 7813 1 10 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.024 0.145 25259 7814 1 10 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.606 -1.448 25259 7815 1 10 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.171 -2.083 25259 7816 1 10 . 1 1 138 138 LYS H H 138 7.698 7.698 7.363 0.335 25259 7817 1 10 . 1 1 139 139 ASN N N 139 118.077 118.077 115.499 2.578 25259 7818 1 10 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.652 0.021 25259 7819 1 10 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.851 -2.069 25259 7820 1 10 . 1 1 139 139 ASN CB C 139 35.817 35.817 39.245 -3.428 25259 7821 1 10 . 1 1 139 139 ASN H H 139 8.485 8.485 8.404 0.081 25259 7822 1 10 . 1 1 140 140 ILE N N 140 120.880 120.880 119.634 1.246 25259 7823 1 10 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.314 -0.284 25259 7824 1 10 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.731 -1.165 25259 7825 1 10 . 1 1 140 140 ILE CB C 140 35.774 35.774 39.600 -3.826 25259 7826 1 10 . 1 1 140 140 ILE H H 140 7.549 7.549 7.677 -0.128 25259 7827 1 10 . 1 1 141 141 GLY N N 141 110.676 110.676 113.248 -2.572 25259 7828 1 10 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.391 0.273 25259 7829 1 10 . 1 1 141 141 GLY H H 141 7.663 7.663 8.572 -0.909 25259 7830 1 10 . 1 1 142 142 LEU N N 142 123.857 123.857 125.014 -1.157 25259 7831 1 10 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.940 -0.247 25259 7832 1 10 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.661 -2.468 25259 7833 1 10 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.667 -1.058 25259 7834 1 10 . 1 1 142 142 LEU H H 142 8.496 8.496 7.550 0.946 25259 7835 1 10 . 1 1 143 143 GLU N N 143 118.407 118.407 118.508 -0.101 25259 7836 1 10 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.957 -0.171 25259 7837 1 10 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.996 -1.774 25259 7838 1 10 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.252 -2.739 25259 7839 1 10 . 1 1 143 143 GLU H H 143 8.672 8.672 7.923 0.749 25259 7840 1 10 . 1 1 144 144 ASN N N 144 118.477 118.477 116.386 2.091 25259 7841 1 10 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.634 -0.192 25259 7842 1 10 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.475 -1.764 25259 7843 1 10 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.567 -2.612 25259 7844 1 10 . 1 1 144 144 ASN H H 144 7.656 7.656 7.823 -0.167 25259 7845 1 10 . 1 1 145 145 LEU N N 145 125.354 125.354 121.278 4.076 25259 7846 1 10 . 1 1 145 145 LEU HA H 145 3.797 3.797 4.009 -0.212 25259 7847 1 10 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.227 -0.904 25259 7848 1 10 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.110 -2.537 25259 7849 1 10 . 1 1 145 145 LEU H H 145 7.758 7.758 7.888 -0.130 25259 7850 1 10 . 1 1 146 146 LEU N N 146 116.372 116.372 118.713 -2.341 25259 7851 1 10 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.965 -0.089 25259 7852 1 10 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.483 -2.240 25259 7853 1 10 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.630 -1.733 25259 7854 1 10 . 1 1 146 146 LEU H H 146 7.242 7.242 7.563 -0.321 25259 7855 1 10 . 1 1 147 147 LYS N N 147 120.054 120.054 118.209 1.845 25259 7856 1 10 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.574 -0.262 25259 7857 1 10 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.432 -0.809 25259 7858 1 10 . 1 1 147 147 LYS CB C 147 30.260 30.260 33.586 -3.326 25259 7859 1 10 . 1 1 147 147 LYS H H 147 7.185 7.185 8.112 -0.927 25259 7860 1 10 . 1 1 148 148 ASN N N 148 119.498 119.498 117.661 1.837 25259 7861 1 10 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.919 0.043 25259 7862 1 10 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.022 -2.248 25259 7863 1 10 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.328 -0.842 25259 7864 1 10 . 1 1 148 148 ASN H H 148 7.698 7.698 7.708 -0.010 25259 7865 1 10 . 1 1 149 149 GLU N N 149 122.834 122.834 118.073 4.761 25259 7866 1 10 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.244 0.357 25259 7867 1 10 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.629 -2.410 25259 7868 1 10 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.164 -2.354 25259 7869 1 10 . 1 1 149 149 GLU H H 149 8.767 8.767 8.665 0.102 25259 7870 1 10 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.144 1.464 25259 7871 1 10 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.385 -1.143 25259 7872 1 10 . 1 1 150 150 PRO CB C 150 28.095 28.095 30.965 -2.870 25259 7873 1 10 . 1 1 151 151 SER N N 151 112.839 112.839 110.900 1.939 25259 7874 1 10 . 1 1 151 151 SER HA H 151 3.835 3.835 4.276 -0.441 25259 7875 1 10 . 1 1 151 151 SER CA C 151 59.270 59.270 57.919 1.351 25259 7876 1 10 . 1 1 151 151 SER CB C 151 59.451 59.451 62.640 -3.189 25259 7877 1 10 . 1 1 151 151 SER H H 151 8.519 8.519 7.943 0.576 25259 7878 1 10 . 1 1 152 152 LYS N N 152 126.710 126.710 122.819 3.891 25259 7879 1 10 . 1 1 152 152 LYS HA H 152 4.248 4.248 3.999 0.249 25259 7880 1 10 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.317 -3.552 25259 7881 1 10 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.457 -2.200 25259 7882 1 10 . 1 1 152 152 LYS H H 152 7.006 7.006 7.462 -0.456 25259 7883 1 10 . 1 1 153 153 TYR N N 153 123.239 123.239 116.693 6.546 25259 7884 1 10 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.490 -0.232 25259 7885 1 10 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.303 1.006 25259 7886 1 10 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.760 -1.426 25259 7887 1 10 . 1 1 153 153 TYR H H 153 8.058 8.058 7.917 0.141 25259 7888 1 10 . 1 1 154 154 ILE N N 154 120.253 120.253 120.893 -0.640 25259 7889 1 10 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.205 0.168 25259 7890 1 10 . 1 1 154 154 ILE CA C 154 63.114 63.114 64.737 -1.623 25259 7891 1 10 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.061 -1.113 25259 7892 1 10 . 1 1 154 154 ILE H H 154 8.193 8.193 7.667 0.526 25259 7893 1 10 . 1 1 155 155 SER N N 155 117.178 117.178 114.488 2.690 25259 7894 1 10 . 1 1 155 155 SER HA H 155 4.091 4.091 4.071 0.020 25259 7895 1 10 . 1 1 155 155 SER CA C 155 59.961 59.961 61.385 -1.424 25259 7896 1 10 . 1 1 155 155 SER CB C 155 60.148 60.148 62.858 -2.710 25259 7897 1 10 . 1 1 155 155 SER H H 155 8.020 8.020 7.817 0.203 25259 7898 1 10 . 1 1 156 156 ASP N N 156 125.479 125.479 121.850 3.629 25259 7899 1 10 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.380 0.047 25259 7900 1 10 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.794 -2.034 25259 7901 1 10 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.859 -2.986 25259 7902 1 10 . 1 1 156 156 ASP H H 156 8.638 8.638 7.692 0.946 25259 7903 1 10 . 1 1 157 157 ARG N N 157 121.542 121.542 118.876 2.666 25259 7904 1 10 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.987 0.124 25259 7905 1 10 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.969 -3.041 25259 7906 1 10 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.690 -1.874 25259 7907 1 10 . 1 1 157 157 ARG H H 157 7.888 7.888 7.613 0.275 25259 7908 1 10 . 1 1 158 158 LEU N N 158 124.257 124.257 118.878 5.379 25259 7909 1 10 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.342 -0.071 25259 7910 1 10 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.553 -2.340 25259 7911 1 10 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.681 -2.736 25259 7912 1 10 . 1 1 158 158 LEU H H 158 8.442 8.442 7.581 0.861 25259 7913 1 10 . 1 1 159 159 ALA N N 159 124.146 124.146 121.098 3.048 25259 7914 1 10 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.033 0.299 25259 7915 1 10 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.571 -3.139 25259 7916 1 10 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.288 -2.381 25259 7917 1 10 . 1 1 159 159 ALA H H 159 8.086 8.086 7.426 0.660 25259 7918 1 10 . 1 1 160 160 ASN N N 160 118.093 118.093 115.419 2.674 25259 7919 1 10 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.595 0.397 25259 7920 1 10 . 1 1 160 160 ASN CA C 160 50.577 50.577 54.219 -3.642 25259 7921 1 10 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.495 -1.762 25259 7922 1 10 . 1 1 160 160 ASN H H 160 7.445 7.445 7.966 -0.521 25259 7923 1 10 . 1 1 161 161 GLY N N 161 108.365 108.365 105.194 3.171 25259 7924 1 10 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.593 -0.947 25259 7925 1 10 . 1 1 161 161 GLY H H 161 7.743 7.743 7.270 0.473 25259 7926 1 10 . 1 1 162 162 ALA N N 162 123.928 123.928 123.021 0.907 25259 7927 1 10 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.817 0.056 25259 7928 1 10 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.834 -2.308 25259 7929 1 10 . 1 1 162 162 ALA CB C 162 18.060 18.060 20.183 -2.123 25259 7930 1 10 . 1 1 162 162 ALA H H 162 8.035 8.035 7.741 0.294 25259 7931 1 10 . 1 1 163 163 THR N N 163 113.286 113.286 112.969 0.317 25259 7932 1 10 . 1 1 163 163 THR HA H 163 4.703 4.703 4.660 0.043 25259 7933 1 10 . 1 1 163 163 THR CA C 163 57.791 57.791 61.013 -3.222 25259 7934 1 10 . 1 1 163 163 THR CB C 163 68.974 68.974 71.285 -2.311 25259 7935 1 10 . 1 1 163 163 THR H H 163 8.451 8.451 8.297 0.154 25259 7936 1 10 . 1 1 164 164 GLU N N 164 125.905 125.905 119.577 6.328 25259 7937 1 10 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.916 0.144 25259 7938 1 10 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.307 -0.722 25259 7939 1 10 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.880 -3.669 25259 7940 1 10 . 1 1 164 164 GLU H H 164 8.716 8.716 8.395 0.321 25259 7941 1 11 . 1 1 2 2 PRO HA H 2 4.675 4.675 4.631 0.044 25259 7942 1 11 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.950 -2.142 25259 7943 1 11 . 1 1 2 2 PRO CB C 2 30.070 30.070 32.698 -2.628 25259 7944 1 11 . 1 1 3 3 ALA N N 3 126.741 126.741 124.070 2.671 25259 7945 1 11 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.642 -0.148 25259 7946 1 11 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.998 -1.796 25259 7947 1 11 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.722 -3.904 25259 7948 1 11 . 1 1 3 3 ALA H H 3 8.440 8.440 8.356 0.084 25259 7949 1 11 . 1 1 4 4 THR N N 4 116.015 116.015 114.198 1.817 25259 7950 1 11 . 1 1 4 4 THR HA H 4 4.393 4.393 4.700 -0.307 25259 7951 1 11 . 1 1 4 4 THR CA C 4 59.148 59.148 61.654 -2.506 25259 7952 1 11 . 1 1 4 4 THR CB C 4 67.580 67.580 69.656 -2.076 25259 7953 1 11 . 1 1 4 4 THR H H 4 8.050 8.050 8.370 -0.320 25259 7954 1 11 . 1 1 5 5 LYS N N 5 126.350 126.350 122.523 3.827 25259 7955 1 11 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.630 -0.125 25259 7956 1 11 . 1 1 5 5 LYS CA C 5 53.917 53.917 56.488 -2.571 25259 7957 1 11 . 1 1 5 5 LYS CB C 5 30.684 30.684 32.983 -2.299 25259 7958 1 11 . 1 1 5 5 LYS H H 5 8.332 8.332 8.345 -0.013 25259 7959 1 11 . 1 1 6 6 THR N N 6 118.124 118.124 115.529 2.595 25259 7960 1 11 . 1 1 6 6 THR HA H 6 4.440 4.440 4.256 0.184 25259 7961 1 11 . 1 1 6 6 THR CA C 6 59.282 59.282 62.552 -3.270 25259 7962 1 11 . 1 1 6 6 THR CB C 6 67.685 67.685 68.014 -0.329 25259 7963 1 11 . 1 1 6 6 THR H H 6 8.283 8.283 8.274 0.009 25259 7964 1 11 . 1 1 7 7 GLU N N 7 125.934 125.934 125.572 0.362 25259 7965 1 11 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.537 -0.193 25259 7966 1 11 . 1 1 7 7 GLU CA C 7 54.181 54.181 56.416 -2.235 25259 7967 1 11 . 1 1 7 7 GLU CB C 7 27.816 27.816 31.683 -3.867 25259 7968 1 11 . 1 1 7 7 GLU H H 7 8.487 8.487 8.307 0.180 25259 7969 1 11 . 1 1 8 8 LYS N N 8 123.945 123.945 122.579 1.366 25259 7970 1 11 . 1 1 8 8 LYS CA C 8 53.935 53.935 56.323 -2.388 25259 7971 1 11 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.781 -3.216 25259 7972 1 11 . 1 1 8 8 LYS H H 8 8.278 8.278 8.380 -0.102 25259 7973 1 11 . 1 1 9 9 ASP N N 9 123.624 123.624 121.620 2.004 25259 7974 1 11 . 1 1 9 9 ASP HA H 9 4.339 4.339 5.142 -0.803 25259 7975 1 11 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.892 -1.769 25259 7976 1 11 . 1 1 9 9 ASP CB C 9 38.933 38.933 43.570 -4.637 25259 7977 1 11 . 1 1 9 9 ASP H H 9 8.277 8.277 8.720 -0.443 25259 7978 1 11 . 1 1 10 10 THR N N 10 116.812 116.812 116.762 0.050 25259 7979 1 11 . 1 1 10 10 THR HA H 10 4.349 4.349 4.423 -0.074 25259 7980 1 11 . 1 1 10 10 THR CA C 10 59.634 59.634 62.779 -3.145 25259 7981 1 11 . 1 1 10 10 THR CB C 10 67.254 67.254 69.209 -1.955 25259 7982 1 11 . 1 1 10 10 THR H H 10 8.049 8.049 8.330 -0.281 25259 7983 1 11 . 1 1 11 11 LEU N N 11 126.610 126.610 123.835 2.775 25259 7984 1 11 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.847 -0.455 25259 7985 1 11 . 1 1 11 11 LEU CA C 11 53.078 53.078 55.785 -2.707 25259 7986 1 11 . 1 1 11 11 LEU CB C 11 39.633 39.633 43.016 -3.383 25259 7987 1 11 . 1 1 11 11 LEU H H 11 8.191 8.191 8.525 -0.334 25259 7988 1 11 . 1 1 12 12 GLN N N 12 123.274 123.274 123.804 -0.530 25259 7989 1 11 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.634 -0.252 25259 7990 1 11 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.859 -2.285 25259 7991 1 11 . 1 1 12 12 GLN CB C 12 26.803 26.803 30.395 -3.592 25259 7992 1 11 . 1 1 12 12 GLN H H 12 8.280 8.280 8.395 -0.115 25259 7993 1 11 . 1 1 13 13 SER N N 13 119.027 119.027 118.034 0.993 25259 7994 1 11 . 1 1 13 13 SER HA H 13 4.471 4.471 4.876 -0.405 25259 7995 1 11 . 1 1 13 13 SER CA C 13 55.869 55.869 58.878 -3.009 25259 7996 1 11 . 1 1 13 13 SER CB C 13 61.424 61.424 63.304 -1.880 25259 7997 1 11 . 1 1 13 13 SER H H 13 8.178 8.178 8.492 -0.314 25259 7998 1 11 . 1 1 14 14 ALA N N 14 128.314 128.314 127.101 1.213 25259 7999 1 11 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.872 -0.438 25259 8000 1 11 . 1 1 14 14 ALA CA C 14 49.696 49.696 52.092 -2.396 25259 8001 1 11 . 1 1 14 14 ALA CB C 14 17.081 17.081 20.969 -3.888 25259 8002 1 11 . 1 1 14 14 ALA H H 14 8.195 8.195 8.400 -0.205 25259 8003 1 11 . 1 1 15 15 LEU N N 15 125.175 125.175 121.794 3.381 25259 8004 1 11 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.919 -0.279 25259 8005 1 11 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.463 -2.859 25259 8006 1 11 . 1 1 15 15 LEU CB C 15 39.467 39.467 44.093 -4.626 25259 8007 1 11 . 1 1 15 15 LEU H H 15 8.050 8.050 8.761 -0.711 25259 8008 1 11 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.802 -0.298 25259 8009 1 11 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.915 -2.284 25259 8010 1 11 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.878 -3.220 25259 8011 1 11 . 1 1 17 17 VAL N N 17 123.223 123.223 120.643 2.580 25259 8012 1 11 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.499 -0.365 25259 8013 1 11 . 1 1 17 17 VAL CA C 17 59.827 59.827 62.014 -2.187 25259 8014 1 11 . 1 1 17 17 VAL CB C 17 30.377 30.377 34.058 -3.681 25259 8015 1 11 . 1 1 17 17 VAL H H 17 8.134 8.134 8.548 -0.414 25259 8016 1 11 . 1 1 18 18 ILE N N 18 127.777 127.777 121.889 5.888 25259 8017 1 11 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.983 -0.740 25259 8018 1 11 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.467 -2.145 25259 8019 1 11 . 1 1 18 18 ILE CB C 18 36.254 36.254 41.248 -4.994 25259 8020 1 11 . 1 1 18 18 ILE H H 18 8.187 8.187 8.494 -0.307 25259 8021 1 11 . 1 1 19 19 GLU N N 19 128.148 128.148 122.195 5.953 25259 8022 1 11 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.778 -0.441 25259 8023 1 11 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.766 -1.675 25259 8024 1 11 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.424 -4.248 25259 8025 1 11 . 1 1 19 19 GLU H H 19 8.475 8.475 9.115 -0.640 25259 8026 1 11 . 1 1 20 20 ASN N N 20 122.788 122.788 120.814 1.974 25259 8027 1 11 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.007 -0.312 25259 8028 1 11 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.849 -2.027 25259 8029 1 11 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.226 -3.860 25259 8030 1 11 . 1 1 20 20 ASN H H 20 8.477 8.477 8.434 0.043 25259 8031 1 11 . 1 1 21 21 ALA N N 21 127.253 127.253 125.151 2.102 25259 8032 1 11 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.549 -0.228 25259 8033 1 11 . 1 1 21 21 ALA CA C 21 50.688 50.688 52.363 -1.675 25259 8034 1 11 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.467 -3.554 25259 8035 1 11 . 1 1 21 21 ALA H H 21 8.325 8.325 8.427 -0.102 25259 8036 1 11 . 1 1 22 22 GLU N N 22 122.044 122.044 122.774 -0.730 25259 8037 1 11 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.447 -0.154 25259 8038 1 11 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.616 -2.033 25259 8039 1 11 . 1 1 22 22 GLU CB C 22 27.285 27.285 30.259 -2.974 25259 8040 1 11 . 1 1 22 22 GLU H H 22 8.415 8.415 8.518 -0.103 25259 8041 1 11 . 1 1 23 23 LYS N N 23 123.622 123.622 121.479 2.143 25259 8042 1 11 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.574 -0.249 25259 8043 1 11 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.833 -1.337 25259 8044 1 11 . 1 1 23 23 LYS CB C 23 30.653 30.653 34.335 -3.682 25259 8045 1 11 . 1 1 23 23 LYS H H 23 8.127 8.127 8.393 -0.266 25259 8046 1 11 . 1 1 24 24 ASN N N 24 120.652 120.652 121.983 -1.331 25259 8047 1 11 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.699 0.142 25259 8048 1 11 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.999 -3.336 25259 8049 1 11 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.139 -2.364 25259 8050 1 11 . 1 1 24 24 ASN H H 24 8.424 8.424 8.613 -0.189 25259 8051 1 11 . 1 1 25 25 THR N N 25 117.102 117.102 114.251 2.851 25259 8052 1 11 . 1 1 25 25 THR HA H 25 4.367 4.367 4.546 -0.179 25259 8053 1 11 . 1 1 25 25 THR CA C 25 59.500 59.500 61.841 -2.341 25259 8054 1 11 . 1 1 25 25 THR CB C 25 67.610 67.610 70.833 -3.223 25259 8055 1 11 . 1 1 25 25 THR H H 25 7.852 7.852 8.611 -0.759 25259 8056 1 11 . 1 1 26 26 VAL N N 26 126.491 126.491 125.770 0.721 25259 8057 1 11 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.700 -0.533 25259 8058 1 11 . 1 1 26 26 VAL CA C 26 60.193 60.193 60.028 0.165 25259 8059 1 11 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.250 -4.645 25259 8060 1 11 . 1 1 26 26 VAL H H 26 8.080 8.080 8.219 -0.139 25259 8061 1 11 . 1 1 27 27 VAL N N 27 132.992 132.992 125.685 7.307 25259 8062 1 11 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.582 -0.501 25259 8063 1 11 . 1 1 27 27 VAL CA C 27 58.984 58.984 59.581 -0.597 25259 8064 1 11 . 1 1 27 27 VAL CB C 27 31.540 31.540 33.896 -2.356 25259 8065 1 11 . 1 1 27 27 VAL H H 27 8.830 8.830 8.806 0.024 25259 8066 1 11 . 1 1 28 28 THR N N 28 123.576 123.576 116.431 7.145 25259 8067 1 11 . 1 1 28 28 THR HA H 28 5.553 5.553 4.750 0.803 25259 8068 1 11 . 1 1 28 28 THR CA C 28 58.738 58.738 61.205 -2.467 25259 8069 1 11 . 1 1 28 28 THR CB C 28 68.443 68.443 70.025 -1.582 25259 8070 1 11 . 1 1 28 28 THR H H 28 8.165 8.165 8.057 0.108 25259 8071 1 11 . 1 1 29 29 LYS N N 29 129.099 129.099 126.847 2.252 25259 8072 1 11 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.613 0.329 25259 8073 1 11 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.257 -3.478 25259 8074 1 11 . 1 1 29 29 LYS CB C 29 35.096 35.096 35.191 -0.095 25259 8075 1 11 . 1 1 29 29 LYS H H 29 9.273 9.273 8.803 0.470 25259 8076 1 11 . 1 1 30 30 THR N N 30 123.510 123.510 118.080 5.430 25259 8077 1 11 . 1 1 30 30 THR HA H 30 5.428 5.428 4.642 0.786 25259 8078 1 11 . 1 1 30 30 THR CA C 30 59.784 59.784 62.099 -2.315 25259 8079 1 11 . 1 1 30 30 THR CB C 30 67.818 67.818 69.433 -1.615 25259 8080 1 11 . 1 1 30 30 THR H H 30 8.993 8.993 8.432 0.561 25259 8081 1 11 . 1 1 31 31 LEU N N 31 128.293 128.293 129.141 -0.848 25259 8082 1 11 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.653 0.567 25259 8083 1 11 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.994 -3.939 25259 8084 1 11 . 1 1 31 31 LEU CB C 31 43.399 43.399 42.278 1.121 25259 8085 1 11 . 1 1 31 31 LEU H H 31 9.557 9.557 9.097 0.460 25259 8086 1 11 . 1 1 32 32 VAL N N 32 126.919 126.919 126.472 0.447 25259 8087 1 11 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.031 0.420 25259 8088 1 11 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.977 -2.313 25259 8089 1 11 . 1 1 32 32 VAL CB C 32 29.449 29.449 29.503 -0.054 25259 8090 1 11 . 1 1 32 32 VAL H H 32 9.364 9.364 8.428 0.936 25259 8091 1 11 . 1 1 33 33 LEU N N 33 133.503 133.503 129.110 4.393 25259 8092 1 11 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.430 0.126 25259 8093 1 11 . 1 1 33 33 LEU CA C 33 52.004 52.004 54.074 -2.070 25259 8094 1 11 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.247 -4.400 25259 8095 1 11 . 1 1 33 33 LEU H H 33 8.587 8.587 7.718 0.869 25259 8096 1 11 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.476 0.005 25259 8097 1 11 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.172 -1.726 25259 8098 1 11 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.139 -2.574 25259 8099 1 11 . 1 1 35 35 LYS N N 35 127.420 127.420 117.735 9.685 25259 8100 1 11 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.566 -0.200 25259 8101 1 11 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.075 -0.956 25259 8102 1 11 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.561 -1.967 25259 8103 1 11 . 1 1 35 35 LYS H H 35 8.666 8.666 8.287 0.379 25259 8104 1 11 . 1 1 36 36 SER N N 36 122.222 122.222 116.237 5.985 25259 8105 1 11 . 1 1 36 36 SER HA H 36 4.753 4.753 4.504 0.249 25259 8106 1 11 . 1 1 36 36 SER CA C 36 55.328 55.328 58.607 -3.279 25259 8107 1 11 . 1 1 36 36 SER CB C 36 61.728 61.728 64.416 -2.688 25259 8108 1 11 . 1 1 36 36 SER H H 36 8.771 8.771 8.596 0.175 25259 8109 1 11 . 1 1 37 37 ASP N N 37 126.346 126.346 120.593 5.753 25259 8110 1 11 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.478 -0.024 25259 8111 1 11 . 1 1 37 37 ASP CA C 37 54.616 54.616 55.920 -1.304 25259 8112 1 11 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.833 -2.848 25259 8113 1 11 . 1 1 37 37 ASP H H 37 8.859 8.859 8.793 0.066 25259 8114 1 11 . 1 1 38 38 ASP N N 38 119.171 119.171 117.415 1.756 25259 8115 1 11 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.736 -0.121 25259 8116 1 11 . 1 1 38 38 ASP CA C 38 50.788 50.788 53.764 -2.976 25259 8117 1 11 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.397 -3.762 25259 8118 1 11 . 1 1 38 38 ASP H H 38 7.944 7.944 7.930 0.014 25259 8119 1 11 . 1 1 39 39 GLY N N 39 110.352 110.352 109.770 0.582 25259 8120 1 11 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.473 -2.712 25259 8121 1 11 . 1 1 39 39 GLY H H 39 8.145 8.145 8.031 0.114 25259 8122 1 11 . 1 1 40 40 SER N N 40 120.090 120.090 115.484 4.606 25259 8123 1 11 . 1 1 40 40 SER HA H 40 4.877 4.877 4.958 -0.081 25259 8124 1 11 . 1 1 40 40 SER CA C 40 56.525 56.525 57.558 -1.033 25259 8125 1 11 . 1 1 40 40 SER CB C 40 62.245 62.245 65.635 -3.390 25259 8126 1 11 . 1 1 40 40 SER H H 40 8.344 8.344 7.513 0.831 25259 8127 1 11 . 1 1 41 41 GLN N N 41 122.551 122.551 120.084 2.467 25259 8128 1 11 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.789 0.138 25259 8129 1 11 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.209 -1.796 25259 8130 1 11 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.143 -2.829 25259 8131 1 11 . 1 1 41 41 GLN H H 41 8.627 8.627 8.908 -0.281 25259 8132 1 11 . 1 1 42 42 GLN N N 42 131.724 131.724 119.157 12.567 25259 8133 1 11 . 1 1 42 42 GLN HA H 42 5.611 5.611 5.306 0.305 25259 8134 1 11 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.148 -2.076 25259 8135 1 11 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.412 -2.093 25259 8136 1 11 . 1 1 42 42 GLN H H 42 9.189 9.189 8.434 0.754 25259 8137 1 11 . 1 1 43 43 THR N N 43 122.202 122.202 114.999 7.203 25259 8138 1 11 . 1 1 43 43 THR HA H 43 5.380 5.380 5.033 0.347 25259 8139 1 11 . 1 1 43 43 THR CA C 43 58.863 58.863 60.947 -2.084 25259 8140 1 11 . 1 1 43 43 THR CB C 43 68.893 68.893 71.599 -2.706 25259 8141 1 11 . 1 1 43 43 THR H H 43 9.139 9.139 8.542 0.597 25259 8142 1 11 . 1 1 44 44 GLN N N 44 127.190 127.190 123.162 4.028 25259 8143 1 11 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.175 0.459 25259 8144 1 11 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.687 -3.019 25259 8145 1 11 . 1 1 44 44 GLN CB C 44 28.910 28.910 31.533 -2.623 25259 8146 1 11 . 1 1 44 44 GLN H H 44 9.760 9.760 8.904 0.856 25259 8147 1 11 . 1 1 45 45 THR N N 45 123.479 123.479 121.935 1.544 25259 8148 1 11 . 1 1 45 45 THR HA H 45 5.421 5.421 4.761 0.660 25259 8149 1 11 . 1 1 45 45 THR CA C 45 60.071 60.071 63.895 -3.824 25259 8150 1 11 . 1 1 45 45 THR CB C 45 67.541 67.541 69.703 -2.162 25259 8151 1 11 . 1 1 45 45 THR H H 45 9.518 9.518 9.122 0.396 25259 8152 1 11 . 1 1 46 46 ILE N N 46 133.908 133.908 127.517 6.391 25259 8153 1 11 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.755 0.248 25259 8154 1 11 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.472 -2.001 25259 8155 1 11 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.627 0.318 25259 8156 1 11 . 1 1 46 46 ILE H H 46 9.830 9.830 8.988 0.842 25259 8157 1 11 . 1 1 47 47 THR N N 47 124.701 124.701 124.725 -0.024 25259 8158 1 11 . 1 1 47 47 THR HA H 47 6.048 6.048 4.970 1.078 25259 8159 1 11 . 1 1 47 47 THR CA C 47 58.551 58.551 62.271 -3.720 25259 8160 1 11 . 1 1 47 47 THR CB C 47 67.819 67.819 68.961 -1.142 25259 8161 1 11 . 1 1 47 47 THR H H 47 8.843 8.843 8.542 0.301 25259 8162 1 11 . 1 1 48 48 TYR N N 48 127.369 127.369 122.152 5.217 25259 8163 1 11 . 1 1 48 48 TYR HA H 48 5.278 5.278 4.916 0.362 25259 8164 1 11 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.692 -2.963 25259 8165 1 11 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.178 -1.746 25259 8166 1 11 . 1 1 48 48 TYR H H 48 9.638 9.638 8.207 1.431 25259 8167 1 11 . 1 1 49 49 LYS N N 49 122.138 122.138 117.963 4.175 25259 8168 1 11 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.693 -0.037 25259 8169 1 11 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.979 -3.007 25259 8170 1 11 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.815 -1.212 25259 8171 1 11 . 1 1 49 49 LYS H H 49 8.560 8.560 8.880 -0.320 25259 8172 1 11 . 1 1 50 50 ASP N N 50 130.208 130.208 120.189 10.019 25259 8173 1 11 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.808 -0.504 25259 8174 1 11 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.996 -0.236 25259 8175 1 11 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.850 -5.511 25259 8176 1 11 . 1 1 50 50 ASP H H 50 9.597 9.597 8.481 1.116 25259 8177 1 11 . 1 1 51 51 LYS N N 51 124.586 124.586 119.644 4.942 25259 8178 1 11 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.503 0.028 25259 8179 1 11 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.298 -2.564 25259 8180 1 11 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.866 -4.471 25259 8181 1 11 . 1 1 51 51 LYS H H 51 8.450 8.450 8.241 0.209 25259 8182 1 11 . 1 1 52 52 THR N N 52 120.044 120.044 113.728 6.316 25259 8183 1 11 . 1 1 52 52 THR HA H 52 4.717 4.717 4.518 0.199 25259 8184 1 11 . 1 1 52 52 THR CA C 52 59.313 59.313 60.365 -1.052 25259 8185 1 11 . 1 1 52 52 THR CB C 52 68.815 68.815 70.218 -1.403 25259 8186 1 11 . 1 1 52 52 THR H H 52 8.658 8.658 7.680 0.978 25259 8187 1 11 . 1 1 53 53 PHE N N 53 128.987 128.987 122.505 6.482 25259 8188 1 11 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.680 -0.397 25259 8189 1 11 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.636 -0.647 25259 8190 1 11 . 1 1 53 53 PHE CB C 53 38.311 38.311 38.376 -0.065 25259 8191 1 11 . 1 1 53 53 PHE H H 53 9.218 9.218 8.740 0.478 25259 8192 1 11 . 1 1 54 54 LEU N N 54 124.874 124.874 125.369 -0.495 25259 8193 1 11 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.435 0.494 25259 8194 1 11 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.364 -3.123 25259 8195 1 11 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.737 -2.220 25259 8196 1 11 . 1 1 54 54 LEU H H 54 9.391 9.391 8.362 1.029 25259 8197 1 11 . 1 1 55 55 SER N N 55 115.516 115.516 110.496 5.020 25259 8198 1 11 . 1 1 55 55 SER HA H 55 5.194 5.194 4.777 0.417 25259 8199 1 11 . 1 1 55 55 SER CA C 55 55.818 55.818 57.795 -1.977 25259 8200 1 11 . 1 1 55 55 SER CB C 55 63.474 63.474 66.276 -2.802 25259 8201 1 11 . 1 1 55 55 SER H H 55 8.736 8.736 7.619 1.117 25259 8202 1 11 . 1 1 56 56 LEU N N 56 124.352 124.352 126.929 -2.577 25259 8203 1 11 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.215 0.328 25259 8204 1 11 . 1 1 56 56 LEU CA C 56 51.637 51.637 53.462 -1.825 25259 8205 1 11 . 1 1 56 56 LEU CB C 56 45.513 45.513 44.795 0.718 25259 8206 1 11 . 1 1 56 56 LEU H H 56 8.328 8.328 8.467 -0.139 25259 8207 1 11 . 1 1 57 57 ALA N N 57 131.450 131.450 130.495 0.955 25259 8208 1 11 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.066 0.439 25259 8209 1 11 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.178 -1.976 25259 8210 1 11 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.017 -2.053 25259 8211 1 11 . 1 1 57 57 ALA H H 57 9.208 9.208 8.323 0.885 25259 8212 1 11 . 1 1 58 58 ILE N N 58 126.248 126.248 124.730 1.518 25259 8213 1 11 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.758 0.026 25259 8214 1 11 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.160 -1.913 25259 8215 1 11 . 1 1 58 58 ILE CB C 58 38.045 38.045 39.921 -1.876 25259 8216 1 11 . 1 1 58 58 ILE H H 58 9.597 9.597 9.097 0.500 25259 8217 1 11 . 1 1 59 59 GLN N N 59 132.065 132.065 127.178 4.887 25259 8218 1 11 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.563 0.684 25259 8219 1 11 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.030 -2.866 25259 8220 1 11 . 1 1 59 59 GLN CB C 59 29.661 29.661 29.340 0.321 25259 8221 1 11 . 1 1 59 59 GLN H H 59 9.389 9.389 8.857 0.532 25259 8222 1 11 . 1 1 60 60 GLN N N 60 130.314 130.314 125.560 4.754 25259 8223 1 11 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.964 0.245 25259 8224 1 11 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.480 -2.459 25259 8225 1 11 . 1 1 60 60 GLN CB C 60 29.476 29.476 32.237 -2.761 25259 8226 1 11 . 1 1 60 60 GLN H H 60 9.471 9.471 9.201 0.270 25259 8227 1 11 . 1 1 61 61 LYS N N 61 131.044 131.044 122.764 8.280 25259 8228 1 11 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.177 0.238 25259 8229 1 11 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.784 -2.664 25259 8230 1 11 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.711 -4.294 25259 8231 1 11 . 1 1 61 61 LYS H H 61 8.893 8.893 8.987 -0.094 25259 8232 1 11 . 1 1 62 62 ARG N N 62 125.397 125.397 119.695 5.702 25259 8233 1 11 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.111 -0.108 25259 8234 1 11 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.538 -2.447 25259 8235 1 11 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.488 -1.610 25259 8236 1 11 . 1 1 62 62 ARG H H 62 9.120 9.120 8.695 0.425 25259 8237 1 11 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.646 0.329 25259 8238 1 11 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.874 -3.377 25259 8239 1 11 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.294 -2.410 25259 8240 1 11 . 1 1 64 64 VAL N N 64 121.305 121.305 116.920 4.385 25259 8241 1 11 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.220 -0.196 25259 8242 1 11 . 1 1 64 64 VAL CA C 64 59.677 59.677 61.798 -2.121 25259 8243 1 11 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.219 -1.854 25259 8244 1 11 . 1 1 64 64 VAL H H 64 7.520 7.520 7.994 -0.474 25259 8245 1 11 . 1 1 65 65 SER N N 65 123.215 123.215 114.092 9.123 25259 8246 1 11 . 1 1 65 65 SER HA H 65 4.521 4.521 4.698 -0.177 25259 8247 1 11 . 1 1 65 65 SER CA C 65 54.897 54.897 57.217 -2.320 25259 8248 1 11 . 1 1 65 65 SER CB C 65 62.564 62.564 65.965 -3.401 25259 8249 1 11 . 1 1 65 65 SER H H 65 8.080 8.080 8.067 0.013 25259 8250 1 11 . 1 1 66 66 ASP N N 66 123.802 123.802 122.922 0.880 25259 8251 1 11 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.474 -0.045 25259 8252 1 11 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.787 -1.409 25259 8253 1 11 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.882 -2.844 25259 8254 1 11 . 1 1 66 66 ASP H H 66 8.900 8.900 8.839 0.061 25259 8255 1 11 . 1 1 67 67 GLU N N 67 121.943 121.943 119.591 2.352 25259 8256 1 11 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.044 0.145 25259 8257 1 11 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.321 -1.881 25259 8258 1 11 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.480 -2.695 25259 8259 1 11 . 1 1 67 67 GLU H H 67 8.717 8.717 8.618 0.099 25259 8260 1 11 . 1 1 68 68 LEU N N 68 125.458 125.458 119.631 5.827 25259 8261 1 11 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.189 0.154 25259 8262 1 11 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.923 -2.451 25259 8263 1 11 . 1 1 68 68 LEU CB C 68 39.404 39.404 42.150 -2.746 25259 8264 1 11 . 1 1 68 68 LEU H H 68 7.820 7.820 7.902 -0.082 25259 8265 1 11 . 1 1 69 69 LYS N N 69 123.868 123.868 119.217 4.651 25259 8266 1 11 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.057 -0.051 25259 8267 1 11 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.807 -2.190 25259 8268 1 11 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.196 -2.159 25259 8269 1 11 . 1 1 69 69 LYS H H 69 8.690 8.690 7.701 0.989 25259 8270 1 11 . 1 1 70 70 THR N N 70 117.109 117.109 117.023 0.086 25259 8271 1 11 . 1 1 70 70 THR HA H 70 4.088 4.088 4.010 0.078 25259 8272 1 11 . 1 1 70 70 THR CA C 70 63.879 63.879 67.253 -3.374 25259 8273 1 11 . 1 1 70 70 THR CB C 70 66.383 66.383 68.671 -2.288 25259 8274 1 11 . 1 1 70 70 THR H H 70 7.935 7.935 7.730 0.205 25259 8275 1 11 . 1 1 71 71 TYR N N 71 127.006 127.006 122.470 4.536 25259 8276 1 11 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.156 0.049 25259 8277 1 11 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.715 -1.490 25259 8278 1 11 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.255 -1.710 25259 8279 1 11 . 1 1 71 71 TYR H H 71 7.683 7.683 7.581 0.102 25259 8280 1 11 . 1 1 72 72 ILE N N 72 125.064 125.064 119.324 5.740 25259 8281 1 11 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.668 0.011 25259 8282 1 11 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.191 -2.296 25259 8283 1 11 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.931 -1.655 25259 8284 1 11 . 1 1 72 72 ILE H H 72 9.083 9.083 8.363 0.720 25259 8285 1 11 . 1 1 73 73 ASP N N 73 124.900 124.900 118.642 6.258 25259 8286 1 11 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.418 -0.029 25259 8287 1 11 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.763 -1.725 25259 8288 1 11 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.966 -2.859 25259 8289 1 11 . 1 1 73 73 ASP H H 73 8.751 8.751 7.889 0.862 25259 8290 1 11 . 1 1 74 74 GLN N N 74 117.025 117.025 117.192 -0.167 25259 8291 1 11 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.034 0.104 25259 8292 1 11 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.943 -3.133 25259 8293 1 11 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.083 -1.519 25259 8294 1 11 . 1 1 74 74 GLN H H 74 7.447 7.447 7.911 -0.464 25259 8295 1 11 . 1 1 75 75 HIS N N 75 116.494 116.494 114.455 2.039 25259 8296 1 11 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.582 0.134 25259 8297 1 11 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.116 -2.050 25259 8298 1 11 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.154 -4.852 25259 8299 1 11 . 1 1 75 75 HIS H H 75 8.402 8.402 7.770 0.632 25259 8300 1 11 . 1 1 76 76 GLY N N 76 112.564 112.564 105.197 7.367 25259 8301 1 11 . 1 1 76 76 GLY CA C 76 41.896 41.896 45.067 -3.171 25259 8302 1 11 . 1 1 76 76 GLY H H 76 9.091 9.091 7.932 1.159 25259 8303 1 11 . 1 1 77 77 VAL N N 77 124.763 124.763 121.854 2.909 25259 8304 1 11 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.730 -0.165 25259 8305 1 11 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.095 -0.144 25259 8306 1 11 . 1 1 77 77 VAL CB C 77 29.838 29.838 31.714 -1.876 25259 8307 1 11 . 1 1 77 77 VAL H H 77 8.927 8.927 8.666 0.261 25259 8308 1 11 . 1 1 78 78 GLU N N 78 124.388 124.388 117.879 6.509 25259 8309 1 11 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.012 0.136 25259 8310 1 11 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.849 -1.533 25259 8311 1 11 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.229 -2.770 25259 8312 1 11 . 1 1 78 78 GLU H H 78 8.781 8.781 8.547 0.234 25259 8313 1 11 . 1 1 79 79 GLU N N 79 121.887 121.887 119.333 2.554 25259 8314 1 11 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.108 0.080 25259 8315 1 11 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.606 -3.061 25259 8316 1 11 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.295 -2.262 25259 8317 1 11 . 1 1 79 79 GLU H H 79 9.231 9.231 8.571 0.660 25259 8318 1 11 . 1 1 80 80 THR N N 80 120.781 120.781 116.518 4.263 25259 8319 1 11 . 1 1 80 80 THR HA H 80 4.059 4.059 4.060 -0.001 25259 8320 1 11 . 1 1 80 80 THR CA C 80 65.487 65.487 66.952 -1.465 25259 8321 1 11 . 1 1 80 80 THR CB C 80 64.369 64.369 68.553 -4.184 25259 8322 1 11 . 1 1 80 80 THR H H 80 7.858 7.858 8.441 -0.583 25259 8323 1 11 . 1 1 81 81 GLN N N 81 125.303 125.303 120.174 5.129 25259 8324 1 11 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.871 0.173 25259 8325 1 11 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.438 -2.469 25259 8326 1 11 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.633 -2.556 25259 8327 1 11 . 1 1 81 81 GLN H H 81 8.765 8.765 7.743 1.022 25259 8328 1 11 . 1 1 82 82 LYS N N 82 120.458 120.458 118.805 1.653 25259 8329 1 11 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.953 0.136 25259 8330 1 11 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.869 -1.557 25259 8331 1 11 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.884 -1.730 25259 8332 1 11 . 1 1 82 82 LYS H H 82 7.521 7.521 7.495 0.026 25259 8333 1 11 . 1 1 83 83 ALA N N 83 125.234 125.234 119.149 6.085 25259 8334 1 11 . 1 1 83 83 ALA HA H 83 4.217 4.217 4.096 0.121 25259 8335 1 11 . 1 1 83 83 ALA CA C 83 52.442 52.442 53.763 -1.321 25259 8336 1 11 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.700 -2.413 25259 8337 1 11 . 1 1 83 83 ALA H H 83 7.782 7.782 7.731 0.051 25259 8338 1 11 . 1 1 84 84 LEU N N 84 123.348 123.348 118.563 4.785 25259 8339 1 11 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.909 0.149 25259 8340 1 11 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.300 -1.801 25259 8341 1 11 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.699 -2.391 25259 8342 1 11 . 1 1 84 84 LEU H H 84 8.590 8.590 7.367 1.223 25259 8343 1 11 . 1 1 85 85 LEU N N 85 122.872 122.872 119.552 3.320 25259 8344 1 11 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.988 0.182 25259 8345 1 11 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.558 -2.162 25259 8346 1 11 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.453 -1.712 25259 8347 1 11 . 1 1 85 85 LEU H H 85 7.892 7.892 7.870 0.022 25259 8348 1 11 . 1 1 86 86 GLU N N 86 122.713 122.713 118.354 4.359 25259 8349 1 11 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.971 0.114 25259 8350 1 11 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.827 -2.082 25259 8351 1 11 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.576 -2.673 25259 8352 1 11 . 1 1 86 86 GLU H H 86 8.124 8.124 8.398 -0.274 25259 8353 1 11 . 1 1 87 87 ALA N N 87 123.163 123.163 120.771 2.392 25259 8354 1 11 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.133 0.008 25259 8355 1 11 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.568 -2.300 25259 8356 1 11 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.546 -2.914 25259 8357 1 11 . 1 1 87 87 ALA H H 87 7.765 7.765 7.375 0.390 25259 8358 1 11 . 1 1 88 88 GLU N N 88 121.945 121.945 116.348 5.597 25259 8359 1 11 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.089 -0.005 25259 8360 1 11 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.200 -1.265 25259 8361 1 11 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.746 -1.719 25259 8362 1 11 . 1 1 88 88 GLU H H 88 7.846 7.846 7.880 -0.034 25259 8363 1 11 . 1 1 89 89 GLU N N 89 117.978 117.978 115.050 2.928 25259 8364 1 11 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.205 -0.112 25259 8365 1 11 . 1 1 89 89 GLU CA C 89 55.214 55.214 57.813 -2.599 25259 8366 1 11 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.560 -2.153 25259 8367 1 11 . 1 1 89 89 GLU H H 89 7.634 7.634 7.843 -0.209 25259 8368 1 11 . 1 1 90 90 LYS N N 90 117.519 117.519 117.046 0.473 25259 8369 1 11 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.367 0.064 25259 8370 1 11 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.733 -2.715 25259 8371 1 11 . 1 1 90 90 LYS CB C 90 31.031 31.031 33.508 -2.477 25259 8372 1 11 . 1 1 90 90 LYS H H 90 7.247 7.247 7.345 -0.098 25259 8373 1 11 . 1 1 91 91 ASP N N 91 124.888 124.888 122.416 2.472 25259 8374 1 11 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.529 0.154 25259 8375 1 11 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.549 -3.350 25259 8376 1 11 . 1 1 91 91 ASP CB C 91 39.581 39.581 41.734 -2.153 25259 8377 1 11 . 1 1 91 91 ASP H H 91 7.370 7.370 7.715 -0.345 25259 8378 1 11 . 1 1 92 92 LYS N N 92 129.311 129.311 126.841 2.470 25259 8379 1 11 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.956 0.057 25259 8380 1 11 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.217 -2.001 25259 8381 1 11 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.329 -2.314 25259 8382 1 11 . 1 1 92 92 LYS H H 92 8.795 8.795 8.884 -0.089 25259 8383 1 11 . 1 1 93 93 SER N N 93 118.112 118.112 116.090 2.022 25259 8384 1 11 . 1 1 93 93 SER HA H 93 4.439 4.439 4.186 0.253 25259 8385 1 11 . 1 1 93 93 SER CA C 93 58.945 58.945 61.521 -2.576 25259 8386 1 11 . 1 1 93 93 SER CB C 93 60.278 60.278 62.774 -2.496 25259 8387 1 11 . 1 1 93 93 SER H H 93 8.488 8.488 8.118 0.370 25259 8388 1 11 . 1 1 94 94 ILE N N 94 128.950 128.950 123.155 5.795 25259 8389 1 11 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.158 0.324 25259 8390 1 11 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.966 -2.618 25259 8391 1 11 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.718 -2.965 25259 8392 1 11 . 1 1 94 94 ILE H H 94 7.722 7.722 7.893 -0.171 25259 8393 1 11 . 1 1 95 95 ILE N N 95 123.598 123.598 119.764 3.834 25259 8394 1 11 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.433 0.162 25259 8395 1 11 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.692 -2.945 25259 8396 1 11 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.434 -1.462 25259 8397 1 11 . 1 1 95 95 ILE H H 95 8.378 8.378 8.142 0.236 25259 8398 1 11 . 1 1 96 96 GLU N N 96 118.317 118.317 118.866 -0.549 25259 8399 1 11 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.877 0.107 25259 8400 1 11 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.392 -2.897 25259 8401 1 11 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.404 -2.231 25259 8402 1 11 . 1 1 96 96 GLU H H 96 7.680 7.680 7.897 -0.217 25259 8403 1 11 . 1 1 97 97 ALA N N 97 124.797 124.797 121.603 3.194 25259 8404 1 11 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.891 -0.066 25259 8405 1 11 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.362 -2.065 25259 8406 1 11 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.614 -2.625 25259 8407 1 11 . 1 1 97 97 ALA H H 97 7.383 7.383 7.644 -0.261 25259 8408 1 11 . 1 1 98 98 ARG N N 98 115.469 115.469 115.809 -0.340 25259 8409 1 11 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.350 -0.044 25259 8410 1 11 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.688 -1.198 25259 8411 1 11 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.969 -1.731 25259 8412 1 11 . 1 1 98 98 ARG H H 98 8.229 8.229 8.075 0.154 25259 8413 1 11 . 1 1 99 99 LYS N N 99 120.219 120.219 117.418 2.801 25259 8414 1 11 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.114 0.144 25259 8415 1 11 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.419 -2.178 25259 8416 1 11 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.343 -1.847 25259 8417 1 11 . 1 1 99 99 LYS H H 99 7.270 7.270 7.470 -0.200 25259 8418 1 11 . 1 1 100 100 LEU N N 100 123.800 123.800 118.649 5.151 25259 8419 1 11 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.288 0.053 25259 8420 1 11 . 1 1 100 100 LEU CA C 100 52.079 52.079 55.186 -3.107 25259 8421 1 11 . 1 1 100 100 LEU CB C 100 39.131 39.131 41.845 -2.714 25259 8422 1 11 . 1 1 100 100 LEU H H 100 7.837 7.837 7.342 0.495 25259 8423 1 11 . 1 1 101 101 ALA N N 101 130.512 130.512 121.967 8.545 25259 8424 1 11 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.587 -0.211 25259 8425 1 11 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.277 -1.873 25259 8426 1 11 . 1 1 101 101 ALA CB C 101 15.796 15.796 19.947 -4.151 25259 8427 1 11 . 1 1 101 101 ALA H H 101 8.213 8.213 8.742 -0.529 25259 8428 1 11 . 1 1 102 102 GLY N N 102 110.659 110.659 105.873 4.786 25259 8429 1 11 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.247 -1.354 25259 8430 1 11 . 1 1 102 102 GLY H H 102 8.738 8.738 8.377 0.361 25259 8431 1 11 . 1 1 103 103 PHE N N 103 123.097 123.097 121.308 1.789 25259 8432 1 11 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.308 -0.088 25259 8433 1 11 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.713 -2.945 25259 8434 1 11 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.480 -1.906 25259 8435 1 11 . 1 1 103 103 PHE H H 103 7.514 7.514 7.751 -0.237 25259 8436 1 11 . 1 1 104 104 LYS N N 104 130.652 130.652 125.875 4.777 25259 8437 1 11 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.544 -0.424 25259 8438 1 11 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.689 -1.710 25259 8439 1 11 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.916 -2.679 25259 8440 1 11 . 1 1 104 104 LYS H H 104 7.473 7.473 8.311 -0.838 25259 8441 1 11 . 1 1 105 105 LEU N N 105 127.372 127.372 124.124 3.248 25259 8442 1 11 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.193 -0.197 25259 8443 1 11 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.424 -2.688 25259 8444 1 11 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.099 -1.135 25259 8445 1 11 . 1 1 105 105 LEU H H 105 8.393 8.393 8.220 0.173 25259 8446 1 11 . 1 1 106 106 GLU N N 106 129.358 129.358 125.829 3.529 25259 8447 1 11 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.656 0.188 25259 8448 1 11 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.224 -2.434 25259 8449 1 11 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.844 -2.216 25259 8450 1 11 . 1 1 106 106 GLU H H 106 8.849 8.849 8.461 0.388 25259 8451 1 11 . 1 1 107 107 THR N N 107 131.118 131.118 120.899 10.219 25259 8452 1 11 . 1 1 107 107 THR HA H 107 5.110 5.110 4.753 0.357 25259 8453 1 11 . 1 1 107 107 THR CA C 107 59.832 59.832 62.060 -2.228 25259 8454 1 11 . 1 1 107 107 THR CB C 107 66.671 66.671 70.126 -3.455 25259 8455 1 11 . 1 1 107 107 THR H H 107 9.433 9.433 8.357 1.076 25259 8456 1 11 . 1 1 108 108 LYS N N 108 129.114 129.114 123.515 5.599 25259 8457 1 11 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.587 0.237 25259 8458 1 11 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.373 -3.179 25259 8459 1 11 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.604 -1.216 25259 8460 1 11 . 1 1 108 108 LYS H H 108 9.410 9.410 8.990 0.420 25259 8461 1 11 . 1 1 109 109 LEU N N 109 129.323 129.323 125.971 3.352 25259 8462 1 11 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.424 0.280 25259 8463 1 11 . 1 1 109 109 LEU CA C 109 52.108 52.108 55.153 -3.045 25259 8464 1 11 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.178 -2.523 25259 8465 1 11 . 1 1 109 109 LEU H H 109 8.862 8.862 8.791 0.071 25259 8466 1 11 . 1 1 110 110 LEU N N 110 129.123 129.123 127.450 1.673 25259 8467 1 11 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.044 0.179 25259 8468 1 11 . 1 1 110 110 LEU CA C 110 53.782 53.782 57.199 -3.417 25259 8469 1 11 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.468 -1.807 25259 8470 1 11 . 1 1 110 110 LEU H H 110 8.373 8.373 8.323 0.050 25259 8471 1 11 . 1 1 111 111 SER N N 111 114.587 114.587 109.880 4.707 25259 8472 1 11 . 1 1 111 111 SER HA H 111 4.557 4.557 4.598 -0.041 25259 8473 1 11 . 1 1 111 111 SER CA C 111 53.889 53.889 57.420 -3.531 25259 8474 1 11 . 1 1 111 111 SER CB C 111 61.830 61.830 64.546 -2.716 25259 8475 1 11 . 1 1 111 111 SER H H 111 8.400 8.400 7.828 0.572 25259 8476 1 11 . 1 1 112 112 ALA N N 112 118.269 118.269 123.522 -5.253 25259 8477 1 11 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.306 0.003 25259 8478 1 11 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.611 -3.397 25259 8479 1 11 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.537 -1.949 25259 8480 1 11 . 1 1 112 112 ALA H H 112 8.556 8.556 8.604 -0.048 25259 8481 1 11 . 1 1 113 113 THR N N 113 102.878 102.878 101.723 1.155 25259 8482 1 11 . 1 1 113 113 THR HA H 113 4.662 4.662 4.443 0.219 25259 8483 1 11 . 1 1 113 113 THR CA C 113 58.689 58.689 61.311 -2.622 25259 8484 1 11 . 1 1 113 113 THR CB C 113 67.905 67.905 69.636 -1.731 25259 8485 1 11 . 1 1 113 113 THR H H 113 8.065 8.065 7.653 0.412 25259 8486 1 11 . 1 1 114 114 GLU N N 114 126.514 126.514 121.256 5.258 25259 8487 1 11 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.982 0.032 25259 8488 1 11 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.019 -2.012 25259 8489 1 11 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.659 -1.746 25259 8490 1 11 . 1 1 114 114 GLU H H 114 7.357 7.357 7.963 -0.606 25259 8491 1 11 . 1 1 115 115 LEU N N 115 128.058 128.058 118.591 9.467 25259 8492 1 11 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.331 -0.409 25259 8493 1 11 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.174 -1.850 25259 8494 1 11 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.538 -2.399 25259 8495 1 11 . 1 1 115 115 LEU H H 115 8.930 8.930 8.995 -0.065 25259 8496 1 11 . 1 1 116 116 GLN N N 116 126.540 126.540 119.824 6.716 25259 8497 1 11 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.034 0.681 25259 8498 1 11 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.103 -2.403 25259 8499 1 11 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.097 -0.805 25259 8500 1 11 . 1 1 116 116 GLN H H 116 9.221 9.221 9.008 0.213 25259 8501 1 11 . 1 1 117 117 THR N N 117 125.213 125.213 120.025 5.188 25259 8502 1 11 . 1 1 117 117 THR HA H 117 5.353 5.353 5.222 0.131 25259 8503 1 11 . 1 1 117 117 THR CA C 117 58.926 58.926 60.850 -1.924 25259 8504 1 11 . 1 1 117 117 THR CB C 117 68.948 68.948 71.941 -2.993 25259 8505 1 11 . 1 1 117 117 THR H H 117 9.030 9.030 8.500 0.530 25259 8506 1 11 . 1 1 118 118 THR N N 118 127.799 127.799 120.025 7.774 25259 8507 1 11 . 1 1 118 118 THR HA H 118 5.527 5.527 5.038 0.489 25259 8508 1 11 . 1 1 118 118 THR CA C 118 59.201 59.201 62.096 -2.895 25259 8509 1 11 . 1 1 118 118 THR CB C 118 67.721 67.721 71.186 -3.465 25259 8510 1 11 . 1 1 118 118 THR H H 118 9.459 9.459 8.460 0.999 25259 8511 1 11 . 1 1 119 119 THR N N 119 129.258 129.258 124.631 4.627 25259 8512 1 11 . 1 1 119 119 THR HA H 119 4.885 4.885 4.602 0.283 25259 8513 1 11 . 1 1 119 119 THR CA C 119 58.463 58.463 61.350 -2.887 25259 8514 1 11 . 1 1 119 119 THR CB C 119 67.459 67.459 69.873 -2.414 25259 8515 1 11 . 1 1 119 119 THR H H 119 9.147 9.147 9.066 0.081 25259 8516 1 11 . 1 1 120 120 SER N N 120 123.389 123.389 120.921 2.468 25259 8517 1 11 . 1 1 120 120 SER HA H 120 5.328 5.328 4.909 0.419 25259 8518 1 11 . 1 1 120 120 SER CA C 120 54.386 54.386 57.089 -2.703 25259 8519 1 11 . 1 1 120 120 SER CB C 120 63.031 63.031 64.280 -1.249 25259 8520 1 11 . 1 1 120 120 SER H H 120 8.786 8.786 8.658 0.128 25259 8521 1 11 . 1 1 121 121 PHE N N 121 121.245 121.245 124.179 -2.934 25259 8522 1 11 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.846 0.266 25259 8523 1 11 . 1 1 121 121 PHE CA C 121 53.192 53.192 57.133 -3.941 25259 8524 1 11 . 1 1 121 121 PHE CB C 121 40.265 40.265 40.251 0.014 25259 8525 1 11 . 1 1 121 121 PHE H H 121 8.831 8.831 8.909 -0.078 25259 8526 1 11 . 1 1 122 122 ASP N N 122 124.765 124.765 124.775 -0.010 25259 8527 1 11 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.949 -0.109 25259 8528 1 11 . 1 1 122 122 ASP CA C 122 49.837 49.837 52.679 -2.842 25259 8529 1 11 . 1 1 122 122 ASP CB C 122 38.485 38.485 41.375 -2.890 25259 8530 1 11 . 1 1 122 122 ASP H H 122 8.819 8.819 9.002 -0.183 25259 8531 1 11 . 1 1 123 123 PHE N N 123 124.303 124.303 121.057 3.246 25259 8532 1 11 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.480 0.194 25259 8533 1 11 . 1 1 123 123 PHE CA C 123 57.798 57.798 58.383 -0.585 25259 8534 1 11 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.112 -2.572 25259 8535 1 11 . 1 1 123 123 PHE H H 123 8.262 8.262 8.150 0.112 25259 8536 1 11 . 1 1 124 124 GLN N N 124 120.792 120.792 117.566 3.226 25259 8537 1 11 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.249 0.185 25259 8538 1 11 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.074 -1.991 25259 8539 1 11 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.084 -1.955 25259 8540 1 11 . 1 1 124 124 GLN H H 124 8.954 8.954 8.208 0.746 25259 8541 1 11 . 1 1 125 125 VAL N N 125 114.091 114.091 110.101 3.990 25259 8542 1 11 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.350 0.059 25259 8543 1 11 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.077 -2.779 25259 8544 1 11 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.965 -1.393 25259 8545 1 11 . 1 1 125 125 VAL H H 125 7.026 7.026 7.943 -0.917 25259 8546 1 11 . 1 1 126 126 LEU N N 126 125.158 125.158 124.155 1.003 25259 8547 1 11 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.424 0.051 25259 8548 1 11 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.261 -2.086 25259 8549 1 11 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.992 -0.938 25259 8550 1 11 . 1 1 126 126 LEU H H 126 8.106 8.106 8.101 0.005 25259 8551 1 11 . 1 1 127 127 ASP N N 127 130.026 130.026 129.276 0.750 25259 8552 1 11 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.699 0.142 25259 8553 1 11 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.861 -3.663 25259 8554 1 11 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.701 -2.012 25259 8555 1 11 . 1 1 127 127 ASP H H 127 9.129 9.129 8.989 0.140 25259 8556 1 11 . 1 1 128 128 VAL N N 128 128.833 128.833 123.563 5.270 25259 8557 1 11 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.534 -0.010 25259 8558 1 11 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.225 -2.557 25259 8559 1 11 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.538 -2.043 25259 8560 1 11 . 1 1 128 128 VAL H H 128 8.288 8.288 7.937 0.351 25259 8561 1 11 . 1 1 129 129 LYS N N 129 123.914 123.914 119.379 4.535 25259 8562 1 11 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.938 0.105 25259 8563 1 11 . 1 1 129 129 LYS CA C 129 56.789 56.789 59.161 -2.372 25259 8564 1 11 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.795 -2.858 25259 8565 1 11 . 1 1 129 129 LYS H H 129 8.226 8.226 8.168 0.058 25259 8566 1 11 . 1 1 130 130 LYS N N 130 121.888 121.888 117.292 4.596 25259 8567 1 11 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.232 -0.147 25259 8568 1 11 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.454 -1.308 25259 8569 1 11 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.827 -2.486 25259 8570 1 11 . 1 1 130 130 LYS H H 130 7.590 7.590 7.687 -0.097 25259 8571 1 11 . 1 1 131 131 ALA N N 131 123.088 123.088 122.854 0.234 25259 8572 1 11 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.044 -0.117 25259 8573 1 11 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.306 -2.905 25259 8574 1 11 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.161 -1.714 25259 8575 1 11 . 1 1 131 131 ALA H H 131 8.506 8.506 8.224 0.282 25259 8576 1 11 . 1 1 132 132 SER N N 132 110.456 110.456 112.272 -1.816 25259 8577 1 11 . 1 1 132 132 SER HA H 132 4.117 4.117 4.104 0.013 25259 8578 1 11 . 1 1 132 132 SER CA C 132 58.289 58.289 60.449 -2.160 25259 8579 1 11 . 1 1 132 132 SER CB C 132 61.034 61.034 63.242 -2.208 25259 8580 1 11 . 1 1 132 132 SER H H 132 7.986 7.986 7.805 0.181 25259 8581 1 11 . 1 1 133 133 GLN N N 133 119.034 119.034 118.433 0.601 25259 8582 1 11 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.503 -0.101 25259 8583 1 11 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.193 -1.668 25259 8584 1 11 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.197 -1.963 25259 8585 1 11 . 1 1 133 133 GLN H H 133 7.233 7.233 7.994 -0.761 25259 8586 1 11 . 1 1 134 134 LEU N N 134 123.291 123.291 120.093 3.198 25259 8587 1 11 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.919 -0.526 25259 8588 1 11 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.166 -0.849 25259 8589 1 11 . 1 1 134 134 LEU CB C 134 38.847 38.847 44.278 -5.431 25259 8590 1 11 . 1 1 134 134 LEU H H 134 7.411 7.411 7.678 -0.267 25259 8591 1 11 . 1 1 135 135 GLU N N 135 128.446 128.446 123.806 4.640 25259 8592 1 11 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.899 0.047 25259 8593 1 11 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.772 -2.388 25259 8594 1 11 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.894 -2.598 25259 8595 1 11 . 1 1 135 135 GLU H H 135 8.986 8.986 8.618 0.368 25259 8596 1 11 . 1 1 136 136 HIS N N 136 117.593 117.593 118.342 -0.749 25259 8597 1 11 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.372 0.011 25259 8598 1 11 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.596 -1.911 25259 8599 1 11 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.779 -1.366 25259 8600 1 11 . 1 1 136 136 HIS H H 136 9.226 9.226 8.550 0.676 25259 8601 1 11 . 1 1 137 137 LEU N N 137 115.463 115.463 116.795 -1.332 25259 8602 1 11 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.420 0.087 25259 8603 1 11 . 1 1 137 137 LEU CA C 137 51.948 51.948 55.361 -3.413 25259 8604 1 11 . 1 1 137 137 LEU CB C 137 39.807 39.807 41.977 -2.170 25259 8605 1 11 . 1 1 137 137 LEU H H 137 7.090 7.090 7.878 -0.788 25259 8606 1 11 . 1 1 138 138 LYS N N 138 124.686 124.686 120.338 4.348 25259 8607 1 11 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.112 0.057 25259 8608 1 11 . 1 1 138 138 LYS CA C 138 57.158 57.158 59.370 -2.212 25259 8609 1 11 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.087 -1.999 25259 8610 1 11 . 1 1 138 138 LYS H H 138 7.698 7.698 7.631 0.067 25259 8611 1 11 . 1 1 139 139 ASN N N 139 118.077 118.077 113.902 4.175 25259 8612 1 11 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.591 0.082 25259 8613 1 11 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.126 -2.344 25259 8614 1 11 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.713 -2.896 25259 8615 1 11 . 1 1 139 139 ASN H H 139 8.485 8.485 8.380 0.105 25259 8616 1 11 . 1 1 140 140 ILE N N 140 120.880 120.880 120.529 0.351 25259 8617 1 11 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.243 -0.213 25259 8618 1 11 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.036 -1.470 25259 8619 1 11 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.148 -2.374 25259 8620 1 11 . 1 1 140 140 ILE H H 140 7.549 7.549 7.718 -0.169 25259 8621 1 11 . 1 1 141 141 GLY N N 141 110.676 110.676 117.145 -6.469 25259 8622 1 11 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.597 0.067 25259 8623 1 11 . 1 1 141 141 GLY H H 141 7.663 7.663 8.842 -1.179 25259 8624 1 11 . 1 1 142 142 LEU N N 142 123.857 123.857 124.217 -0.360 25259 8625 1 11 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.625 0.068 25259 8626 1 11 . 1 1 142 142 LEU CA C 142 55.193 55.193 58.168 -2.975 25259 8627 1 11 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.425 -0.816 25259 8628 1 11 . 1 1 142 142 LEU H H 142 8.496 8.496 7.919 0.577 25259 8629 1 11 . 1 1 143 143 GLU N N 143 118.407 118.407 116.069 2.338 25259 8630 1 11 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.869 -0.083 25259 8631 1 11 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.567 -1.345 25259 8632 1 11 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.776 -2.263 25259 8633 1 11 . 1 1 143 143 GLU H H 143 8.672 8.672 8.324 0.348 25259 8634 1 11 . 1 1 144 144 ASN N N 144 118.477 118.477 118.153 0.324 25259 8635 1 11 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.488 -0.046 25259 8636 1 11 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.283 -1.571 25259 8637 1 11 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.261 -2.306 25259 8638 1 11 . 1 1 144 144 ASN H H 144 7.656 7.656 7.267 0.389 25259 8639 1 11 . 1 1 145 145 LEU N N 145 125.354 125.354 121.682 3.672 25259 8640 1 11 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.720 0.077 25259 8641 1 11 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.536 -1.214 25259 8642 1 11 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.870 -2.297 25259 8643 1 11 . 1 1 145 145 LEU H H 145 7.758 7.758 7.764 -0.006 25259 8644 1 11 . 1 1 146 146 LEU N N 146 116.372 116.372 114.668 1.704 25259 8645 1 11 . 1 1 146 146 LEU HA H 146 3.876 3.876 4.038 -0.162 25259 8646 1 11 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.458 -2.215 25259 8647 1 11 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.262 -1.365 25259 8648 1 11 . 1 1 146 146 LEU H H 146 7.242 7.242 7.255 -0.013 25259 8649 1 11 . 1 1 147 147 LYS N N 147 120.054 120.054 117.990 2.064 25259 8650 1 11 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.448 -0.136 25259 8651 1 11 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.466 -0.843 25259 8652 1 11 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.305 -2.045 25259 8653 1 11 . 1 1 147 147 LYS H H 147 7.185 7.185 7.860 -0.675 25259 8654 1 11 . 1 1 148 148 ASN N N 148 119.498 119.498 117.463 2.035 25259 8655 1 11 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.845 0.117 25259 8656 1 11 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.178 -2.404 25259 8657 1 11 . 1 1 148 148 ASN CB C 148 39.486 39.486 39.959 -0.473 25259 8658 1 11 . 1 1 148 148 ASN H H 148 7.698 7.698 7.732 -0.034 25259 8659 1 11 . 1 1 149 149 GLU N N 149 122.834 122.834 118.383 4.451 25259 8660 1 11 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.558 0.043 25259 8661 1 11 . 1 1 149 149 GLU CA C 149 52.219 52.219 52.845 -0.626 25259 8662 1 11 . 1 1 149 149 GLU CB C 149 26.810 26.810 30.455 -3.645 25259 8663 1 11 . 1 1 149 149 GLU H H 149 8.767 8.767 8.627 0.140 25259 8664 1 11 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.663 0.945 25259 8665 1 11 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.931 -1.689 25259 8666 1 11 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.163 -3.068 25259 8667 1 11 . 1 1 151 151 SER N N 151 112.839 112.839 111.974 0.865 25259 8668 1 11 . 1 1 151 151 SER HA H 151 3.835 3.835 4.402 -0.567 25259 8669 1 11 . 1 1 151 151 SER CA C 151 59.270 59.270 58.864 0.406 25259 8670 1 11 . 1 1 151 151 SER CB C 151 59.451 59.451 62.936 -3.485 25259 8671 1 11 . 1 1 151 151 SER H H 151 8.519 8.519 7.711 0.808 25259 8672 1 11 . 1 1 152 152 LYS N N 152 126.710 126.710 122.717 3.993 25259 8673 1 11 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.105 0.143 25259 8674 1 11 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.283 -3.518 25259 8675 1 11 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.370 -2.113 25259 8676 1 11 . 1 1 152 152 LYS H H 152 7.006 7.006 7.956 -0.950 25259 8677 1 11 . 1 1 153 153 TYR N N 153 123.239 123.239 116.891 6.348 25259 8678 1 11 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.411 -0.153 25259 8679 1 11 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.508 0.801 25259 8680 1 11 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.424 -1.090 25259 8681 1 11 . 1 1 153 153 TYR H H 153 8.058 8.058 7.933 0.125 25259 8682 1 11 . 1 1 154 154 ILE N N 154 120.253 120.253 120.468 -0.215 25259 8683 1 11 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.235 0.138 25259 8684 1 11 . 1 1 154 154 ILE CA C 154 63.114 63.114 64.940 -1.826 25259 8685 1 11 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.007 -1.059 25259 8686 1 11 . 1 1 154 154 ILE H H 154 8.193 8.193 7.904 0.289 25259 8687 1 11 . 1 1 155 155 SER N N 155 117.178 117.178 114.787 2.391 25259 8688 1 11 . 1 1 155 155 SER HA H 155 4.091 4.091 4.027 0.064 25259 8689 1 11 . 1 1 155 155 SER CA C 155 59.961 59.961 61.735 -1.774 25259 8690 1 11 . 1 1 155 155 SER CB C 155 60.148 60.148 62.749 -2.601 25259 8691 1 11 . 1 1 155 155 SER H H 155 8.020 8.020 8.050 -0.030 25259 8692 1 11 . 1 1 156 156 ASP N N 156 125.479 125.479 121.742 3.737 25259 8693 1 11 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.446 -0.019 25259 8694 1 11 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.663 -1.903 25259 8695 1 11 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.072 -3.199 25259 8696 1 11 . 1 1 156 156 ASP H H 156 8.638 8.638 7.564 1.074 25259 8697 1 11 . 1 1 157 157 ARG N N 157 121.542 121.542 119.893 1.649 25259 8698 1 11 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.968 0.143 25259 8699 1 11 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.481 -2.553 25259 8700 1 11 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.737 -1.921 25259 8701 1 11 . 1 1 157 157 ARG H H 157 7.888 7.888 7.913 -0.025 25259 8702 1 11 . 1 1 158 158 LEU N N 158 124.257 124.257 119.310 4.947 25259 8703 1 11 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.250 0.021 25259 8704 1 11 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.935 -2.723 25259 8705 1 11 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.847 -1.902 25259 8706 1 11 . 1 1 158 158 LEU H H 158 8.442 8.442 8.540 -0.098 25259 8707 1 11 . 1 1 159 159 ALA N N 159 124.146 124.146 119.252 4.894 25259 8708 1 11 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.131 0.201 25259 8709 1 11 . 1 1 159 159 ALA CA C 159 51.432 51.432 53.776 -2.344 25259 8710 1 11 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.692 -2.785 25259 8711 1 11 . 1 1 159 159 ALA H H 159 8.086 8.086 7.389 0.697 25259 8712 1 11 . 1 1 160 160 ASN N N 160 118.093 118.093 116.659 1.434 25259 8713 1 11 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.622 0.370 25259 8714 1 11 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.127 -2.550 25259 8715 1 11 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.673 -0.940 25259 8716 1 11 . 1 1 160 160 ASN H H 160 7.445 7.445 7.679 -0.234 25259 8717 1 11 . 1 1 161 161 GLY N N 161 108.365 108.365 107.094 1.271 25259 8718 1 11 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.074 -1.428 25259 8719 1 11 . 1 1 161 161 GLY H H 161 7.743 7.743 7.693 0.050 25259 8720 1 11 . 1 1 162 162 ALA N N 162 123.928 123.928 121.790 2.138 25259 8721 1 11 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.924 -0.051 25259 8722 1 11 . 1 1 162 162 ALA CA C 162 49.526 49.526 50.915 -1.389 25259 8723 1 11 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.698 -3.638 25259 8724 1 11 . 1 1 162 162 ALA H H 162 8.035 8.035 7.351 0.684 25259 8725 1 11 . 1 1 163 163 THR N N 163 113.286 113.286 110.324 2.962 25259 8726 1 11 . 1 1 163 163 THR HA H 163 4.703 4.703 4.664 0.039 25259 8727 1 11 . 1 1 163 163 THR CA C 163 57.791 57.791 60.657 -2.866 25259 8728 1 11 . 1 1 163 163 THR CB C 163 68.974 68.974 71.651 -2.677 25259 8729 1 11 . 1 1 163 163 THR H H 163 8.451 8.451 8.259 0.192 25259 8730 1 11 . 1 1 164 164 GLU N N 164 125.905 125.905 118.336 7.569 25259 8731 1 11 . 1 1 164 164 GLU HA H 164 5.060 5.060 5.298 -0.238 25259 8732 1 11 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.502 -0.917 25259 8733 1 11 . 1 1 164 164 GLU CB C 164 29.211 29.211 33.040 -3.829 25259 8734 1 11 . 1 1 164 164 GLU H H 164 8.716 8.716 8.474 0.242 25259 8735 1 12 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.022 -0.347 25259 8736 1 12 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.951 -2.143 25259 8737 1 12 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.437 -3.366 25259 8738 1 12 . 1 1 3 3 ALA N N 3 126.741 126.741 127.247 -0.506 25259 8739 1 12 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.694 -0.200 25259 8740 1 12 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.850 -1.648 25259 8741 1 12 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.858 -4.040 25259 8742 1 12 . 1 1 3 3 ALA H H 3 8.440 8.440 8.704 -0.264 25259 8743 1 12 . 1 1 4 4 THR N N 4 116.015 116.015 114.884 1.131 25259 8744 1 12 . 1 1 4 4 THR HA H 4 4.393 4.393 4.671 -0.278 25259 8745 1 12 . 1 1 4 4 THR CA C 4 59.148 59.148 61.599 -2.451 25259 8746 1 12 . 1 1 4 4 THR CB C 4 67.580 67.580 70.716 -3.136 25259 8747 1 12 . 1 1 4 4 THR H H 4 8.050 8.050 8.222 -0.172 25259 8748 1 12 . 1 1 5 5 LYS N N 5 126.350 126.350 122.780 3.570 25259 8749 1 12 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.620 -0.115 25259 8750 1 12 . 1 1 5 5 LYS CA C 5 53.917 53.917 56.807 -2.890 25259 8751 1 12 . 1 1 5 5 LYS CB C 5 30.684 30.684 33.154 -2.470 25259 8752 1 12 . 1 1 5 5 LYS H H 5 8.332 8.332 8.568 -0.236 25259 8753 1 12 . 1 1 6 6 THR N N 6 118.124 118.124 116.737 1.387 25259 8754 1 12 . 1 1 6 6 THR HA H 6 4.440 4.440 4.617 -0.177 25259 8755 1 12 . 1 1 6 6 THR CA C 6 59.282 59.282 61.516 -2.234 25259 8756 1 12 . 1 1 6 6 THR CB C 6 67.685 67.685 70.586 -2.901 25259 8757 1 12 . 1 1 6 6 THR H H 6 8.283 8.283 8.225 0.058 25259 8758 1 12 . 1 1 7 7 GLU N N 7 125.934 125.934 122.133 3.801 25259 8759 1 12 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.728 -0.384 25259 8760 1 12 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.021 -0.840 25259 8761 1 12 . 1 1 7 7 GLU CB C 7 27.816 27.816 32.716 -4.900 25259 8762 1 12 . 1 1 7 7 GLU H H 7 8.487 8.487 8.371 0.116 25259 8763 1 12 . 1 1 8 8 LYS N N 8 123.945 123.945 120.094 3.851 25259 8764 1 12 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.131 -1.196 25259 8765 1 12 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.211 -3.646 25259 8766 1 12 . 1 1 8 8 LYS H H 8 8.278 8.278 8.330 -0.052 25259 8767 1 12 . 1 1 9 9 ASP N N 9 123.624 123.624 122.217 1.407 25259 8768 1 12 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.792 -0.453 25259 8769 1 12 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.928 -1.805 25259 8770 1 12 . 1 1 9 9 ASP CB C 9 38.933 38.933 40.708 -1.775 25259 8771 1 12 . 1 1 9 9 ASP H H 9 8.277 8.277 8.624 -0.347 25259 8772 1 12 . 1 1 10 10 THR N N 10 116.812 116.812 114.931 1.881 25259 8773 1 12 . 1 1 10 10 THR HA H 10 4.349 4.349 4.647 -0.298 25259 8774 1 12 . 1 1 10 10 THR CA C 10 59.634 59.634 61.691 -2.057 25259 8775 1 12 . 1 1 10 10 THR CB C 10 67.254 67.254 69.529 -2.275 25259 8776 1 12 . 1 1 10 10 THR H H 10 8.049 8.049 8.214 -0.165 25259 8777 1 12 . 1 1 11 11 LEU N N 11 126.610 126.610 120.792 5.818 25259 8778 1 12 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.906 -0.514 25259 8779 1 12 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.596 -1.518 25259 8780 1 12 . 1 1 11 11 LEU CB C 11 39.633 39.633 44.736 -5.103 25259 8781 1 12 . 1 1 11 11 LEU H H 11 8.191 8.191 8.078 0.113 25259 8782 1 12 . 1 1 12 12 GLN N N 12 123.274 123.274 117.242 6.032 25259 8783 1 12 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.553 -0.171 25259 8784 1 12 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.978 -1.404 25259 8785 1 12 . 1 1 12 12 GLN CB C 12 26.803 26.803 30.443 -3.640 25259 8786 1 12 . 1 1 12 12 GLN H H 12 8.280 8.280 8.294 -0.014 25259 8787 1 12 . 1 1 13 13 SER N N 13 119.027 119.027 115.426 3.601 25259 8788 1 12 . 1 1 13 13 SER HA H 13 4.471 4.471 4.574 -0.103 25259 8789 1 12 . 1 1 13 13 SER CA C 13 55.869 55.869 57.803 -1.934 25259 8790 1 12 . 1 1 13 13 SER CB C 13 61.424 61.424 63.902 -2.478 25259 8791 1 12 . 1 1 13 13 SER H H 13 8.178 8.178 8.508 -0.330 25259 8792 1 12 . 1 1 14 14 ALA N N 14 128.314 128.314 122.100 6.214 25259 8793 1 12 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.519 -0.085 25259 8794 1 12 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.536 -1.840 25259 8795 1 12 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.879 -2.798 25259 8796 1 12 . 1 1 14 14 ALA H H 14 8.195 8.195 8.124 0.071 25259 8797 1 12 . 1 1 15 15 LEU N N 15 125.175 125.175 118.458 6.717 25259 8798 1 12 . 1 1 15 15 LEU HA H 15 4.640 4.640 5.120 -0.480 25259 8799 1 12 . 1 1 15 15 LEU CA C 15 50.604 50.604 52.972 -2.368 25259 8800 1 12 . 1 1 15 15 LEU CB C 15 39.467 39.467 43.171 -3.704 25259 8801 1 12 . 1 1 15 15 LEU H H 15 8.050 8.050 8.650 -0.600 25259 8802 1 12 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.612 -0.108 25259 8803 1 12 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.718 -2.087 25259 8804 1 12 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.512 -2.854 25259 8805 1 12 . 1 1 17 17 VAL N N 17 123.223 123.223 118.467 4.756 25259 8806 1 12 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.369 -0.235 25259 8807 1 12 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.017 -1.190 25259 8808 1 12 . 1 1 17 17 VAL CB C 17 30.377 30.377 34.164 -3.787 25259 8809 1 12 . 1 1 17 17 VAL H H 17 8.134 8.134 8.479 -0.345 25259 8810 1 12 . 1 1 18 18 ILE N N 18 127.777 127.777 122.835 4.942 25259 8811 1 12 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.671 -0.428 25259 8812 1 12 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.170 -2.849 25259 8813 1 12 . 1 1 18 18 ILE CB C 18 36.254 36.254 39.553 -3.299 25259 8814 1 12 . 1 1 18 18 ILE H H 18 8.187 8.187 8.605 -0.418 25259 8815 1 12 . 1 1 19 19 GLU N N 19 128.148 128.148 119.950 8.198 25259 8816 1 12 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.597 -0.260 25259 8817 1 12 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.606 -1.515 25259 8818 1 12 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.259 -4.083 25259 8819 1 12 . 1 1 19 19 GLU H H 19 8.475 8.475 8.936 -0.461 25259 8820 1 12 . 1 1 20 20 ASN N N 20 122.788 122.788 119.586 3.202 25259 8821 1 12 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.811 -0.116 25259 8822 1 12 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.913 -3.091 25259 8823 1 12 . 1 1 20 20 ASN CB C 20 36.366 36.366 39.344 -2.978 25259 8824 1 12 . 1 1 20 20 ASN H H 20 8.477 8.477 8.648 -0.171 25259 8825 1 12 . 1 1 21 21 ALA N N 21 127.253 127.253 126.040 1.213 25259 8826 1 12 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.459 -0.138 25259 8827 1 12 . 1 1 21 21 ALA CA C 21 50.688 50.688 52.254 -1.566 25259 8828 1 12 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.448 -3.535 25259 8829 1 12 . 1 1 21 21 ALA H H 21 8.325 8.325 8.441 -0.116 25259 8830 1 12 . 1 1 22 22 GLU N N 22 122.044 122.044 119.888 2.156 25259 8831 1 12 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.299 -0.006 25259 8832 1 12 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.951 -2.368 25259 8833 1 12 . 1 1 22 22 GLU CB C 22 27.285 27.285 28.540 -1.255 25259 8834 1 12 . 1 1 22 22 GLU H H 22 8.415 8.415 8.255 0.161 25259 8835 1 12 . 1 1 23 23 LYS N N 23 123.622 123.622 123.115 0.507 25259 8836 1 12 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.478 -0.153 25259 8837 1 12 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.435 -0.939 25259 8838 1 12 . 1 1 23 23 LYS CB C 23 30.653 30.653 34.792 -4.139 25259 8839 1 12 . 1 1 23 23 LYS H H 23 8.127 8.127 7.665 0.462 25259 8840 1 12 . 1 1 24 24 ASN N N 24 120.652 120.652 119.622 1.030 25259 8841 1 12 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.758 0.083 25259 8842 1 12 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.563 -2.900 25259 8843 1 12 . 1 1 24 24 ASN CB C 24 36.775 36.775 38.732 -1.957 25259 8844 1 12 . 1 1 24 24 ASN H H 24 8.424 8.424 8.265 0.159 25259 8845 1 12 . 1 1 25 25 THR N N 25 117.102 117.102 111.824 5.278 25259 8846 1 12 . 1 1 25 25 THR HA H 25 4.367 4.367 4.096 0.271 25259 8847 1 12 . 1 1 25 25 THR CA C 25 59.500 59.500 63.202 -3.702 25259 8848 1 12 . 1 1 25 25 THR CB C 25 67.610 67.610 69.420 -1.810 25259 8849 1 12 . 1 1 25 25 THR H H 25 7.852 7.852 8.368 -0.516 25259 8850 1 12 . 1 1 26 26 VAL N N 26 126.491 126.491 122.235 4.256 25259 8851 1 12 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.443 -0.276 25259 8852 1 12 . 1 1 26 26 VAL CA C 26 60.193 60.193 59.487 0.706 25259 8853 1 12 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.307 -4.702 25259 8854 1 12 . 1 1 26 26 VAL H H 26 8.080 8.080 7.766 0.314 25259 8855 1 12 . 1 1 27 27 VAL N N 27 132.992 132.992 121.200 11.792 25259 8856 1 12 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.673 -0.592 25259 8857 1 12 . 1 1 27 27 VAL CA C 27 58.984 58.984 59.501 -0.517 25259 8858 1 12 . 1 1 27 27 VAL CB C 27 31.540 31.540 35.064 -3.524 25259 8859 1 12 . 1 1 27 27 VAL H H 27 8.830 8.830 8.903 -0.073 25259 8860 1 12 . 1 1 28 28 THR N N 28 123.576 123.576 113.856 9.720 25259 8861 1 12 . 1 1 28 28 THR HA H 28 5.553 5.553 4.778 0.775 25259 8862 1 12 . 1 1 28 28 THR CA C 28 58.738 58.738 59.767 -1.029 25259 8863 1 12 . 1 1 28 28 THR CB C 28 68.443 68.443 70.660 -2.217 25259 8864 1 12 . 1 1 28 28 THR H H 28 8.165 8.165 7.969 0.196 25259 8865 1 12 . 1 1 29 29 LYS N N 29 129.099 129.099 123.781 5.318 25259 8866 1 12 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.584 0.358 25259 8867 1 12 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.304 -3.525 25259 8868 1 12 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.252 0.844 25259 8869 1 12 . 1 1 29 29 LYS H H 29 9.273 9.273 8.503 0.770 25259 8870 1 12 . 1 1 30 30 THR N N 30 123.510 123.510 116.290 7.220 25259 8871 1 12 . 1 1 30 30 THR HA H 30 5.428 5.428 4.954 0.474 25259 8872 1 12 . 1 1 30 30 THR CA C 30 59.784 59.784 62.250 -2.466 25259 8873 1 12 . 1 1 30 30 THR CB C 30 67.818 67.818 70.740 -2.922 25259 8874 1 12 . 1 1 30 30 THR H H 30 8.993 8.993 8.254 0.739 25259 8875 1 12 . 1 1 31 31 LEU N N 31 128.293 128.293 125.998 2.295 25259 8876 1 12 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.999 0.221 25259 8877 1 12 . 1 1 31 31 LEU CA C 31 50.055 50.055 52.850 -2.795 25259 8878 1 12 . 1 1 31 31 LEU CB C 31 43.399 43.399 43.880 -0.481 25259 8879 1 12 . 1 1 31 31 LEU H H 31 9.557 9.557 8.995 0.562 25259 8880 1 12 . 1 1 32 32 VAL N N 32 126.919 126.919 124.712 2.207 25259 8881 1 12 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.060 0.391 25259 8882 1 12 . 1 1 32 32 VAL CA C 32 59.664 59.664 62.238 -2.574 25259 8883 1 12 . 1 1 32 32 VAL CB C 32 29.449 29.449 31.196 -1.747 25259 8884 1 12 . 1 1 32 32 VAL H H 32 9.364 9.364 8.638 0.726 25259 8885 1 12 . 1 1 33 33 LEU N N 33 133.503 133.503 129.582 3.921 25259 8886 1 12 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.503 0.053 25259 8887 1 12 . 1 1 33 33 LEU CA C 33 52.004 52.004 52.602 -0.598 25259 8888 1 12 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.404 -3.557 25259 8889 1 12 . 1 1 33 33 LEU H H 33 8.587 8.587 7.863 0.724 25259 8890 1 12 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.436 0.045 25259 8891 1 12 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.528 -2.083 25259 8892 1 12 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.069 -2.504 25259 8893 1 12 . 1 1 35 35 LYS N N 35 127.420 127.420 117.728 9.692 25259 8894 1 12 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.408 -0.042 25259 8895 1 12 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.702 -1.583 25259 8896 1 12 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.647 -2.053 25259 8897 1 12 . 1 1 35 35 LYS H H 35 8.666 8.666 8.358 0.308 25259 8898 1 12 . 1 1 36 36 SER N N 36 122.222 122.222 114.638 7.584 25259 8899 1 12 . 1 1 36 36 SER HA H 36 4.753 4.753 4.589 0.164 25259 8900 1 12 . 1 1 36 36 SER CA C 36 55.328 55.328 58.185 -2.857 25259 8901 1 12 . 1 1 36 36 SER CB C 36 61.728 61.728 63.582 -1.854 25259 8902 1 12 . 1 1 36 36 SER H H 36 8.771 8.771 8.260 0.511 25259 8903 1 12 . 1 1 37 37 ASP N N 37 126.346 126.346 121.598 4.748 25259 8904 1 12 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.226 0.228 25259 8905 1 12 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.129 -2.513 25259 8906 1 12 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.055 -2.070 25259 8907 1 12 . 1 1 37 37 ASP H H 37 8.859 8.859 8.584 0.275 25259 8908 1 12 . 1 1 38 38 ASP N N 38 119.171 119.171 119.951 -0.780 25259 8909 1 12 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.776 -0.161 25259 8910 1 12 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.206 -3.418 25259 8911 1 12 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.642 -4.007 25259 8912 1 12 . 1 1 38 38 ASP H H 38 7.944 7.944 7.966 -0.022 25259 8913 1 12 . 1 1 39 39 GLY N N 39 110.352 110.352 106.007 4.345 25259 8914 1 12 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.144 -2.383 25259 8915 1 12 . 1 1 39 39 GLY H H 39 8.145 8.145 8.203 -0.058 25259 8916 1 12 . 1 1 40 40 SER N N 40 120.090 120.090 113.718 6.372 25259 8917 1 12 . 1 1 40 40 SER HA H 40 4.877 4.877 5.043 -0.166 25259 8918 1 12 . 1 1 40 40 SER CA C 40 56.525 56.525 57.252 -0.727 25259 8919 1 12 . 1 1 40 40 SER CB C 40 62.245 62.245 66.447 -4.202 25259 8920 1 12 . 1 1 40 40 SER H H 40 8.344 8.344 7.738 0.606 25259 8921 1 12 . 1 1 41 41 GLN N N 41 122.551 122.551 122.083 0.468 25259 8922 1 12 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.797 0.130 25259 8923 1 12 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.148 -0.734 25259 8924 1 12 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.347 -3.033 25259 8925 1 12 . 1 1 41 41 GLN H H 41 8.627 8.627 8.701 -0.074 25259 8926 1 12 . 1 1 42 42 GLN N N 42 131.724 131.724 118.492 13.232 25259 8927 1 12 . 1 1 42 42 GLN HA H 42 5.611 5.611 5.075 0.536 25259 8928 1 12 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.326 -2.254 25259 8929 1 12 . 1 1 42 42 GLN CB C 42 30.319 30.319 33.006 -2.687 25259 8930 1 12 . 1 1 42 42 GLN H H 42 9.189 9.189 8.636 0.553 25259 8931 1 12 . 1 1 43 43 THR N N 43 122.202 122.202 115.511 6.691 25259 8932 1 12 . 1 1 43 43 THR HA H 43 5.380 5.380 5.282 0.098 25259 8933 1 12 . 1 1 43 43 THR CA C 43 58.863 58.863 60.830 -1.967 25259 8934 1 12 . 1 1 43 43 THR CB C 43 68.893 68.893 72.063 -3.170 25259 8935 1 12 . 1 1 43 43 THR H H 43 9.139 9.139 8.513 0.626 25259 8936 1 12 . 1 1 44 44 GLN N N 44 127.190 127.190 122.667 4.523 25259 8937 1 12 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.166 0.468 25259 8938 1 12 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.796 -3.128 25259 8939 1 12 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.414 -3.504 25259 8940 1 12 . 1 1 44 44 GLN H H 44 9.760 9.760 8.584 1.176 25259 8941 1 12 . 1 1 45 45 THR N N 45 123.479 123.479 121.781 1.698 25259 8942 1 12 . 1 1 45 45 THR HA H 45 5.421 5.421 4.867 0.554 25259 8943 1 12 . 1 1 45 45 THR CA C 45 60.071 60.071 62.539 -2.468 25259 8944 1 12 . 1 1 45 45 THR CB C 45 67.541 67.541 69.778 -2.237 25259 8945 1 12 . 1 1 45 45 THR H H 45 9.518 9.518 9.132 0.386 25259 8946 1 12 . 1 1 46 46 ILE N N 46 133.908 133.908 129.326 4.582 25259 8947 1 12 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.635 0.368 25259 8948 1 12 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.708 -2.237 25259 8949 1 12 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.540 0.405 25259 8950 1 12 . 1 1 46 46 ILE H H 46 9.830 9.830 8.267 1.563 25259 8951 1 12 . 1 1 47 47 THR N N 47 124.701 124.701 124.124 0.577 25259 8952 1 12 . 1 1 47 47 THR HA H 47 6.048 6.048 4.843 1.205 25259 8953 1 12 . 1 1 47 47 THR CA C 47 58.551 58.551 62.502 -3.950 25259 8954 1 12 . 1 1 47 47 THR CB C 47 67.819 67.819 69.157 -1.338 25259 8955 1 12 . 1 1 47 47 THR H H 47 8.843 8.843 8.512 0.331 25259 8956 1 12 . 1 1 48 48 TYR N N 48 127.369 127.369 122.148 5.221 25259 8957 1 12 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.118 0.160 25259 8958 1 12 . 1 1 48 48 TYR CA C 48 53.729 53.729 55.973 -2.244 25259 8959 1 12 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.645 -2.213 25259 8960 1 12 . 1 1 48 48 TYR H H 48 9.638 9.638 8.672 0.966 25259 8961 1 12 . 1 1 49 49 LYS N N 49 122.138 122.138 119.006 3.132 25259 8962 1 12 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.561 0.095 25259 8963 1 12 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.664 -3.692 25259 8964 1 12 . 1 1 49 49 LYS CB C 49 33.603 33.603 33.850 -0.247 25259 8965 1 12 . 1 1 49 49 LYS H H 49 8.560 8.560 8.921 -0.360 25259 8966 1 12 . 1 1 50 50 ASP N N 50 130.208 130.208 121.383 8.825 25259 8967 1 12 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.859 -0.555 25259 8968 1 12 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.518 0.242 25259 8969 1 12 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.937 -5.598 25259 8970 1 12 . 1 1 50 50 ASP H H 50 9.597 9.597 8.269 1.328 25259 8971 1 12 . 1 1 51 51 LYS N N 51 124.586 124.586 118.189 6.397 25259 8972 1 12 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.411 0.120 25259 8973 1 12 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.196 -2.462 25259 8974 1 12 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.310 -3.915 25259 8975 1 12 . 1 1 51 51 LYS H H 51 8.450 8.450 8.054 0.396 25259 8976 1 12 . 1 1 52 52 THR N N 52 120.044 120.044 113.943 6.101 25259 8977 1 12 . 1 1 52 52 THR HA H 52 4.717 4.717 4.548 0.169 25259 8978 1 12 . 1 1 52 52 THR CA C 52 59.313 59.313 61.166 -1.853 25259 8979 1 12 . 1 1 52 52 THR CB C 52 68.815 68.815 71.235 -2.420 25259 8980 1 12 . 1 1 52 52 THR H H 52 8.658 8.658 7.672 0.986 25259 8981 1 12 . 1 1 53 53 PHE N N 53 128.987 128.987 123.605 5.382 25259 8982 1 12 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.448 -0.165 25259 8983 1 12 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.298 -1.309 25259 8984 1 12 . 1 1 53 53 PHE CB C 53 38.311 38.311 38.011 0.300 25259 8985 1 12 . 1 1 53 53 PHE H H 53 9.218 9.218 8.778 0.440 25259 8986 1 12 . 1 1 54 54 LEU N N 54 124.874 124.874 126.321 -1.447 25259 8987 1 12 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.317 0.612 25259 8988 1 12 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.912 -3.671 25259 8989 1 12 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.666 -2.149 25259 8990 1 12 . 1 1 54 54 LEU H H 54 9.391 9.391 8.532 0.859 25259 8991 1 12 . 1 1 55 55 SER N N 55 115.516 115.516 109.778 5.738 25259 8992 1 12 . 1 1 55 55 SER HA H 55 5.194 5.194 5.429 -0.235 25259 8993 1 12 . 1 1 55 55 SER CA C 55 55.818 55.818 56.866 -1.048 25259 8994 1 12 . 1 1 55 55 SER CB C 55 63.474 63.474 66.707 -3.233 25259 8995 1 12 . 1 1 55 55 SER H H 55 8.736 8.736 7.704 1.032 25259 8996 1 12 . 1 1 56 56 LEU N N 56 124.352 124.352 122.281 2.071 25259 8997 1 12 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.565 -0.022 25259 8998 1 12 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.187 -2.550 25259 8999 1 12 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.914 -1.401 25259 9000 1 12 . 1 1 56 56 LEU H H 56 8.328 8.328 8.726 -0.398 25259 9001 1 12 . 1 1 57 57 ALA N N 57 131.450 131.450 127.180 4.270 25259 9002 1 12 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.522 -0.017 25259 9003 1 12 . 1 1 57 57 ALA CA C 57 48.202 48.202 49.729 -1.527 25259 9004 1 12 . 1 1 57 57 ALA CB C 57 18.964 18.964 22.811 -3.847 25259 9005 1 12 . 1 1 57 57 ALA H H 57 9.208 9.208 8.931 0.277 25259 9006 1 12 . 1 1 58 58 ILE N N 58 126.248 126.248 120.835 5.413 25259 9007 1 12 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.856 -0.072 25259 9008 1 12 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.400 -2.153 25259 9009 1 12 . 1 1 58 58 ILE CB C 58 38.045 38.045 40.470 -2.425 25259 9010 1 12 . 1 1 58 58 ILE H H 58 9.597 9.597 8.991 0.606 25259 9011 1 12 . 1 1 59 59 GLN N N 59 132.065 132.065 126.542 5.523 25259 9012 1 12 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.929 0.318 25259 9013 1 12 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.688 -3.524 25259 9014 1 12 . 1 1 59 59 GLN CB C 59 29.661 29.661 31.033 -1.372 25259 9015 1 12 . 1 1 59 59 GLN H H 59 9.389 9.389 8.493 0.896 25259 9016 1 12 . 1 1 60 60 GLN N N 60 130.314 130.314 120.381 9.933 25259 9017 1 12 . 1 1 60 60 GLN HA H 60 5.209 5.209 5.060 0.149 25259 9018 1 12 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.946 -2.925 25259 9019 1 12 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.275 -3.799 25259 9020 1 12 . 1 1 60 60 GLN H H 60 9.471 9.471 9.081 0.390 25259 9021 1 12 . 1 1 61 61 LYS N N 61 131.044 131.044 124.868 6.176 25259 9022 1 12 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.247 0.168 25259 9023 1 12 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.565 -2.445 25259 9024 1 12 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.518 -4.101 25259 9025 1 12 . 1 1 61 61 LYS H H 61 8.893 8.893 9.001 -0.108 25259 9026 1 12 . 1 1 62 62 ARG N N 62 125.397 125.397 121.441 3.956 25259 9027 1 12 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.082 -0.079 25259 9028 1 12 . 1 1 62 62 ARG CA C 62 51.091 51.091 52.881 -1.790 25259 9029 1 12 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.914 -2.036 25259 9030 1 12 . 1 1 62 62 ARG H H 62 9.120 9.120 8.028 1.092 25259 9031 1 12 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.476 0.499 25259 9032 1 12 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.627 -3.130 25259 9033 1 12 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.322 -2.438 25259 9034 1 12 . 1 1 64 64 VAL N N 64 121.305 121.305 117.298 4.007 25259 9035 1 12 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.148 -0.124 25259 9036 1 12 . 1 1 64 64 VAL CA C 64 59.677 59.677 62.049 -2.372 25259 9037 1 12 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.708 -2.343 25259 9038 1 12 . 1 1 64 64 VAL H H 64 7.520 7.520 7.652 -0.132 25259 9039 1 12 . 1 1 65 65 SER N N 65 123.215 123.215 114.458 8.757 25259 9040 1 12 . 1 1 65 65 SER HA H 65 4.521 4.521 4.733 -0.212 25259 9041 1 12 . 1 1 65 65 SER CA C 65 54.897 54.897 57.297 -2.401 25259 9042 1 12 . 1 1 65 65 SER CB C 65 62.564 62.564 65.893 -3.329 25259 9043 1 12 . 1 1 65 65 SER H H 65 8.080 8.080 8.032 0.048 25259 9044 1 12 . 1 1 66 66 ASP N N 66 123.802 123.802 122.611 1.191 25259 9045 1 12 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.430 -0.001 25259 9046 1 12 . 1 1 66 66 ASP CA C 66 55.378 55.378 57.143 -1.765 25259 9047 1 12 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.956 -2.918 25259 9048 1 12 . 1 1 66 66 ASP H H 66 8.900 8.900 8.716 0.184 25259 9049 1 12 . 1 1 67 67 GLU N N 67 121.943 121.943 116.515 5.428 25259 9050 1 12 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.133 0.056 25259 9051 1 12 . 1 1 67 67 GLU CA C 67 57.440 57.440 58.247 -0.807 25259 9052 1 12 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.531 -2.746 25259 9053 1 12 . 1 1 67 67 GLU H H 67 8.717 8.717 8.527 0.190 25259 9054 1 12 . 1 1 68 68 LEU N N 68 125.458 125.458 117.879 7.579 25259 9055 1 12 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.657 -0.314 25259 9056 1 12 . 1 1 68 68 LEU CA C 68 54.472 54.472 55.092 -0.620 25259 9057 1 12 . 1 1 68 68 LEU CB C 68 39.404 39.404 43.340 -3.936 25259 9058 1 12 . 1 1 68 68 LEU H H 68 7.820 7.820 7.886 -0.066 25259 9059 1 12 . 1 1 69 69 LYS N N 69 123.868 123.868 121.697 2.171 25259 9060 1 12 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.035 -0.029 25259 9061 1 12 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.630 -2.013 25259 9062 1 12 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.873 -1.836 25259 9063 1 12 . 1 1 69 69 LYS H H 69 8.690 8.690 8.080 0.610 25259 9064 1 12 . 1 1 70 70 THR N N 70 117.109 117.109 115.141 1.968 25259 9065 1 12 . 1 1 70 70 THR HA H 70 4.088 4.088 4.006 0.082 25259 9066 1 12 . 1 1 70 70 THR CA C 70 63.879 63.879 67.007 -3.128 25259 9067 1 12 . 1 1 70 70 THR CB C 70 66.383 66.383 68.381 -1.998 25259 9068 1 12 . 1 1 70 70 THR H H 70 7.935 7.935 7.701 0.234 25259 9069 1 12 . 1 1 71 71 TYR N N 71 127.006 127.006 122.058 4.948 25259 9070 1 12 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.289 -0.084 25259 9071 1 12 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.922 -1.697 25259 9072 1 12 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.280 -1.735 25259 9073 1 12 . 1 1 71 71 TYR H H 71 7.683 7.683 7.872 -0.189 25259 9074 1 12 . 1 1 72 72 ILE N N 72 125.064 125.064 119.121 5.943 25259 9075 1 12 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.844 -0.165 25259 9076 1 12 . 1 1 72 72 ILE CA C 72 62.895 62.895 64.705 -1.810 25259 9077 1 12 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.648 -1.372 25259 9078 1 12 . 1 1 72 72 ILE H H 72 9.083 9.083 7.595 1.488 25259 9079 1 12 . 1 1 73 73 ASP N N 73 124.900 124.900 119.565 5.335 25259 9080 1 12 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.489 -0.100 25259 9081 1 12 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.635 -1.597 25259 9082 1 12 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.841 -2.734 25259 9083 1 12 . 1 1 73 73 ASP H H 73 8.751 8.751 7.759 0.992 25259 9084 1 12 . 1 1 74 74 GLN N N 74 117.025 117.025 117.935 -0.910 25259 9085 1 12 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.944 0.194 25259 9086 1 12 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.927 -3.117 25259 9087 1 12 . 1 1 74 74 GLN CB C 74 27.564 27.564 28.955 -1.391 25259 9088 1 12 . 1 1 74 74 GLN H H 74 7.447 7.447 8.070 -0.623 25259 9089 1 12 . 1 1 75 75 HIS N N 75 116.494 116.494 115.187 1.307 25259 9090 1 12 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.573 0.143 25259 9091 1 12 . 1 1 75 75 HIS CA C 75 54.066 54.066 57.019 -2.953 25259 9092 1 12 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.404 -4.102 25259 9093 1 12 . 1 1 75 75 HIS H H 75 8.402 8.402 7.976 0.426 25259 9094 1 12 . 1 1 76 76 GLY N N 76 112.564 112.564 105.526 7.038 25259 9095 1 12 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.849 -2.953 25259 9096 1 12 . 1 1 76 76 GLY H H 76 9.091 9.091 7.818 1.273 25259 9097 1 12 . 1 1 77 77 VAL N N 77 124.763 124.763 121.196 3.567 25259 9098 1 12 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.696 -0.131 25259 9099 1 12 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.894 -0.943 25259 9100 1 12 . 1 1 77 77 VAL CB C 77 29.838 29.838 31.541 -1.702 25259 9101 1 12 . 1 1 77 77 VAL H H 77 8.927 8.927 8.602 0.325 25259 9102 1 12 . 1 1 78 78 GLU N N 78 124.388 124.388 118.419 5.969 25259 9103 1 12 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.127 0.021 25259 9104 1 12 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.713 -1.397 25259 9105 1 12 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.936 -2.477 25259 9106 1 12 . 1 1 78 78 GLU H H 78 8.781 8.781 8.831 -0.050 25259 9107 1 12 . 1 1 79 79 GLU N N 79 121.887 121.887 118.749 3.138 25259 9108 1 12 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.193 -0.005 25259 9109 1 12 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.173 -2.628 25259 9110 1 12 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.502 -2.469 25259 9111 1 12 . 1 1 79 79 GLU H H 79 9.231 9.231 8.175 1.056 25259 9112 1 12 . 1 1 80 80 THR N N 80 120.781 120.781 116.996 3.785 25259 9113 1 12 . 1 1 80 80 THR HA H 80 4.059 4.059 3.867 0.192 25259 9114 1 12 . 1 1 80 80 THR CA C 80 65.487 65.487 67.097 -1.610 25259 9115 1 12 . 1 1 80 80 THR CB C 80 64.369 64.369 68.519 -4.150 25259 9116 1 12 . 1 1 80 80 THR H H 80 7.858 7.858 8.010 -0.152 25259 9117 1 12 . 1 1 81 81 GLN N N 81 125.303 125.303 120.217 5.086 25259 9118 1 12 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.967 0.077 25259 9119 1 12 . 1 1 81 81 GLN CA C 81 56.969 56.969 58.941 -1.972 25259 9120 1 12 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.178 -2.101 25259 9121 1 12 . 1 1 81 81 GLN H H 81 8.765 8.765 7.873 0.892 25259 9122 1 12 . 1 1 82 82 LYS N N 82 120.458 120.458 119.140 1.318 25259 9123 1 12 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.968 0.121 25259 9124 1 12 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.450 -1.138 25259 9125 1 12 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.486 -1.332 25259 9126 1 12 . 1 1 82 82 LYS H H 82 7.521 7.521 7.635 -0.114 25259 9127 1 12 . 1 1 83 83 ALA N N 83 125.234 125.234 121.966 3.268 25259 9128 1 12 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.924 0.293 25259 9129 1 12 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.637 -2.195 25259 9130 1 12 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.671 -2.384 25259 9131 1 12 . 1 1 83 83 ALA H H 83 7.782 7.782 7.744 0.038 25259 9132 1 12 . 1 1 84 84 LEU N N 84 123.348 123.348 119.962 3.386 25259 9133 1 12 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.858 0.200 25259 9134 1 12 . 1 1 84 84 LEU CA C 84 55.499 55.499 58.633 -3.134 25259 9135 1 12 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.395 -2.087 25259 9136 1 12 . 1 1 84 84 LEU H H 84 8.590 8.590 7.920 0.670 25259 9137 1 12 . 1 1 85 85 LEU N N 85 122.872 122.872 118.406 4.466 25259 9138 1 12 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.967 0.203 25259 9139 1 12 . 1 1 85 85 LEU CA C 85 55.396 55.396 56.790 -1.394 25259 9140 1 12 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.169 -1.429 25259 9141 1 12 . 1 1 85 85 LEU H H 85 7.892 7.892 7.520 0.372 25259 9142 1 12 . 1 1 86 86 GLU N N 86 122.713 122.713 118.750 3.963 25259 9143 1 12 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.942 0.143 25259 9144 1 12 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.217 -2.472 25259 9145 1 12 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.571 -2.668 25259 9146 1 12 . 1 1 86 86 GLU H H 86 8.124 8.124 8.398 -0.274 25259 9147 1 12 . 1 1 87 87 ALA N N 87 123.163 123.163 121.952 1.211 25259 9148 1 12 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.040 0.101 25259 9149 1 12 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.885 -2.617 25259 9150 1 12 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.556 -2.924 25259 9151 1 12 . 1 1 87 87 ALA H H 87 7.765 7.765 7.377 0.388 25259 9152 1 12 . 1 1 88 88 GLU N N 88 121.945 121.945 117.466 4.479 25259 9153 1 12 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.120 -0.036 25259 9154 1 12 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.355 -1.421 25259 9155 1 12 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.313 -1.286 25259 9156 1 12 . 1 1 88 88 GLU H H 88 7.846 7.846 7.696 0.150 25259 9157 1 12 . 1 1 89 89 GLU N N 89 117.978 117.978 119.973 -1.995 25259 9158 1 12 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.027 0.066 25259 9159 1 12 . 1 1 89 89 GLU CA C 89 55.214 55.214 59.566 -4.352 25259 9160 1 12 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.055 -1.648 25259 9161 1 12 . 1 1 89 89 GLU H H 89 7.634 7.634 8.427 -0.793 25259 9162 1 12 . 1 1 90 90 LYS N N 90 117.519 117.519 115.564 1.955 25259 9163 1 12 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.272 0.159 25259 9164 1 12 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.863 -2.845 25259 9165 1 12 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.164 -1.133 25259 9166 1 12 . 1 1 90 90 LYS H H 90 7.247 7.247 7.641 -0.394 25259 9167 1 12 . 1 1 91 91 ASP N N 91 124.888 124.888 123.952 0.936 25259 9168 1 12 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.614 0.069 25259 9169 1 12 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.381 -3.182 25259 9170 1 12 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.128 -2.547 25259 9171 1 12 . 1 1 91 91 ASP H H 91 7.370 7.370 7.470 -0.100 25259 9172 1 12 . 1 1 92 92 LYS N N 92 129.311 129.311 128.701 0.610 25259 9173 1 12 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.928 0.085 25259 9174 1 12 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.661 -2.445 25259 9175 1 12 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.553 -2.538 25259 9176 1 12 . 1 1 92 92 LYS H H 92 8.795 8.795 8.794 0.001 25259 9177 1 12 . 1 1 93 93 SER N N 93 118.112 118.112 113.507 4.605 25259 9178 1 12 . 1 1 93 93 SER HA H 93 4.439 4.439 4.457 -0.018 25259 9179 1 12 . 1 1 93 93 SER CA C 93 58.945 58.945 60.770 -1.825 25259 9180 1 12 . 1 1 93 93 SER CB C 93 60.278 60.278 63.391 -3.113 25259 9181 1 12 . 1 1 93 93 SER H H 93 8.488 8.488 8.450 0.038 25259 9182 1 12 . 1 1 94 94 ILE N N 94 128.950 128.950 121.867 7.083 25259 9183 1 12 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.801 -0.319 25259 9184 1 12 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.029 -1.680 25259 9185 1 12 . 1 1 94 94 ILE CB C 94 34.753 34.753 38.684 -3.931 25259 9186 1 12 . 1 1 94 94 ILE H H 94 7.722 7.722 7.455 0.267 25259 9187 1 12 . 1 1 95 95 ILE N N 95 123.598 123.598 121.656 1.942 25259 9188 1 12 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.457 0.138 25259 9189 1 12 . 1 1 95 95 ILE CA C 95 62.747 62.747 66.248 -3.501 25259 9190 1 12 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.639 -1.667 25259 9191 1 12 . 1 1 95 95 ILE H H 95 8.378 8.378 8.545 -0.167 25259 9192 1 12 . 1 1 96 96 GLU N N 96 118.317 118.317 118.370 -0.053 25259 9193 1 12 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.911 0.073 25259 9194 1 12 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.071 -2.576 25259 9195 1 12 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.133 -1.960 25259 9196 1 12 . 1 1 96 96 GLU H H 96 7.680 7.680 8.285 -0.605 25259 9197 1 12 . 1 1 97 97 ALA N N 97 124.797 124.797 121.128 3.669 25259 9198 1 12 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.981 -0.156 25259 9199 1 12 . 1 1 97 97 ALA CA C 97 52.297 52.297 53.423 -1.126 25259 9200 1 12 . 1 1 97 97 ALA CB C 97 14.989 14.989 18.548 -3.559 25259 9201 1 12 . 1 1 97 97 ALA H H 97 7.383 7.383 7.342 0.041 25259 9202 1 12 . 1 1 98 98 ARG N N 98 115.469 115.469 117.150 -1.681 25259 9203 1 12 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.265 0.041 25259 9204 1 12 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.448 -1.958 25259 9205 1 12 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.983 -1.745 25259 9206 1 12 . 1 1 98 98 ARG H H 98 8.229 8.229 8.122 0.107 25259 9207 1 12 . 1 1 99 99 LYS N N 99 120.219 120.219 117.532 2.687 25259 9208 1 12 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.146 0.112 25259 9209 1 12 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.298 -2.057 25259 9210 1 12 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.489 -1.992 25259 9211 1 12 . 1 1 99 99 LYS H H 99 7.270 7.270 7.468 -0.198 25259 9212 1 12 . 1 1 100 100 LEU N N 100 123.800 123.800 118.881 4.919 25259 9213 1 12 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.216 0.125 25259 9214 1 12 . 1 1 100 100 LEU CA C 100 52.079 52.079 55.550 -3.471 25259 9215 1 12 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.068 -2.937 25259 9216 1 12 . 1 1 100 100 LEU H H 100 7.837 7.837 7.574 0.263 25259 9217 1 12 . 1 1 101 101 ALA N N 101 130.512 130.512 122.526 7.986 25259 9218 1 12 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.549 -0.173 25259 9219 1 12 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.431 -2.027 25259 9220 1 12 . 1 1 101 101 ALA CB C 101 15.796 15.796 19.395 -3.599 25259 9221 1 12 . 1 1 101 101 ALA H H 101 8.213 8.213 8.882 -0.669 25259 9222 1 12 . 1 1 102 102 GLY N N 102 110.659 110.659 105.876 4.783 25259 9223 1 12 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.266 -1.373 25259 9224 1 12 . 1 1 102 102 GLY H H 102 8.738 8.738 8.226 0.512 25259 9225 1 12 . 1 1 103 103 PHE N N 103 123.097 123.097 121.222 1.875 25259 9226 1 12 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.313 -0.093 25259 9227 1 12 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.336 -2.568 25259 9228 1 12 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.630 -2.057 25259 9229 1 12 . 1 1 103 103 PHE H H 103 7.514 7.514 7.755 -0.241 25259 9230 1 12 . 1 1 104 104 LYS N N 104 130.652 130.652 126.281 4.371 25259 9231 1 12 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.307 -0.187 25259 9232 1 12 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.773 -1.794 25259 9233 1 12 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.889 -2.652 25259 9234 1 12 . 1 1 104 104 LYS H H 104 7.473 7.473 7.750 -0.277 25259 9235 1 12 . 1 1 105 105 LEU N N 105 127.372 127.372 123.202 4.170 25259 9236 1 12 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.009 -0.013 25259 9237 1 12 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.371 -1.635 25259 9238 1 12 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.255 -1.291 25259 9239 1 12 . 1 1 105 105 LEU H H 105 8.393 8.393 8.326 0.067 25259 9240 1 12 . 1 1 106 106 GLU N N 106 129.358 129.358 125.959 3.399 25259 9241 1 12 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.748 0.096 25259 9242 1 12 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.885 -2.095 25259 9243 1 12 . 1 1 106 106 GLU CB C 106 31.628 31.628 34.179 -2.551 25259 9244 1 12 . 1 1 106 106 GLU H H 106 8.849 8.849 8.951 -0.102 25259 9245 1 12 . 1 1 107 107 THR N N 107 131.118 131.118 116.719 14.399 25259 9246 1 12 . 1 1 107 107 THR HA H 107 5.110 5.110 5.140 -0.030 25259 9247 1 12 . 1 1 107 107 THR CA C 107 59.832 59.832 60.767 -0.935 25259 9248 1 12 . 1 1 107 107 THR CB C 107 66.671 66.671 71.435 -4.764 25259 9249 1 12 . 1 1 107 107 THR H H 107 9.433 9.433 8.350 1.083 25259 9250 1 12 . 1 1 108 108 LYS N N 108 129.114 129.114 122.501 6.613 25259 9251 1 12 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.711 0.113 25259 9252 1 12 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.518 -3.324 25259 9253 1 12 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.967 -1.579 25259 9254 1 12 . 1 1 108 108 LYS H H 108 9.410 9.410 9.073 0.337 25259 9255 1 12 . 1 1 109 109 LEU N N 109 129.323 129.323 126.227 3.096 25259 9256 1 12 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.651 0.053 25259 9257 1 12 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.351 -2.243 25259 9258 1 12 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.344 -2.689 25259 9259 1 12 . 1 1 109 109 LEU H H 109 8.862 8.862 8.716 0.146 25259 9260 1 12 . 1 1 110 110 LEU N N 110 129.123 129.123 126.679 2.444 25259 9261 1 12 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.155 0.068 25259 9262 1 12 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.637 -2.855 25259 9263 1 12 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.218 -1.557 25259 9264 1 12 . 1 1 110 110 LEU H H 110 8.373 8.373 8.137 0.236 25259 9265 1 12 . 1 1 111 111 SER N N 111 114.587 114.587 111.388 3.199 25259 9266 1 12 . 1 1 111 111 SER HA H 111 4.557 4.557 4.630 -0.073 25259 9267 1 12 . 1 1 111 111 SER CA C 111 53.889 53.889 57.379 -3.490 25259 9268 1 12 . 1 1 111 111 SER CB C 111 61.830 61.830 64.722 -2.892 25259 9269 1 12 . 1 1 111 111 SER H H 111 8.400 8.400 7.714 0.686 25259 9270 1 12 . 1 1 112 112 ALA N N 112 118.269 118.269 122.684 -4.415 25259 9271 1 12 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.362 -0.053 25259 9272 1 12 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.139 -2.925 25259 9273 1 12 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.527 -1.939 25259 9274 1 12 . 1 1 112 112 ALA H H 112 8.556 8.556 8.577 -0.021 25259 9275 1 12 . 1 1 113 113 THR N N 113 102.878 102.878 103.018 -0.140 25259 9276 1 12 . 1 1 113 113 THR HA H 113 4.662 4.662 4.438 0.224 25259 9277 1 12 . 1 1 113 113 THR CA C 113 58.689 58.689 62.057 -3.368 25259 9278 1 12 . 1 1 113 113 THR CB C 113 67.905 67.905 69.508 -1.603 25259 9279 1 12 . 1 1 113 113 THR H H 113 8.065 8.065 7.718 0.347 25259 9280 1 12 . 1 1 114 114 GLU N N 114 126.514 126.514 120.372 6.142 25259 9281 1 12 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.795 0.219 25259 9282 1 12 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.190 -2.183 25259 9283 1 12 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.240 -1.327 25259 9284 1 12 . 1 1 114 114 GLU H H 114 7.357 7.357 7.509 -0.152 25259 9285 1 12 . 1 1 115 115 LEU N N 115 128.058 128.058 116.835 11.223 25259 9286 1 12 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.279 -0.357 25259 9287 1 12 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.301 -1.977 25259 9288 1 12 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.211 -2.072 25259 9289 1 12 . 1 1 115 115 LEU H H 115 8.930 8.930 8.098 0.832 25259 9290 1 12 . 1 1 116 116 GLN N N 116 126.540 126.540 119.193 7.347 25259 9291 1 12 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.231 0.484 25259 9292 1 12 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.362 -2.662 25259 9293 1 12 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.414 -1.122 25259 9294 1 12 . 1 1 116 116 GLN H H 116 9.221 9.221 8.986 0.235 25259 9295 1 12 . 1 1 117 117 THR N N 117 125.213 125.213 121.209 4.004 25259 9296 1 12 . 1 1 117 117 THR HA H 117 5.353 5.353 5.235 0.118 25259 9297 1 12 . 1 1 117 117 THR CA C 117 58.926 58.926 60.780 -1.854 25259 9298 1 12 . 1 1 117 117 THR CB C 117 68.948 68.948 72.041 -3.093 25259 9299 1 12 . 1 1 117 117 THR H H 117 9.030 9.030 8.848 0.182 25259 9300 1 12 . 1 1 118 118 THR N N 118 127.799 127.799 119.340 8.459 25259 9301 1 12 . 1 1 118 118 THR HA H 118 5.527 5.527 5.129 0.398 25259 9302 1 12 . 1 1 118 118 THR CA C 118 59.201 59.201 62.075 -2.874 25259 9303 1 12 . 1 1 118 118 THR CB C 118 67.721 67.721 72.229 -4.508 25259 9304 1 12 . 1 1 118 118 THR H H 118 9.459 9.459 8.933 0.526 25259 9305 1 12 . 1 1 119 119 THR N N 119 129.258 129.258 122.330 6.928 25259 9306 1 12 . 1 1 119 119 THR HA H 119 4.885 4.885 4.913 -0.028 25259 9307 1 12 . 1 1 119 119 THR CA C 119 58.463 58.463 60.970 -2.507 25259 9308 1 12 . 1 1 119 119 THR CB C 119 67.459 67.459 70.756 -3.297 25259 9309 1 12 . 1 1 119 119 THR H H 119 9.147 9.147 8.785 0.362 25259 9310 1 12 . 1 1 120 120 SER N N 120 123.389 123.389 117.768 5.621 25259 9311 1 12 . 1 1 120 120 SER HA H 120 5.328 5.328 5.302 0.026 25259 9312 1 12 . 1 1 120 120 SER CA C 120 54.386 54.386 55.700 -1.314 25259 9313 1 12 . 1 1 120 120 SER CB C 120 63.031 63.031 65.148 -2.117 25259 9314 1 12 . 1 1 120 120 SER H H 120 8.786 8.786 8.467 0.319 25259 9315 1 12 . 1 1 121 121 PHE N N 121 121.245 121.245 120.604 0.641 25259 9316 1 12 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.923 0.189 25259 9317 1 12 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.676 -3.484 25259 9318 1 12 . 1 1 121 121 PHE CB C 121 40.265 40.265 41.966 -1.701 25259 9319 1 12 . 1 1 121 121 PHE H H 121 8.831 8.831 8.962 -0.131 25259 9320 1 12 . 1 1 122 122 ASP N N 122 124.765 124.765 125.724 -0.959 25259 9321 1 12 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.963 -0.123 25259 9322 1 12 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.681 -3.844 25259 9323 1 12 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.841 -2.356 25259 9324 1 12 . 1 1 122 122 ASP H H 122 8.819 8.819 8.932 -0.113 25259 9325 1 12 . 1 1 123 123 PHE N N 123 124.303 124.303 122.820 1.483 25259 9326 1 12 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.301 0.373 25259 9327 1 12 . 1 1 123 123 PHE CA C 123 57.798 57.798 61.220 -3.422 25259 9328 1 12 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.818 -3.278 25259 9329 1 12 . 1 1 123 123 PHE H H 123 8.262 8.262 8.125 0.137 25259 9330 1 12 . 1 1 124 124 GLN N N 124 120.792 120.792 117.010 3.782 25259 9331 1 12 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.236 0.198 25259 9332 1 12 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.352 -2.269 25259 9333 1 12 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.086 -1.957 25259 9334 1 12 . 1 1 124 124 GLN H H 124 8.954 8.954 8.541 0.413 25259 9335 1 12 . 1 1 125 125 VAL N N 125 114.091 114.091 110.935 3.156 25259 9336 1 12 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.416 -0.007 25259 9337 1 12 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.515 -3.217 25259 9338 1 12 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.876 -1.304 25259 9339 1 12 . 1 1 125 125 VAL H H 125 7.026 7.026 7.917 -0.891 25259 9340 1 12 . 1 1 126 126 LEU N N 126 125.158 125.158 123.718 1.440 25259 9341 1 12 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.335 0.140 25259 9342 1 12 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.639 -2.464 25259 9343 1 12 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.156 -1.102 25259 9344 1 12 . 1 1 126 126 LEU H H 126 8.106 8.106 7.914 0.192 25259 9345 1 12 . 1 1 127 127 ASP N N 127 130.026 130.026 127.623 2.403 25259 9346 1 12 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.688 0.153 25259 9347 1 12 . 1 1 127 127 ASP CA C 127 50.198 50.198 54.982 -4.784 25259 9348 1 12 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.556 -1.867 25259 9349 1 12 . 1 1 127 127 ASP H H 127 9.129 9.129 8.589 0.540 25259 9350 1 12 . 1 1 128 128 VAL N N 128 128.833 128.833 124.199 4.634 25259 9351 1 12 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.722 -0.198 25259 9352 1 12 . 1 1 128 128 VAL CA C 128 63.668 63.668 65.943 -2.275 25259 9353 1 12 . 1 1 128 128 VAL CB C 128 29.495 29.495 32.261 -2.766 25259 9354 1 12 . 1 1 128 128 VAL H H 128 8.288 8.288 7.657 0.631 25259 9355 1 12 . 1 1 129 129 LYS N N 129 123.914 123.914 118.256 5.658 25259 9356 1 12 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.202 -0.159 25259 9357 1 12 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.595 -1.806 25259 9358 1 12 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.756 -2.819 25259 9359 1 12 . 1 1 129 129 LYS H H 129 8.226 8.226 8.301 -0.075 25259 9360 1 12 . 1 1 130 130 LYS N N 130 121.888 121.888 118.014 3.874 25259 9361 1 12 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.195 -0.110 25259 9362 1 12 . 1 1 130 130 LYS CA C 130 56.146 56.146 58.382 -2.236 25259 9363 1 12 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.066 -2.726 25259 9364 1 12 . 1 1 130 130 LYS H H 130 7.590 7.590 7.570 0.020 25259 9365 1 12 . 1 1 131 131 ALA N N 131 123.088 123.088 123.531 -0.443 25259 9366 1 12 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.045 -0.118 25259 9367 1 12 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.319 -2.917 25259 9368 1 12 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.115 -1.668 25259 9369 1 12 . 1 1 131 131 ALA H H 131 8.506 8.506 8.441 0.065 25259 9370 1 12 . 1 1 132 132 SER N N 132 110.456 110.456 111.658 -1.202 25259 9371 1 12 . 1 1 132 132 SER HA H 132 4.117 4.117 4.234 -0.117 25259 9372 1 12 . 1 1 132 132 SER CA C 132 58.289 58.289 61.041 -2.752 25259 9373 1 12 . 1 1 132 132 SER CB C 132 61.034 61.034 63.320 -2.286 25259 9374 1 12 . 1 1 132 132 SER H H 132 7.986 7.986 7.874 0.112 25259 9375 1 12 . 1 1 133 133 GLN N N 133 119.034 119.034 116.122 2.912 25259 9376 1 12 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.538 -0.136 25259 9377 1 12 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.664 -2.139 25259 9378 1 12 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.810 -2.576 25259 9379 1 12 . 1 1 133 133 GLN H H 133 7.233 7.233 7.645 -0.412 25259 9380 1 12 . 1 1 134 134 LEU N N 134 123.291 123.291 121.941 1.350 25259 9381 1 12 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.458 -0.065 25259 9382 1 12 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.447 -2.131 25259 9383 1 12 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.795 -3.948 25259 9384 1 12 . 1 1 134 134 LEU H H 134 7.411 7.411 7.579 -0.168 25259 9385 1 12 . 1 1 135 135 GLU N N 135 128.446 128.446 122.668 5.778 25259 9386 1 12 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.912 0.034 25259 9387 1 12 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.568 -2.184 25259 9388 1 12 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.802 -2.506 25259 9389 1 12 . 1 1 135 135 GLU H H 135 8.986 8.986 8.964 0.022 25259 9390 1 12 . 1 1 136 136 HIS N N 136 117.593 117.593 117.137 0.456 25259 9391 1 12 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.381 0.002 25259 9392 1 12 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.566 -1.881 25259 9393 1 12 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.914 -1.501 25259 9394 1 12 . 1 1 136 136 HIS H H 136 9.226 9.226 8.177 1.049 25259 9395 1 12 . 1 1 137 137 LEU N N 137 115.463 115.463 116.796 -1.333 25259 9396 1 12 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.675 -0.168 25259 9397 1 12 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.465 -2.517 25259 9398 1 12 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.685 -2.878 25259 9399 1 12 . 1 1 137 137 LEU H H 137 7.090 7.090 7.629 -0.539 25259 9400 1 12 . 1 1 138 138 LYS N N 138 124.686 124.686 121.590 3.096 25259 9401 1 12 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.018 0.151 25259 9402 1 12 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.833 -1.675 25259 9403 1 12 . 1 1 138 138 LYS CB C 138 30.088 30.088 31.664 -1.576 25259 9404 1 12 . 1 1 138 138 LYS H H 138 7.698 7.698 8.060 -0.362 25259 9405 1 12 . 1 1 139 139 ASN N N 139 118.077 118.077 115.480 2.597 25259 9406 1 12 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.624 0.049 25259 9407 1 12 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.687 -1.905 25259 9408 1 12 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.634 -2.817 25259 9409 1 12 . 1 1 139 139 ASN H H 139 8.485 8.485 8.646 -0.161 25259 9410 1 12 . 1 1 140 140 ILE N N 140 120.880 120.880 116.881 3.999 25259 9411 1 12 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.355 -0.325 25259 9412 1 12 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.149 -0.583 25259 9413 1 12 . 1 1 140 140 ILE CB C 140 35.774 35.774 40.808 -5.034 25259 9414 1 12 . 1 1 140 140 ILE H H 140 7.549 7.549 7.392 0.157 25259 9415 1 12 . 1 1 141 141 GLY N N 141 110.676 110.676 110.483 0.193 25259 9416 1 12 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.172 0.492 25259 9417 1 12 . 1 1 141 141 GLY H H 141 7.663 7.663 8.222 -0.559 25259 9418 1 12 . 1 1 142 142 LEU N N 142 123.857 123.857 126.094 -2.237 25259 9419 1 12 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.862 -0.169 25259 9420 1 12 . 1 1 142 142 LEU CA C 142 55.193 55.193 56.884 -1.691 25259 9421 1 12 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.492 -0.883 25259 9422 1 12 . 1 1 142 142 LEU H H 142 8.496 8.496 8.166 0.330 25259 9423 1 12 . 1 1 143 143 GLU N N 143 118.407 118.407 119.171 -0.764 25259 9424 1 12 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.885 -0.099 25259 9425 1 12 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.301 -2.079 25259 9426 1 12 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.144 -2.631 25259 9427 1 12 . 1 1 143 143 GLU H H 143 8.672 8.672 8.061 0.611 25259 9428 1 12 . 1 1 144 144 ASN N N 144 118.477 118.477 117.423 1.054 25259 9429 1 12 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.450 -0.008 25259 9430 1 12 . 1 1 144 144 ASN CA C 144 52.712 52.712 55.834 -3.122 25259 9431 1 12 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.573 -2.618 25259 9432 1 12 . 1 1 144 144 ASN H H 144 7.656 7.656 8.160 -0.504 25259 9433 1 12 . 1 1 145 145 LEU N N 145 125.354 125.354 121.765 3.589 25259 9434 1 12 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.677 0.120 25259 9435 1 12 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.759 -1.436 25259 9436 1 12 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.704 -2.131 25259 9437 1 12 . 1 1 145 145 LEU H H 145 7.758 7.758 7.931 -0.173 25259 9438 1 12 . 1 1 146 146 LEU N N 146 116.372 116.372 114.008 2.364 25259 9439 1 12 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.456 0.420 25259 9440 1 12 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.589 -2.346 25259 9441 1 12 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.197 -2.300 25259 9442 1 12 . 1 1 146 146 LEU H H 146 7.242 7.242 7.117 0.125 25259 9443 1 12 . 1 1 147 147 LYS N N 147 120.054 120.054 119.927 0.127 25259 9444 1 12 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.162 0.150 25259 9445 1 12 . 1 1 147 147 LYS CA C 147 54.623 54.623 56.159 -1.536 25259 9446 1 12 . 1 1 147 147 LYS CB C 147 30.260 30.260 30.788 -0.528 25259 9447 1 12 . 1 1 147 147 LYS H H 147 7.185 7.185 7.425 -0.240 25259 9448 1 12 . 1 1 148 148 ASN N N 148 119.498 119.498 116.362 3.136 25259 9449 1 12 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.763 0.199 25259 9450 1 12 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.957 -2.183 25259 9451 1 12 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.324 -0.838 25259 9452 1 12 . 1 1 148 148 ASN H H 148 7.698 7.698 7.815 -0.117 25259 9453 1 12 . 1 1 149 149 GLU N N 149 122.834 122.834 118.063 4.771 25259 9454 1 12 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.504 0.097 25259 9455 1 12 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.508 -2.289 25259 9456 1 12 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.091 -2.281 25259 9457 1 12 . 1 1 149 149 GLU H H 149 8.767 8.767 8.726 0.041 25259 9458 1 12 . 1 1 150 150 PRO HA H 150 3.608 3.608 3.377 0.231 25259 9459 1 12 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.251 -1.009 25259 9460 1 12 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.293 -3.198 25259 9461 1 12 . 1 1 151 151 SER N N 151 112.839 112.839 110.055 2.784 25259 9462 1 12 . 1 1 151 151 SER HA H 151 3.835 3.835 4.543 -0.708 25259 9463 1 12 . 1 1 151 151 SER CA C 151 59.270 59.270 57.987 1.283 25259 9464 1 12 . 1 1 151 151 SER CB C 151 59.451 59.451 63.848 -4.397 25259 9465 1 12 . 1 1 151 151 SER H H 151 8.519 8.519 7.756 0.763 25259 9466 1 12 . 1 1 152 152 LYS N N 152 126.710 126.710 124.943 1.767 25259 9467 1 12 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.047 0.201 25259 9468 1 12 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.398 -3.634 25259 9469 1 12 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.649 -2.392 25259 9470 1 12 . 1 1 152 152 LYS H H 152 7.006 7.006 7.660 -0.654 25259 9471 1 12 . 1 1 153 153 TYR N N 153 123.239 123.239 117.648 5.591 25259 9472 1 12 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.396 -0.138 25259 9473 1 12 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.565 0.744 25259 9474 1 12 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.351 -1.017 25259 9475 1 12 . 1 1 153 153 TYR H H 153 8.058 8.058 9.157 -1.099 25259 9476 1 12 . 1 1 154 154 ILE N N 154 120.253 120.253 121.062 -0.809 25259 9477 1 12 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.367 0.006 25259 9478 1 12 . 1 1 154 154 ILE CA C 154 63.114 63.114 64.976 -1.862 25259 9479 1 12 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.074 -1.126 25259 9480 1 12 . 1 1 154 154 ILE H H 154 8.193 8.193 8.027 0.166 25259 9481 1 12 . 1 1 155 155 SER N N 155 117.178 117.178 114.141 3.037 25259 9482 1 12 . 1 1 155 155 SER HA H 155 4.091 4.091 4.138 -0.047 25259 9483 1 12 . 1 1 155 155 SER CA C 155 59.961 59.961 61.834 -1.873 25259 9484 1 12 . 1 1 155 155 SER CB C 155 60.148 60.148 62.762 -2.614 25259 9485 1 12 . 1 1 155 155 SER H H 155 8.020 8.020 7.898 0.122 25259 9486 1 12 . 1 1 156 156 ASP N N 156 125.479 125.479 119.798 5.681 25259 9487 1 12 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.560 -0.133 25259 9488 1 12 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.575 -1.815 25259 9489 1 12 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.149 -3.276 25259 9490 1 12 . 1 1 156 156 ASP H H 156 8.638 8.638 7.481 1.157 25259 9491 1 12 . 1 1 157 157 ARG N N 157 121.542 121.542 119.883 1.659 25259 9492 1 12 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.997 0.114 25259 9493 1 12 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.357 -2.429 25259 9494 1 12 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.730 -1.914 25259 9495 1 12 . 1 1 157 157 ARG H H 157 7.888 7.888 7.586 0.302 25259 9496 1 12 . 1 1 158 158 LEU N N 158 124.257 124.257 119.648 4.609 25259 9497 1 12 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.186 0.085 25259 9498 1 12 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.348 -3.135 25259 9499 1 12 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.477 -2.531 25259 9500 1 12 . 1 1 158 158 LEU H H 158 8.442 8.442 7.684 0.758 25259 9501 1 12 . 1 1 159 159 ALA N N 159 124.146 124.146 120.859 3.287 25259 9502 1 12 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.093 0.239 25259 9503 1 12 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.587 -3.155 25259 9504 1 12 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.094 -2.187 25259 9505 1 12 . 1 1 159 159 ALA H H 159 8.086 8.086 7.786 0.300 25259 9506 1 12 . 1 1 160 160 ASN N N 160 118.093 118.093 115.585 2.508 25259 9507 1 12 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.746 0.246 25259 9508 1 12 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.148 -2.571 25259 9509 1 12 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.453 -1.720 25259 9510 1 12 . 1 1 160 160 ASN H H 160 7.445 7.445 7.832 -0.387 25259 9511 1 12 . 1 1 161 161 GLY N N 161 108.365 108.365 107.193 1.172 25259 9512 1 12 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.885 -1.239 25259 9513 1 12 . 1 1 161 161 GLY H H 161 7.743 7.743 8.177 -0.434 25259 9514 1 12 . 1 1 162 162 ALA N N 162 123.928 123.928 122.330 1.598 25259 9515 1 12 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.874 -0.001 25259 9516 1 12 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.633 -2.107 25259 9517 1 12 . 1 1 162 162 ALA CB C 162 18.060 18.060 20.624 -2.564 25259 9518 1 12 . 1 1 162 162 ALA H H 162 8.035 8.035 7.442 0.593 25259 9519 1 12 . 1 1 163 163 THR N N 163 113.286 113.286 112.527 0.759 25259 9520 1 12 . 1 1 163 163 THR HA H 163 4.703 4.703 4.668 0.035 25259 9521 1 12 . 1 1 163 163 THR CA C 163 57.791 57.791 60.755 -2.964 25259 9522 1 12 . 1 1 163 163 THR CB C 163 68.974 68.974 71.475 -2.501 25259 9523 1 12 . 1 1 163 163 THR H H 163 8.451 8.451 8.261 0.190 25259 9524 1 12 . 1 1 164 164 GLU N N 164 125.905 125.905 121.100 4.805 25259 9525 1 12 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.746 0.314 25259 9526 1 12 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.405 -1.820 25259 9527 1 12 . 1 1 164 164 GLU CB C 164 29.211 29.211 31.334 -2.123 25259 9528 1 12 . 1 1 164 164 GLU H H 164 8.716 8.716 8.543 0.173 25259 9529 1 13 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.204 -0.529 25259 9530 1 13 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.816 -2.008 25259 9531 1 13 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.451 -3.381 25259 9532 1 13 . 1 1 3 3 ALA N N 3 126.741 126.741 122.288 4.453 25259 9533 1 13 . 1 1 3 3 ALA HA H 3 4.494 4.494 5.106 -0.612 25259 9534 1 13 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.474 -1.272 25259 9535 1 13 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.259 -4.441 25259 9536 1 13 . 1 1 3 3 ALA H H 3 8.440 8.440 8.863 -0.423 25259 9537 1 13 . 1 1 4 4 THR N N 4 116.015 116.015 113.183 2.832 25259 9538 1 13 . 1 1 4 4 THR HA H 4 4.393 4.393 4.567 -0.174 25259 9539 1 13 . 1 1 4 4 THR CA C 4 59.148 59.148 61.615 -2.467 25259 9540 1 13 . 1 1 4 4 THR CB C 4 67.580 67.580 70.021 -2.441 25259 9541 1 13 . 1 1 4 4 THR H H 4 8.050 8.050 8.001 0.049 25259 9542 1 13 . 1 1 5 5 LYS N N 5 126.350 126.350 123.532 2.818 25259 9543 1 13 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.731 -0.226 25259 9544 1 13 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.756 -1.839 25259 9545 1 13 . 1 1 5 5 LYS CB C 5 30.684 30.684 33.321 -2.637 25259 9546 1 13 . 1 1 5 5 LYS H H 5 8.332 8.332 8.482 -0.150 25259 9547 1 13 . 1 1 6 6 THR N N 6 118.124 118.124 113.180 4.944 25259 9548 1 13 . 1 1 6 6 THR HA H 6 4.440 4.440 4.575 -0.135 25259 9549 1 13 . 1 1 6 6 THR CA C 6 59.282 59.282 61.231 -1.949 25259 9550 1 13 . 1 1 6 6 THR CB C 6 67.685 67.685 70.344 -2.659 25259 9551 1 13 . 1 1 6 6 THR H H 6 8.283 8.283 8.009 0.274 25259 9552 1 13 . 1 1 7 7 GLU N N 7 125.934 125.934 120.845 5.089 25259 9553 1 13 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.759 -0.415 25259 9554 1 13 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.571 -1.390 25259 9555 1 13 . 1 1 7 7 GLU CB C 7 27.816 27.816 30.899 -3.083 25259 9556 1 13 . 1 1 7 7 GLU H H 7 8.487 8.487 8.454 0.033 25259 9557 1 13 . 1 1 8 8 LYS N N 8 123.945 123.945 120.285 3.660 25259 9558 1 13 . 1 1 8 8 LYS CA C 8 53.935 53.935 56.109 -2.174 25259 9559 1 13 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.168 -3.603 25259 9560 1 13 . 1 1 8 8 LYS H H 8 8.278 8.278 8.414 -0.136 25259 9561 1 13 . 1 1 9 9 ASP N N 9 123.624 123.624 122.286 1.338 25259 9562 1 13 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.888 -0.549 25259 9563 1 13 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.496 -1.373 25259 9564 1 13 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.226 -3.293 25259 9565 1 13 . 1 1 9 9 ASP H H 9 8.277 8.277 8.444 -0.167 25259 9566 1 13 . 1 1 10 10 THR N N 10 116.812 116.812 112.964 3.848 25259 9567 1 13 . 1 1 10 10 THR HA H 10 4.349 4.349 4.643 -0.294 25259 9568 1 13 . 1 1 10 10 THR CA C 10 59.634 59.634 61.624 -1.990 25259 9569 1 13 . 1 1 10 10 THR CB C 10 67.254 67.254 69.176 -1.922 25259 9570 1 13 . 1 1 10 10 THR H H 10 8.049 8.049 8.293 -0.244 25259 9571 1 13 . 1 1 11 11 LEU N N 11 126.610 126.610 123.076 3.534 25259 9572 1 13 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.820 -0.428 25259 9573 1 13 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.386 -1.308 25259 9574 1 13 . 1 1 11 11 LEU CB C 11 39.633 39.633 44.017 -4.384 25259 9575 1 13 . 1 1 11 11 LEU H H 11 8.191 8.191 8.000 0.191 25259 9576 1 13 . 1 1 12 12 GLN N N 12 123.274 123.274 123.566 -0.292 25259 9577 1 13 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.679 -0.297 25259 9578 1 13 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.665 -2.091 25259 9579 1 13 . 1 1 12 12 GLN CB C 12 26.803 26.803 29.593 -2.790 25259 9580 1 13 . 1 1 12 12 GLN H H 12 8.280 8.280 8.638 -0.358 25259 9581 1 13 . 1 1 13 13 SER N N 13 119.027 119.027 118.056 0.971 25259 9582 1 13 . 1 1 13 13 SER HA H 13 4.471 4.471 4.666 -0.195 25259 9583 1 13 . 1 1 13 13 SER CA C 13 55.869 55.869 57.589 -1.720 25259 9584 1 13 . 1 1 13 13 SER CB C 13 61.424 61.424 64.028 -2.604 25259 9585 1 13 . 1 1 13 13 SER H H 13 8.178 8.178 8.224 -0.046 25259 9586 1 13 . 1 1 14 14 ALA N N 14 128.314 128.314 123.181 5.133 25259 9587 1 13 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.426 0.008 25259 9588 1 13 . 1 1 14 14 ALA CA C 14 49.696 49.696 52.479 -2.783 25259 9589 1 13 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.379 -2.298 25259 9590 1 13 . 1 1 14 14 ALA H H 14 8.195 8.195 8.482 -0.287 25259 9591 1 13 . 1 1 15 15 LEU N N 15 125.175 125.175 120.671 4.504 25259 9592 1 13 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.606 0.034 25259 9593 1 13 . 1 1 15 15 LEU CA C 15 50.604 50.604 52.880 -2.276 25259 9594 1 13 . 1 1 15 15 LEU CB C 15 39.467 39.467 43.383 -3.916 25259 9595 1 13 . 1 1 15 15 LEU H H 15 8.050 8.050 8.094 -0.044 25259 9596 1 13 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.585 -0.081 25259 9597 1 13 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.576 -1.945 25259 9598 1 13 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.095 -2.437 25259 9599 1 13 . 1 1 17 17 VAL N N 17 123.223 123.223 118.110 5.113 25259 9600 1 13 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.239 -0.105 25259 9601 1 13 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.345 -1.518 25259 9602 1 13 . 1 1 17 17 VAL CB C 17 30.377 30.377 32.248 -1.871 25259 9603 1 13 . 1 1 17 17 VAL H H 17 8.134 8.134 8.022 0.112 25259 9604 1 13 . 1 1 18 18 ILE N N 18 127.777 127.777 119.395 8.382 25259 9605 1 13 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.767 -0.524 25259 9606 1 13 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.090 -2.768 25259 9607 1 13 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.226 -3.972 25259 9608 1 13 . 1 1 18 18 ILE H H 18 8.187 8.187 8.775 -0.588 25259 9609 1 13 . 1 1 19 19 GLU N N 19 128.148 128.148 122.828 5.320 25259 9610 1 13 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.708 -0.371 25259 9611 1 13 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.566 -1.476 25259 9612 1 13 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.788 -4.612 25259 9613 1 13 . 1 1 19 19 GLU H H 19 8.475 8.475 8.753 -0.278 25259 9614 1 13 . 1 1 20 20 ASN N N 20 122.788 122.788 119.639 3.149 25259 9615 1 13 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.979 -0.284 25259 9616 1 13 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.674 -2.852 25259 9617 1 13 . 1 1 20 20 ASN CB C 20 36.366 36.366 39.232 -2.866 25259 9618 1 13 . 1 1 20 20 ASN H H 20 8.477 8.477 8.665 -0.188 25259 9619 1 13 . 1 1 21 21 ALA N N 21 127.253 127.253 127.007 0.246 25259 9620 1 13 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.458 -0.137 25259 9621 1 13 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.728 -1.040 25259 9622 1 13 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.300 -3.387 25259 9623 1 13 . 1 1 21 21 ALA H H 21 8.325 8.325 8.255 0.070 25259 9624 1 13 . 1 1 22 22 GLU N N 22 122.044 122.044 121.142 0.902 25259 9625 1 13 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.301 -0.008 25259 9626 1 13 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.525 -1.942 25259 9627 1 13 . 1 1 22 22 GLU CB C 22 27.285 27.285 28.978 -1.693 25259 9628 1 13 . 1 1 22 22 GLU H H 22 8.415 8.415 8.462 -0.047 25259 9629 1 13 . 1 1 23 23 LYS N N 23 123.622 123.622 122.098 1.524 25259 9630 1 13 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.414 -0.089 25259 9631 1 13 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.190 -1.694 25259 9632 1 13 . 1 1 23 23 LYS CB C 23 30.653 30.653 33.448 -2.795 25259 9633 1 13 . 1 1 23 23 LYS H H 23 8.127 8.127 8.084 0.043 25259 9634 1 13 . 1 1 24 24 ASN N N 24 120.652 120.652 118.607 2.045 25259 9635 1 13 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.859 -0.018 25259 9636 1 13 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.941 -2.278 25259 9637 1 13 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.138 -2.363 25259 9638 1 13 . 1 1 24 24 ASN H H 24 8.424 8.424 8.232 0.192 25259 9639 1 13 . 1 1 25 25 THR N N 25 117.102 117.102 113.281 3.821 25259 9640 1 13 . 1 1 25 25 THR HA H 25 4.367 4.367 4.328 0.039 25259 9641 1 13 . 1 1 25 25 THR CA C 25 59.500 59.500 62.625 -3.125 25259 9642 1 13 . 1 1 25 25 THR CB C 25 67.610 67.610 69.154 -1.544 25259 9643 1 13 . 1 1 25 25 THR H H 25 7.852 7.852 8.318 -0.466 25259 9644 1 13 . 1 1 26 26 VAL N N 26 126.491 126.491 125.120 1.371 25259 9645 1 13 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.355 -0.188 25259 9646 1 13 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.044 -0.851 25259 9647 1 13 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.735 -5.130 25259 9648 1 13 . 1 1 26 26 VAL H H 26 8.080 8.080 8.566 -0.486 25259 9649 1 13 . 1 1 27 27 VAL N N 27 132.992 132.992 129.509 3.483 25259 9650 1 13 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.085 -0.004 25259 9651 1 13 . 1 1 27 27 VAL CA C 27 58.984 58.984 61.487 -2.503 25259 9652 1 13 . 1 1 27 27 VAL CB C 27 31.540 31.540 30.200 1.340 25259 9653 1 13 . 1 1 27 27 VAL H H 27 8.830 8.830 9.044 -0.214 25259 9654 1 13 . 1 1 28 28 THR N N 28 123.576 123.576 121.749 1.827 25259 9655 1 13 . 1 1 28 28 THR HA H 28 5.553 5.553 4.323 1.230 25259 9656 1 13 . 1 1 28 28 THR CA C 28 58.738 58.738 62.436 -3.698 25259 9657 1 13 . 1 1 28 28 THR CB C 28 68.443 68.443 69.299 -0.856 25259 9658 1 13 . 1 1 28 28 THR H H 28 8.165 8.165 8.277 -0.112 25259 9659 1 13 . 1 1 29 29 LYS N N 29 129.099 129.099 127.658 1.441 25259 9660 1 13 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.695 0.247 25259 9661 1 13 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.391 -3.612 25259 9662 1 13 . 1 1 29 29 LYS CB C 29 35.096 35.096 36.775 -1.679 25259 9663 1 13 . 1 1 29 29 LYS H H 29 9.273 9.273 8.442 0.831 25259 9664 1 13 . 1 1 30 30 THR N N 30 123.510 123.510 117.958 5.552 25259 9665 1 13 . 1 1 30 30 THR HA H 30 5.428 5.428 5.275 0.153 25259 9666 1 13 . 1 1 30 30 THR CA C 30 59.784 59.784 61.577 -1.793 25259 9667 1 13 . 1 1 30 30 THR CB C 30 67.818 67.818 71.989 -4.171 25259 9668 1 13 . 1 1 30 30 THR H H 30 8.993 8.993 8.647 0.346 25259 9669 1 13 . 1 1 31 31 LEU N N 31 128.293 128.293 124.354 3.939 25259 9670 1 13 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.943 0.277 25259 9671 1 13 . 1 1 31 31 LEU CA C 31 50.055 50.055 54.257 -4.202 25259 9672 1 13 . 1 1 31 31 LEU CB C 31 43.399 43.399 46.909 -3.510 25259 9673 1 13 . 1 1 31 31 LEU H H 31 9.557 9.557 9.150 0.407 25259 9674 1 13 . 1 1 32 32 VAL N N 32 126.919 126.919 124.572 2.347 25259 9675 1 13 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.323 0.128 25259 9676 1 13 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.239 -1.575 25259 9677 1 13 . 1 1 32 32 VAL CB C 32 29.449 29.449 31.729 -2.280 25259 9678 1 13 . 1 1 32 32 VAL H H 32 9.364 9.364 9.161 0.203 25259 9679 1 13 . 1 1 33 33 LEU N N 33 133.503 133.503 128.690 4.813 25259 9680 1 13 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.524 0.032 25259 9681 1 13 . 1 1 33 33 LEU CA C 33 52.004 52.004 53.469 -1.465 25259 9682 1 13 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.940 -4.093 25259 9683 1 13 . 1 1 33 33 LEU H H 33 8.587 8.587 7.811 0.776 25259 9684 1 13 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.421 0.060 25259 9685 1 13 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.569 -2.124 25259 9686 1 13 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.301 -2.736 25259 9687 1 13 . 1 1 35 35 LYS N N 35 127.420 127.420 120.732 6.688 25259 9688 1 13 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.050 0.316 25259 9689 1 13 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.557 -2.438 25259 9690 1 13 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.772 -2.178 25259 9691 1 13 . 1 1 35 35 LYS H H 35 8.666 8.666 8.286 0.380 25259 9692 1 13 . 1 1 36 36 SER N N 36 122.222 122.222 120.134 2.088 25259 9693 1 13 . 1 1 36 36 SER HA H 36 4.753 4.753 4.427 0.326 25259 9694 1 13 . 1 1 36 36 SER CA C 36 55.328 55.328 58.773 -3.445 25259 9695 1 13 . 1 1 36 36 SER CB C 36 61.728 61.728 63.599 -1.871 25259 9696 1 13 . 1 1 36 36 SER H H 36 8.771 8.771 8.629 0.142 25259 9697 1 13 . 1 1 37 37 ASP N N 37 126.346 126.346 120.986 5.360 25259 9698 1 13 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.441 0.013 25259 9699 1 13 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.368 -1.752 25259 9700 1 13 . 1 1 37 37 ASP CB C 37 37.985 37.985 41.021 -3.036 25259 9701 1 13 . 1 1 37 37 ASP H H 37 8.859 8.859 8.605 0.254 25259 9702 1 13 . 1 1 38 38 ASP N N 38 119.171 119.171 117.915 1.256 25259 9703 1 13 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.699 -0.084 25259 9704 1 13 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.073 -3.285 25259 9705 1 13 . 1 1 38 38 ASP CB C 38 37.635 37.635 40.922 -3.287 25259 9706 1 13 . 1 1 38 38 ASP H H 38 7.944 7.944 8.367 -0.423 25259 9707 1 13 . 1 1 39 39 GLY N N 39 110.352 110.352 109.949 0.403 25259 9708 1 13 . 1 1 39 39 GLY CA C 39 42.761 42.761 44.951 -2.190 25259 9709 1 13 . 1 1 39 39 GLY H H 39 8.145 8.145 8.448 -0.303 25259 9710 1 13 . 1 1 40 40 SER N N 40 120.090 120.090 116.014 4.076 25259 9711 1 13 . 1 1 40 40 SER HA H 40 4.877 4.877 5.280 -0.403 25259 9712 1 13 . 1 1 40 40 SER CA C 40 56.525 56.525 56.688 -0.163 25259 9713 1 13 . 1 1 40 40 SER CB C 40 62.245 62.245 65.299 -3.054 25259 9714 1 13 . 1 1 40 40 SER H H 40 8.344 8.344 7.680 0.664 25259 9715 1 13 . 1 1 41 41 GLN N N 41 122.551 122.551 125.764 -3.213 25259 9716 1 13 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.693 0.234 25259 9717 1 13 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.134 -1.720 25259 9718 1 13 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.026 -2.712 25259 9719 1 13 . 1 1 41 41 GLN H H 41 8.627 8.627 8.553 0.074 25259 9720 1 13 . 1 1 42 42 GLN N N 42 131.724 131.724 122.632 9.092 25259 9721 1 13 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.713 0.898 25259 9722 1 13 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.295 -2.223 25259 9723 1 13 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.470 -2.151 25259 9724 1 13 . 1 1 42 42 GLN H H 42 9.189 9.189 8.635 0.554 25259 9725 1 13 . 1 1 43 43 THR N N 43 122.202 122.202 114.290 7.912 25259 9726 1 13 . 1 1 43 43 THR HA H 43 5.380 5.380 4.932 0.448 25259 9727 1 13 . 1 1 43 43 THR CA C 43 58.863 58.863 61.021 -2.158 25259 9728 1 13 . 1 1 43 43 THR CB C 43 68.893 68.893 72.240 -3.347 25259 9729 1 13 . 1 1 43 43 THR H H 43 9.139 9.139 8.398 0.741 25259 9730 1 13 . 1 1 44 44 GLN N N 44 127.190 127.190 122.195 4.995 25259 9731 1 13 . 1 1 44 44 GLN HA H 44 5.634 5.634 4.810 0.824 25259 9732 1 13 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.827 -3.159 25259 9733 1 13 . 1 1 44 44 GLN CB C 44 28.910 28.910 31.484 -2.574 25259 9734 1 13 . 1 1 44 44 GLN H H 44 9.760 9.760 9.165 0.595 25259 9735 1 13 . 1 1 45 45 THR N N 45 123.479 123.479 121.978 1.501 25259 9736 1 13 . 1 1 45 45 THR HA H 45 5.421 5.421 4.527 0.894 25259 9737 1 13 . 1 1 45 45 THR CA C 45 60.071 60.071 63.586 -3.515 25259 9738 1 13 . 1 1 45 45 THR CB C 45 67.541 67.541 69.411 -1.870 25259 9739 1 13 . 1 1 45 45 THR H H 45 9.518 9.518 8.953 0.565 25259 9740 1 13 . 1 1 46 46 ILE N N 46 133.908 133.908 130.054 3.854 25259 9741 1 13 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.650 0.353 25259 9742 1 13 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.655 -2.184 25259 9743 1 13 . 1 1 46 46 ILE CB C 46 39.945 39.945 38.898 1.047 25259 9744 1 13 . 1 1 46 46 ILE H H 46 9.830 9.830 9.419 0.411 25259 9745 1 13 . 1 1 47 47 THR N N 47 124.701 124.701 124.216 0.485 25259 9746 1 13 . 1 1 47 47 THR HA H 47 6.048 6.048 5.427 0.621 25259 9747 1 13 . 1 1 47 47 THR CA C 47 58.551 58.551 61.342 -2.791 25259 9748 1 13 . 1 1 47 47 THR CB C 47 67.819 67.819 69.561 -1.742 25259 9749 1 13 . 1 1 47 47 THR H H 47 8.843 8.843 8.402 0.441 25259 9750 1 13 . 1 1 48 48 TYR N N 48 127.369 127.369 122.438 4.931 25259 9751 1 13 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.305 -0.027 25259 9752 1 13 . 1 1 48 48 TYR CA C 48 53.729 53.729 55.846 -2.117 25259 9753 1 13 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.407 -1.975 25259 9754 1 13 . 1 1 48 48 TYR H H 48 9.638 9.638 9.142 0.496 25259 9755 1 13 . 1 1 49 49 LYS N N 49 122.138 122.138 117.188 4.950 25259 9756 1 13 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.365 0.291 25259 9757 1 13 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.697 -3.725 25259 9758 1 13 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.301 -0.698 25259 9759 1 13 . 1 1 49 49 LYS H H 49 8.560 8.560 8.743 -0.183 25259 9760 1 13 . 1 1 50 50 ASP N N 50 130.208 130.208 120.245 9.963 25259 9761 1 13 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.717 -0.413 25259 9762 1 13 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.652 -0.892 25259 9763 1 13 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.847 -5.508 25259 9764 1 13 . 1 1 50 50 ASP H H 50 9.597 9.597 8.599 0.998 25259 9765 1 13 . 1 1 51 51 LYS N N 51 124.586 124.586 117.138 7.448 25259 9766 1 13 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.463 0.068 25259 9767 1 13 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.531 -2.796 25259 9768 1 13 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.226 -3.831 25259 9769 1 13 . 1 1 51 51 LYS H H 51 8.450 8.450 7.997 0.453 25259 9770 1 13 . 1 1 52 52 THR N N 52 120.044 120.044 114.868 5.176 25259 9771 1 13 . 1 1 52 52 THR HA H 52 4.717 4.717 4.542 0.175 25259 9772 1 13 . 1 1 52 52 THR CA C 52 59.313 59.313 61.318 -2.005 25259 9773 1 13 . 1 1 52 52 THR CB C 52 68.815 68.815 71.790 -2.975 25259 9774 1 13 . 1 1 52 52 THR H H 52 8.658 8.658 7.696 0.962 25259 9775 1 13 . 1 1 53 53 PHE N N 53 128.987 128.987 123.841 5.146 25259 9776 1 13 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.495 -0.212 25259 9777 1 13 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.106 -1.117 25259 9778 1 13 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.639 0.672 25259 9779 1 13 . 1 1 53 53 PHE H H 53 9.218 9.218 8.710 0.508 25259 9780 1 13 . 1 1 54 54 LEU N N 54 124.874 124.874 126.202 -1.328 25259 9781 1 13 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.252 0.677 25259 9782 1 13 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.648 -3.407 25259 9783 1 13 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.633 -2.116 25259 9784 1 13 . 1 1 54 54 LEU H H 54 9.391 9.391 8.692 0.699 25259 9785 1 13 . 1 1 55 55 SER N N 55 115.516 115.516 108.745 6.771 25259 9786 1 13 . 1 1 55 55 SER HA H 55 5.194 5.194 5.255 -0.061 25259 9787 1 13 . 1 1 55 55 SER CA C 55 55.818 55.818 57.358 -1.540 25259 9788 1 13 . 1 1 55 55 SER CB C 55 63.474 63.474 67.107 -3.633 25259 9789 1 13 . 1 1 55 55 SER H H 55 8.736 8.736 7.832 0.904 25259 9790 1 13 . 1 1 56 56 LEU N N 56 124.352 124.352 122.303 2.049 25259 9791 1 13 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.493 0.050 25259 9792 1 13 . 1 1 56 56 LEU CA C 56 51.637 51.637 53.599 -1.962 25259 9793 1 13 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.226 -0.713 25259 9794 1 13 . 1 1 56 56 LEU H H 56 8.328 8.328 8.535 -0.207 25259 9795 1 13 . 1 1 57 57 ALA N N 57 131.450 131.450 130.132 1.318 25259 9796 1 13 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.187 0.318 25259 9797 1 13 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.327 -2.125 25259 9798 1 13 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.170 -2.206 25259 9799 1 13 . 1 1 57 57 ALA H H 57 9.208 9.208 8.820 0.388 25259 9800 1 13 . 1 1 58 58 ILE N N 58 126.248 126.248 126.981 -0.733 25259 9801 1 13 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.460 0.324 25259 9802 1 13 . 1 1 58 58 ILE CA C 58 58.247 58.247 61.751 -3.504 25259 9803 1 13 . 1 1 58 58 ILE CB C 58 38.045 38.045 37.871 0.174 25259 9804 1 13 . 1 1 58 58 ILE H H 58 9.597 9.597 8.583 1.014 25259 9805 1 13 . 1 1 59 59 GLN N N 59 132.065 132.065 128.315 3.750 25259 9806 1 13 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.341 0.906 25259 9807 1 13 . 1 1 59 59 GLN CA C 59 52.164 52.164 56.675 -4.511 25259 9808 1 13 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.173 -0.512 25259 9809 1 13 . 1 1 59 59 GLN H H 59 9.389 9.389 8.281 1.108 25259 9810 1 13 . 1 1 60 60 GLN N N 60 130.314 130.314 118.587 11.727 25259 9811 1 13 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.564 0.645 25259 9812 1 13 . 1 1 60 60 GLN CA C 60 52.021 52.021 56.145 -4.124 25259 9813 1 13 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.164 -3.688 25259 9814 1 13 . 1 1 60 60 GLN H H 60 9.471 9.471 8.672 0.799 25259 9815 1 13 . 1 1 61 61 LYS N N 61 131.044 131.044 127.793 3.251 25259 9816 1 13 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.230 0.185 25259 9817 1 13 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.401 -2.281 25259 9818 1 13 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.124 -3.707 25259 9819 1 13 . 1 1 61 61 LYS H H 61 8.893 8.893 8.941 -0.048 25259 9820 1 13 . 1 1 62 62 ARG N N 62 125.397 125.397 124.309 1.088 25259 9821 1 13 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.216 -0.213 25259 9822 1 13 . 1 1 62 62 ARG CA C 62 51.091 51.091 52.805 -1.714 25259 9823 1 13 . 1 1 62 62 ARG CB C 62 29.878 29.878 33.581 -3.703 25259 9824 1 13 . 1 1 62 62 ARG H H 62 9.120 9.120 8.021 1.099 25259 9825 1 13 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.634 0.341 25259 9826 1 13 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.289 -2.792 25259 9827 1 13 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.190 -2.305 25259 9828 1 13 . 1 1 64 64 VAL N N 64 121.305 121.305 118.640 2.665 25259 9829 1 13 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.223 -0.199 25259 9830 1 13 . 1 1 64 64 VAL CA C 64 59.677 59.677 62.054 -2.377 25259 9831 1 13 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.343 -1.978 25259 9832 1 13 . 1 1 64 64 VAL H H 64 7.520 7.520 7.879 -0.359 25259 9833 1 13 . 1 1 65 65 SER N N 65 123.215 123.215 113.792 9.423 25259 9834 1 13 . 1 1 65 65 SER HA H 65 4.521 4.521 4.737 -0.216 25259 9835 1 13 . 1 1 65 65 SER CA C 65 54.897 54.897 57.629 -2.732 25259 9836 1 13 . 1 1 65 65 SER CB C 65 62.564 62.564 65.368 -2.804 25259 9837 1 13 . 1 1 65 65 SER H H 65 8.080 8.080 7.927 0.153 25259 9838 1 13 . 1 1 66 66 ASP N N 66 123.802 123.802 122.972 0.830 25259 9839 1 13 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.523 -0.094 25259 9840 1 13 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.598 -1.220 25259 9841 1 13 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.821 -2.783 25259 9842 1 13 . 1 1 66 66 ASP H H 66 8.900 8.900 8.718 0.182 25259 9843 1 13 . 1 1 67 67 GLU N N 67 121.943 121.943 119.770 2.173 25259 9844 1 13 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.092 0.097 25259 9845 1 13 . 1 1 67 67 GLU CA C 67 57.440 57.440 58.801 -1.361 25259 9846 1 13 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.510 -2.725 25259 9847 1 13 . 1 1 67 67 GLU H H 67 8.717 8.717 8.571 0.146 25259 9848 1 13 . 1 1 68 68 LEU N N 68 125.458 125.458 120.878 4.580 25259 9849 1 13 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.230 0.113 25259 9850 1 13 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.908 -2.436 25259 9851 1 13 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.641 -2.237 25259 9852 1 13 . 1 1 68 68 LEU H H 68 7.820 7.820 7.719 0.101 25259 9853 1 13 . 1 1 69 69 LYS N N 69 123.868 123.868 119.258 4.610 25259 9854 1 13 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.030 -0.024 25259 9855 1 13 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.793 -2.176 25259 9856 1 13 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.176 -2.139 25259 9857 1 13 . 1 1 69 69 LYS H H 69 8.690 8.690 8.019 0.671 25259 9858 1 13 . 1 1 70 70 THR N N 70 117.109 117.109 116.571 0.538 25259 9859 1 13 . 1 1 70 70 THR HA H 70 4.088 4.088 3.989 0.099 25259 9860 1 13 . 1 1 70 70 THR CA C 70 63.879 63.879 66.848 -2.969 25259 9861 1 13 . 1 1 70 70 THR CB C 70 66.383 66.383 68.656 -2.273 25259 9862 1 13 . 1 1 70 70 THR H H 70 7.935 7.935 7.753 0.182 25259 9863 1 13 . 1 1 71 71 TYR N N 71 127.006 127.006 122.956 4.050 25259 9864 1 13 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.273 -0.068 25259 9865 1 13 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.850 -1.625 25259 9866 1 13 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.085 -1.540 25259 9867 1 13 . 1 1 71 71 TYR H H 71 7.683 7.683 7.734 -0.051 25259 9868 1 13 . 1 1 72 72 ILE N N 72 125.064 125.064 118.051 7.013 25259 9869 1 13 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.831 -0.152 25259 9870 1 13 . 1 1 72 72 ILE CA C 72 62.895 62.895 64.889 -1.994 25259 9871 1 13 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.818 -1.542 25259 9872 1 13 . 1 1 72 72 ILE H H 72 9.083 9.083 7.954 1.129 25259 9873 1 13 . 1 1 73 73 ASP N N 73 124.900 124.900 118.471 6.429 25259 9874 1 13 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.496 -0.107 25259 9875 1 13 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.442 -1.404 25259 9876 1 13 . 1 1 73 73 ASP CB C 73 38.107 38.107 41.215 -3.108 25259 9877 1 13 . 1 1 73 73 ASP H H 73 8.751 8.751 7.639 1.112 25259 9878 1 13 . 1 1 74 74 GLN N N 74 117.025 117.025 117.486 -0.461 25259 9879 1 13 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.968 0.170 25259 9880 1 13 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.877 -3.067 25259 9881 1 13 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.215 -1.651 25259 9882 1 13 . 1 1 74 74 GLN H H 74 7.447 7.447 8.137 -0.690 25259 9883 1 13 . 1 1 75 75 HIS N N 75 116.494 116.494 114.594 1.900 25259 9884 1 13 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.702 0.014 25259 9885 1 13 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.480 -2.414 25259 9886 1 13 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.130 -4.828 25259 9887 1 13 . 1 1 75 75 HIS H H 75 8.402 8.402 8.070 0.332 25259 9888 1 13 . 1 1 76 76 GLY N N 76 112.564 112.564 105.523 7.041 25259 9889 1 13 . 1 1 76 76 GLY CA C 76 41.896 41.896 45.030 -3.134 25259 9890 1 13 . 1 1 76 76 GLY H H 76 9.091 9.091 7.761 1.330 25259 9891 1 13 . 1 1 77 77 VAL N N 77 124.763 124.763 121.941 2.822 25259 9892 1 13 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.748 -0.183 25259 9893 1 13 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.686 -0.735 25259 9894 1 13 . 1 1 77 77 VAL CB C 77 29.838 29.838 31.957 -2.119 25259 9895 1 13 . 1 1 77 77 VAL H H 77 8.927 8.927 8.641 0.286 25259 9896 1 13 . 1 1 78 78 GLU N N 78 124.388 124.388 119.003 5.385 25259 9897 1 13 . 1 1 78 78 GLU HA H 78 4.148 4.148 3.919 0.229 25259 9898 1 13 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.361 -1.045 25259 9899 1 13 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.187 -2.728 25259 9900 1 13 . 1 1 78 78 GLU H H 78 8.781 8.781 8.538 0.243 25259 9901 1 13 . 1 1 79 79 GLU N N 79 121.887 121.887 120.101 1.786 25259 9902 1 13 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.066 0.122 25259 9903 1 13 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.118 -2.573 25259 9904 1 13 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.203 -2.170 25259 9905 1 13 . 1 1 79 79 GLU H H 79 9.231 9.231 8.526 0.705 25259 9906 1 13 . 1 1 80 80 THR N N 80 120.781 120.781 116.012 4.769 25259 9907 1 13 . 1 1 80 80 THR HA H 80 4.059 4.059 3.823 0.236 25259 9908 1 13 . 1 1 80 80 THR CA C 80 65.487 65.487 66.819 -1.332 25259 9909 1 13 . 1 1 80 80 THR CB C 80 64.369 64.369 68.391 -4.022 25259 9910 1 13 . 1 1 80 80 THR H H 80 7.858 7.858 8.243 -0.385 25259 9911 1 13 . 1 1 81 81 GLN N N 81 125.303 125.303 120.508 4.795 25259 9912 1 13 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.889 0.155 25259 9913 1 13 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.112 -2.143 25259 9914 1 13 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.579 -2.502 25259 9915 1 13 . 1 1 81 81 GLN H H 81 8.765 8.765 7.855 0.910 25259 9916 1 13 . 1 1 82 82 LYS N N 82 120.458 120.458 119.757 0.701 25259 9917 1 13 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.922 0.167 25259 9918 1 13 . 1 1 82 82 LYS CA C 82 57.312 57.312 59.250 -1.938 25259 9919 1 13 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.690 -1.536 25259 9920 1 13 . 1 1 82 82 LYS H H 82 7.521 7.521 7.420 0.101 25259 9921 1 13 . 1 1 83 83 ALA N N 83 125.234 125.234 121.836 3.398 25259 9922 1 13 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.954 0.263 25259 9923 1 13 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.687 -2.245 25259 9924 1 13 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.730 -2.442 25259 9925 1 13 . 1 1 83 83 ALA H H 83 7.782 7.782 7.563 0.219 25259 9926 1 13 . 1 1 84 84 LEU N N 84 123.348 123.348 117.677 5.671 25259 9927 1 13 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.849 0.209 25259 9928 1 13 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.587 -2.088 25259 9929 1 13 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.218 -1.910 25259 9930 1 13 . 1 1 84 84 LEU H H 84 8.590 8.590 7.104 1.486 25259 9931 1 13 . 1 1 85 85 LEU N N 85 122.872 122.872 118.183 4.689 25259 9932 1 13 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.948 0.222 25259 9933 1 13 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.511 -2.115 25259 9934 1 13 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.611 -2.870 25259 9935 1 13 . 1 1 85 85 LEU H H 85 7.892 7.892 7.405 0.487 25259 9936 1 13 . 1 1 86 86 GLU N N 86 122.713 122.713 117.404 5.309 25259 9937 1 13 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.072 0.013 25259 9938 1 13 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.134 -1.389 25259 9939 1 13 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.672 -2.769 25259 9940 1 13 . 1 1 86 86 GLU H H 86 8.124 8.124 8.148 -0.024 25259 9941 1 13 . 1 1 87 87 ALA N N 87 123.163 123.163 121.624 1.539 25259 9942 1 13 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.284 -0.143 25259 9943 1 13 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.379 -2.111 25259 9944 1 13 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.579 -2.947 25259 9945 1 13 . 1 1 87 87 ALA H H 87 7.765 7.765 7.561 0.204 25259 9946 1 13 . 1 1 88 88 GLU N N 88 121.945 121.945 119.135 2.810 25259 9947 1 13 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.080 0.004 25259 9948 1 13 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.649 -1.714 25259 9949 1 13 . 1 1 88 88 GLU CB C 88 28.027 28.027 28.848 -0.821 25259 9950 1 13 . 1 1 88 88 GLU H H 88 7.846 7.846 8.052 -0.206 25259 9951 1 13 . 1 1 89 89 GLU N N 89 117.978 117.978 117.384 0.594 25259 9952 1 13 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.113 -0.020 25259 9953 1 13 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.169 -2.955 25259 9954 1 13 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.080 -1.673 25259 9955 1 13 . 1 1 89 89 GLU H H 89 7.634 7.634 8.055 -0.421 25259 9956 1 13 . 1 1 90 90 LYS N N 90 117.519 117.519 116.877 0.642 25259 9957 1 13 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.471 -0.040 25259 9958 1 13 . 1 1 90 90 LYS CA C 90 53.018 53.018 54.878 -1.860 25259 9959 1 13 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.540 -1.509 25259 9960 1 13 . 1 1 90 90 LYS H H 90 7.247 7.247 7.522 -0.275 25259 9961 1 13 . 1 1 91 91 ASP N N 91 124.888 124.888 121.810 3.078 25259 9962 1 13 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.785 -0.102 25259 9963 1 13 . 1 1 91 91 ASP CA C 91 51.199 51.199 52.469 -1.270 25259 9964 1 13 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.492 -2.911 25259 9965 1 13 . 1 1 91 91 ASP H H 91 7.370 7.370 7.518 -0.148 25259 9966 1 13 . 1 1 92 92 LYS N N 92 129.311 129.311 126.089 3.222 25259 9967 1 13 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.949 0.064 25259 9968 1 13 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.219 -2.003 25259 9969 1 13 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.476 -2.461 25259 9970 1 13 . 1 1 92 92 LYS H H 92 8.795 8.795 8.871 -0.076 25259 9971 1 13 . 1 1 93 93 SER N N 93 118.112 118.112 115.829 2.283 25259 9972 1 13 . 1 1 93 93 SER HA H 93 4.439 4.439 4.197 0.242 25259 9973 1 13 . 1 1 93 93 SER CA C 93 58.945 58.945 60.934 -1.989 25259 9974 1 13 . 1 1 93 93 SER CB C 93 60.278 60.278 63.371 -3.093 25259 9975 1 13 . 1 1 93 93 SER H H 93 8.488 8.488 8.672 -0.184 25259 9976 1 13 . 1 1 94 94 ILE N N 94 128.950 128.950 122.928 6.022 25259 9977 1 13 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.283 0.199 25259 9978 1 13 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.629 -2.280 25259 9979 1 13 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.999 -3.246 25259 9980 1 13 . 1 1 94 94 ILE H H 94 7.722 7.722 7.302 0.420 25259 9981 1 13 . 1 1 95 95 ILE N N 95 123.598 123.598 119.326 4.272 25259 9982 1 13 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.569 0.026 25259 9983 1 13 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.730 -2.983 25259 9984 1 13 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.416 -1.444 25259 9985 1 13 . 1 1 95 95 ILE H H 95 8.378 8.378 8.338 0.040 25259 9986 1 13 . 1 1 96 96 GLU N N 96 118.317 118.317 117.592 0.725 25259 9987 1 13 . 1 1 96 96 GLU HA H 96 3.984 3.984 4.049 -0.065 25259 9988 1 13 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.158 -2.663 25259 9989 1 13 . 1 1 96 96 GLU CB C 96 27.173 27.173 28.857 -1.684 25259 9990 1 13 . 1 1 96 96 GLU H H 96 7.680 7.680 7.893 -0.213 25259 9991 1 13 . 1 1 97 97 ALA N N 97 124.797 124.797 123.051 1.746 25259 9992 1 13 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.876 -0.051 25259 9993 1 13 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.330 -2.033 25259 9994 1 13 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.397 -2.408 25259 9995 1 13 . 1 1 97 97 ALA H H 97 7.383 7.383 7.126 0.257 25259 9996 1 13 . 1 1 98 98 ARG N N 98 115.469 115.469 115.407 0.062 25259 9997 1 13 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.348 -0.042 25259 9998 1 13 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.000 -1.510 25259 9999 1 13 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.948 -1.710 25259 10000 1 13 . 1 1 98 98 ARG H H 98 8.229 8.229 8.046 0.183 25259 10001 1 13 . 1 1 99 99 LYS N N 99 120.219 120.219 117.144 3.075 25259 10002 1 13 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.181 0.077 25259 10003 1 13 . 1 1 99 99 LYS CA C 99 55.241 55.241 56.792 -1.552 25259 10004 1 13 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.715 -2.219 25259 10005 1 13 . 1 1 99 99 LYS H H 99 7.270 7.270 7.266 0.004 25259 10006 1 13 . 1 1 100 100 LEU N N 100 123.800 123.800 120.353 3.447 25259 10007 1 13 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.349 -0.008 25259 10008 1 13 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.443 -2.364 25259 10009 1 13 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.535 -3.404 25259 10010 1 13 . 1 1 100 100 LEU H H 100 7.837 7.837 7.703 0.134 25259 10011 1 13 . 1 1 101 101 ALA N N 101 130.512 130.512 125.923 4.589 25259 10012 1 13 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.422 -0.046 25259 10013 1 13 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.037 -2.633 25259 10014 1 13 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.661 -2.865 25259 10015 1 13 . 1 1 101 101 ALA H H 101 8.213 8.213 8.991 -0.778 25259 10016 1 13 . 1 1 102 102 GLY N N 102 110.659 110.659 105.157 5.502 25259 10017 1 13 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.105 -1.212 25259 10018 1 13 . 1 1 102 102 GLY H H 102 8.738 8.738 8.195 0.543 25259 10019 1 13 . 1 1 103 103 PHE N N 103 123.097 123.097 122.251 0.846 25259 10020 1 13 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.375 -0.155 25259 10021 1 13 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.309 -2.541 25259 10022 1 13 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.029 -1.456 25259 10023 1 13 . 1 1 103 103 PHE H H 103 7.514 7.514 7.482 0.032 25259 10024 1 13 . 1 1 104 104 LYS N N 104 130.652 130.652 127.135 3.517 25259 10025 1 13 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.388 -0.268 25259 10026 1 13 . 1 1 104 104 LYS CA C 104 52.979 52.979 53.879 -0.900 25259 10027 1 13 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.962 -2.725 25259 10028 1 13 . 1 1 104 104 LYS H H 104 7.473 7.473 7.975 -0.502 25259 10029 1 13 . 1 1 105 105 LEU N N 105 127.372 127.372 124.083 3.289 25259 10030 1 13 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.760 0.236 25259 10031 1 13 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.506 -1.770 25259 10032 1 13 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.063 -1.099 25259 10033 1 13 . 1 1 105 105 LEU H H 105 8.393 8.393 8.307 0.086 25259 10034 1 13 . 1 1 106 106 GLU N N 106 129.358 129.358 127.612 1.746 25259 10035 1 13 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.683 0.161 25259 10036 1 13 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.828 -2.038 25259 10037 1 13 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.112 -1.484 25259 10038 1 13 . 1 1 106 106 GLU H H 106 8.849 8.849 9.056 -0.207 25259 10039 1 13 . 1 1 107 107 THR N N 107 131.118 131.118 120.186 10.932 25259 10040 1 13 . 1 1 107 107 THR HA H 107 5.110 5.110 4.791 0.319 25259 10041 1 13 . 1 1 107 107 THR CA C 107 59.832 59.832 61.127 -1.295 25259 10042 1 13 . 1 1 107 107 THR CB C 107 66.671 66.671 70.354 -3.683 25259 10043 1 13 . 1 1 107 107 THR H H 107 9.433 9.433 8.440 0.993 25259 10044 1 13 . 1 1 108 108 LYS N N 108 129.114 129.114 127.124 1.990 25259 10045 1 13 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.600 0.224 25259 10046 1 13 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.705 -2.511 25259 10047 1 13 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.500 -1.112 25259 10048 1 13 . 1 1 108 108 LYS H H 108 9.410 9.410 9.090 0.320 25259 10049 1 13 . 1 1 109 109 LEU N N 109 129.323 129.323 127.357 1.966 25259 10050 1 13 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.362 0.342 25259 10051 1 13 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.228 -2.120 25259 10052 1 13 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.455 -2.800 25259 10053 1 13 . 1 1 109 109 LEU H H 109 8.862 8.862 8.748 0.114 25259 10054 1 13 . 1 1 110 110 LEU N N 110 129.123 129.123 126.780 2.343 25259 10055 1 13 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.467 -0.244 25259 10056 1 13 . 1 1 110 110 LEU CA C 110 53.782 53.782 55.737 -1.955 25259 10057 1 13 . 1 1 110 110 LEU CB C 110 40.661 40.661 43.082 -2.421 25259 10058 1 13 . 1 1 110 110 LEU H H 110 8.373 8.373 8.725 -0.352 25259 10059 1 13 . 1 1 111 111 SER N N 111 114.587 114.587 111.784 2.803 25259 10060 1 13 . 1 1 111 111 SER HA H 111 4.557 4.557 4.506 0.051 25259 10061 1 13 . 1 1 111 111 SER CA C 111 53.889 53.889 58.260 -4.371 25259 10062 1 13 . 1 1 111 111 SER CB C 111 61.830 61.830 64.647 -2.817 25259 10063 1 13 . 1 1 111 111 SER H H 111 8.400 8.400 7.757 0.643 25259 10064 1 13 . 1 1 112 112 ALA N N 112 118.269 118.269 123.281 -5.012 25259 10065 1 13 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.262 0.047 25259 10066 1 13 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.438 -3.224 25259 10067 1 13 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.706 -2.118 25259 10068 1 13 . 1 1 112 112 ALA H H 112 8.556 8.556 8.636 -0.080 25259 10069 1 13 . 1 1 113 113 THR N N 113 102.878 102.878 102.894 -0.016 25259 10070 1 13 . 1 1 113 113 THR HA H 113 4.662 4.662 4.500 0.162 25259 10071 1 13 . 1 1 113 113 THR CA C 113 58.689 58.689 61.084 -2.395 25259 10072 1 13 . 1 1 113 113 THR CB C 113 67.905 67.905 69.570 -1.665 25259 10073 1 13 . 1 1 113 113 THR H H 113 8.065 8.065 7.559 0.506 25259 10074 1 13 . 1 1 114 114 GLU N N 114 126.514 126.514 121.211 5.303 25259 10075 1 13 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.757 0.257 25259 10076 1 13 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.358 -2.351 25259 10077 1 13 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.288 -1.375 25259 10078 1 13 . 1 1 114 114 GLU H H 114 7.357 7.357 7.914 -0.557 25259 10079 1 13 . 1 1 115 115 LEU N N 115 128.058 128.058 119.539 8.519 25259 10080 1 13 . 1 1 115 115 LEU HA H 115 4.922 4.922 4.927 -0.005 25259 10081 1 13 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.331 -2.007 25259 10082 1 13 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.313 -2.174 25259 10083 1 13 . 1 1 115 115 LEU H H 115 8.930 8.930 8.652 0.278 25259 10084 1 13 . 1 1 116 116 GLN N N 116 126.540 126.540 119.588 6.952 25259 10085 1 13 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.315 0.400 25259 10086 1 13 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.569 -2.869 25259 10087 1 13 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.653 -1.361 25259 10088 1 13 . 1 1 116 116 GLN H H 116 9.221 9.221 9.016 0.205 25259 10089 1 13 . 1 1 117 117 THR N N 117 125.213 125.213 123.230 1.983 25259 10090 1 13 . 1 1 117 117 THR HA H 117 5.353 5.353 5.335 0.018 25259 10091 1 13 . 1 1 117 117 THR CA C 117 58.926 58.926 61.108 -2.183 25259 10092 1 13 . 1 1 117 117 THR CB C 117 68.948 68.948 72.213 -3.265 25259 10093 1 13 . 1 1 117 117 THR H H 117 9.030 9.030 9.001 0.029 25259 10094 1 13 . 1 1 118 118 THR N N 118 127.799 127.799 120.301 7.498 25259 10095 1 13 . 1 1 118 118 THR HA H 118 5.527 5.527 4.973 0.554 25259 10096 1 13 . 1 1 118 118 THR CA C 118 59.201 59.201 61.589 -2.388 25259 10097 1 13 . 1 1 118 118 THR CB C 118 67.721 67.721 71.290 -3.569 25259 10098 1 13 . 1 1 118 118 THR H H 118 9.459 9.459 8.741 0.718 25259 10099 1 13 . 1 1 119 119 THR N N 119 129.258 129.258 123.722 5.536 25259 10100 1 13 . 1 1 119 119 THR HA H 119 4.885 4.885 4.697 0.188 25259 10101 1 13 . 1 1 119 119 THR CA C 119 58.463 58.463 61.392 -2.929 25259 10102 1 13 . 1 1 119 119 THR CB C 119 67.459 67.459 69.519 -2.060 25259 10103 1 13 . 1 1 119 119 THR H H 119 9.147 9.147 9.036 0.111 25259 10104 1 13 . 1 1 120 120 SER N N 120 123.389 123.389 120.720 2.669 25259 10105 1 13 . 1 1 120 120 SER HA H 120 5.328 5.328 4.749 0.579 25259 10106 1 13 . 1 1 120 120 SER CA C 120 54.386 54.386 57.764 -3.378 25259 10107 1 13 . 1 1 120 120 SER CB C 120 63.031 63.031 64.011 -0.980 25259 10108 1 13 . 1 1 120 120 SER H H 120 8.786 8.786 8.427 0.359 25259 10109 1 13 . 1 1 121 121 PHE N N 121 121.245 121.245 123.260 -2.015 25259 10110 1 13 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.866 0.246 25259 10111 1 13 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.041 -2.849 25259 10112 1 13 . 1 1 121 121 PHE CB C 121 40.265 40.265 40.361 -0.096 25259 10113 1 13 . 1 1 121 121 PHE H H 121 8.831 8.831 9.027 -0.196 25259 10114 1 13 . 1 1 122 122 ASP N N 122 124.765 124.765 126.213 -1.448 25259 10115 1 13 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.778 0.062 25259 10116 1 13 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.045 -3.208 25259 10117 1 13 . 1 1 122 122 ASP CB C 122 38.485 38.485 39.187 -0.702 25259 10118 1 13 . 1 1 122 122 ASP H H 122 8.819 8.819 9.001 -0.182 25259 10119 1 13 . 1 1 123 123 PHE N N 123 124.303 124.303 122.534 1.769 25259 10120 1 13 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.235 0.439 25259 10121 1 13 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.841 -3.043 25259 10122 1 13 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.465 -2.925 25259 10123 1 13 . 1 1 123 123 PHE H H 123 8.262 8.262 7.807 0.455 25259 10124 1 13 . 1 1 124 124 GLN N N 124 120.792 120.792 117.583 3.209 25259 10125 1 13 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.157 0.277 25259 10126 1 13 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.414 -2.331 25259 10127 1 13 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.021 -1.892 25259 10128 1 13 . 1 1 124 124 GLN H H 124 8.954 8.954 8.025 0.929 25259 10129 1 13 . 1 1 125 125 VAL N N 125 114.091 114.091 110.349 3.742 25259 10130 1 13 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.355 0.054 25259 10131 1 13 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.801 -2.503 25259 10132 1 13 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.431 -0.860 25259 10133 1 13 . 1 1 125 125 VAL H H 125 7.026 7.026 7.935 -0.909 25259 10134 1 13 . 1 1 126 126 LEU N N 126 125.158 125.158 123.464 1.694 25259 10135 1 13 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.542 -0.067 25259 10136 1 13 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.654 -1.479 25259 10137 1 13 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.365 -1.311 25259 10138 1 13 . 1 1 126 126 LEU H H 126 8.106 8.106 7.600 0.506 25259 10139 1 13 . 1 1 127 127 ASP N N 127 130.026 130.026 129.746 0.280 25259 10140 1 13 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.698 0.143 25259 10141 1 13 . 1 1 127 127 ASP CA C 127 50.198 50.198 54.622 -4.424 25259 10142 1 13 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.778 -2.088 25259 10143 1 13 . 1 1 127 127 ASP H H 127 9.129 9.129 9.032 0.097 25259 10144 1 13 . 1 1 128 128 VAL N N 128 128.833 128.833 123.782 5.051 25259 10145 1 13 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.649 -0.125 25259 10146 1 13 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.877 -3.209 25259 10147 1 13 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.543 -2.048 25259 10148 1 13 . 1 1 128 128 VAL H H 128 8.288 8.288 8.147 0.141 25259 10149 1 13 . 1 1 129 129 LYS N N 129 123.914 123.914 118.504 5.410 25259 10150 1 13 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.010 0.033 25259 10151 1 13 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.998 -2.209 25259 10152 1 13 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.931 -2.994 25259 10153 1 13 . 1 1 129 129 LYS H H 129 8.226 8.226 8.286 -0.060 25259 10154 1 13 . 1 1 130 130 LYS N N 130 121.888 121.888 117.497 4.391 25259 10155 1 13 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.272 -0.187 25259 10156 1 13 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.649 -1.503 25259 10157 1 13 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.202 -2.862 25259 10158 1 13 . 1 1 130 130 LYS H H 130 7.590 7.590 7.613 -0.023 25259 10159 1 13 . 1 1 131 131 ALA N N 131 123.088 123.088 123.637 -0.549 25259 10160 1 13 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.085 -0.158 25259 10161 1 13 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.341 -2.939 25259 10162 1 13 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.438 -1.990 25259 10163 1 13 . 1 1 131 131 ALA H H 131 8.506 8.506 8.385 0.121 25259 10164 1 13 . 1 1 132 132 SER N N 132 110.456 110.456 111.024 -0.568 25259 10165 1 13 . 1 1 132 132 SER HA H 132 4.117 4.117 4.094 0.023 25259 10166 1 13 . 1 1 132 132 SER CA C 132 58.289 58.289 60.820 -2.531 25259 10167 1 13 . 1 1 132 132 SER CB C 132 61.034 61.034 63.123 -2.089 25259 10168 1 13 . 1 1 132 132 SER H H 132 7.986 7.986 8.021 -0.035 25259 10169 1 13 . 1 1 133 133 GLN N N 133 119.034 119.034 119.776 -0.742 25259 10170 1 13 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.558 -0.156 25259 10171 1 13 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.640 -2.115 25259 10172 1 13 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.933 -1.699 25259 10173 1 13 . 1 1 133 133 GLN H H 133 7.233 7.233 7.561 -0.328 25259 10174 1 13 . 1 1 134 134 LEU N N 134 123.291 123.291 119.621 3.670 25259 10175 1 13 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.676 -0.283 25259 10176 1 13 . 1 1 134 134 LEU CA C 134 52.316 52.316 52.822 -0.506 25259 10177 1 13 . 1 1 134 134 LEU CB C 134 38.847 38.847 44.480 -5.633 25259 10178 1 13 . 1 1 134 134 LEU H H 134 7.411 7.411 7.336 0.075 25259 10179 1 13 . 1 1 135 135 GLU N N 135 128.446 128.446 121.879 6.567 25259 10180 1 13 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.923 0.023 25259 10181 1 13 . 1 1 135 135 GLU CA C 135 57.384 57.384 60.166 -2.783 25259 10182 1 13 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.518 -2.222 25259 10183 1 13 . 1 1 135 135 GLU H H 135 8.986 8.986 8.905 0.081 25259 10184 1 13 . 1 1 136 136 HIS N N 136 117.593 117.593 117.169 0.424 25259 10185 1 13 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.427 -0.044 25259 10186 1 13 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.610 -1.925 25259 10187 1 13 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.770 -1.357 25259 10188 1 13 . 1 1 136 136 HIS H H 136 9.226 9.226 8.418 0.808 25259 10189 1 13 . 1 1 137 137 LEU N N 137 115.463 115.463 117.708 -2.245 25259 10190 1 13 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.486 0.021 25259 10191 1 13 . 1 1 137 137 LEU CA C 137 51.948 51.948 55.514 -3.566 25259 10192 1 13 . 1 1 137 137 LEU CB C 137 39.807 39.807 43.002 -3.196 25259 10193 1 13 . 1 1 137 137 LEU H H 137 7.090 7.090 7.857 -0.767 25259 10194 1 13 . 1 1 138 138 LYS N N 138 124.686 124.686 120.339 4.347 25259 10195 1 13 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.174 -0.005 25259 10196 1 13 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.933 -1.775 25259 10197 1 13 . 1 1 138 138 LYS CB C 138 30.088 30.088 31.996 -1.908 25259 10198 1 13 . 1 1 138 138 LYS H H 138 7.698 7.698 8.121 -0.423 25259 10199 1 13 . 1 1 139 139 ASN N N 139 118.077 118.077 116.161 1.916 25259 10200 1 13 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.655 0.018 25259 10201 1 13 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.543 -1.761 25259 10202 1 13 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.726 -2.909 25259 10203 1 13 . 1 1 139 139 ASN H H 139 8.485 8.485 8.151 0.334 25259 10204 1 13 . 1 1 140 140 ILE N N 140 120.880 120.880 120.732 0.148 25259 10205 1 13 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.260 -0.230 25259 10206 1 13 . 1 1 140 140 ILE CA C 140 59.566 59.566 60.890 -1.324 25259 10207 1 13 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.586 -2.812 25259 10208 1 13 . 1 1 140 140 ILE H H 140 7.549 7.549 7.828 -0.279 25259 10209 1 13 . 1 1 141 141 GLY N N 141 110.676 110.676 115.980 -5.304 25259 10210 1 13 . 1 1 141 141 GLY CA C 141 44.664 44.664 45.192 -0.528 25259 10211 1 13 . 1 1 141 141 GLY H H 141 7.663 7.663 8.853 -1.190 25259 10212 1 13 . 1 1 142 142 LEU N N 142 123.857 123.857 121.700 2.157 25259 10213 1 13 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.930 -0.237 25259 10214 1 13 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.041 -1.848 25259 10215 1 13 . 1 1 142 142 LEU CB C 142 40.609 40.609 42.177 -1.568 25259 10216 1 13 . 1 1 142 142 LEU H H 142 8.496 8.496 7.777 0.719 25259 10217 1 13 . 1 1 143 143 GLU N N 143 118.407 118.407 118.836 -0.429 25259 10218 1 13 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.834 -0.048 25259 10219 1 13 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.629 -2.407 25259 10220 1 13 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.935 -2.422 25259 10221 1 13 . 1 1 143 143 GLU H H 143 8.672 8.672 8.701 -0.029 25259 10222 1 13 . 1 1 144 144 ASN N N 144 118.477 118.477 116.885 1.592 25259 10223 1 13 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.339 0.103 25259 10224 1 13 . 1 1 144 144 ASN CA C 144 52.712 52.712 55.505 -2.793 25259 10225 1 13 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.131 -2.176 25259 10226 1 13 . 1 1 144 144 ASN H H 144 7.656 7.656 8.019 -0.363 25259 10227 1 13 . 1 1 145 145 LEU N N 145 125.354 125.354 121.226 4.128 25259 10228 1 13 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.541 0.256 25259 10229 1 13 . 1 1 145 145 LEU CA C 145 56.323 56.323 58.100 -1.777 25259 10230 1 13 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.819 -2.246 25259 10231 1 13 . 1 1 145 145 LEU H H 145 7.758 7.758 7.304 0.454 25259 10232 1 13 . 1 1 146 146 LEU N N 146 116.372 116.372 116.046 0.326 25259 10233 1 13 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.408 0.468 25259 10234 1 13 . 1 1 146 146 LEU CA C 146 53.243 53.243 56.046 -2.803 25259 10235 1 13 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.538 -2.641 25259 10236 1 13 . 1 1 146 146 LEU H H 146 7.242 7.242 7.411 -0.169 25259 10237 1 13 . 1 1 147 147 LYS N N 147 120.054 120.054 116.813 3.241 25259 10238 1 13 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.205 0.107 25259 10239 1 13 . 1 1 147 147 LYS CA C 147 54.623 54.623 56.695 -2.072 25259 10240 1 13 . 1 1 147 147 LYS CB C 147 30.260 30.260 31.844 -1.584 25259 10241 1 13 . 1 1 147 147 LYS H H 147 7.185 7.185 7.771 -0.586 25259 10242 1 13 . 1 1 148 148 ASN N N 148 119.498 119.498 116.653 2.845 25259 10243 1 13 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.836 0.126 25259 10244 1 13 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.962 -2.188 25259 10245 1 13 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.770 -1.284 25259 10246 1 13 . 1 1 148 148 ASN H H 148 7.698 7.698 7.489 0.209 25259 10247 1 13 . 1 1 149 149 GLU N N 149 122.834 122.834 117.625 5.209 25259 10248 1 13 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.594 0.007 25259 10249 1 13 . 1 1 149 149 GLU CA C 149 52.219 52.219 53.534 -1.315 25259 10250 1 13 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.441 -2.631 25259 10251 1 13 . 1 1 149 149 GLU H H 149 8.767 8.767 8.676 0.091 25259 10252 1 13 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.588 1.020 25259 10253 1 13 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.608 -1.365 25259 10254 1 13 . 1 1 150 150 PRO CB C 150 28.095 28.095 30.817 -2.722 25259 10255 1 13 . 1 1 151 151 SER N N 151 112.839 112.839 109.473 3.366 25259 10256 1 13 . 1 1 151 151 SER HA H 151 3.835 3.835 4.364 -0.529 25259 10257 1 13 . 1 1 151 151 SER CA C 151 59.270 59.270 57.729 1.541 25259 10258 1 13 . 1 1 151 151 SER CB C 151 59.451 59.451 62.486 -3.034 25259 10259 1 13 . 1 1 151 151 SER H H 151 8.519 8.519 8.090 0.429 25259 10260 1 13 . 1 1 152 152 LYS N N 152 126.710 126.710 123.172 3.538 25259 10261 1 13 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.091 0.157 25259 10262 1 13 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.525 -3.760 25259 10263 1 13 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.860 -2.603 25259 10264 1 13 . 1 1 152 152 LYS H H 152 7.006 7.006 7.445 -0.439 25259 10265 1 13 . 1 1 153 153 TYR N N 153 123.239 123.239 117.522 5.717 25259 10266 1 13 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.387 -0.129 25259 10267 1 13 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.391 0.918 25259 10268 1 13 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.261 -0.927 25259 10269 1 13 . 1 1 153 153 TYR H H 153 8.058 8.058 8.351 -0.293 25259 10270 1 13 . 1 1 154 154 ILE N N 154 120.253 120.253 122.069 -1.816 25259 10271 1 13 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.084 0.289 25259 10272 1 13 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.547 -2.433 25259 10273 1 13 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.215 -1.268 25259 10274 1 13 . 1 1 154 154 ILE H H 154 8.193 8.193 7.696 0.497 25259 10275 1 13 . 1 1 155 155 SER N N 155 117.178 117.178 114.921 2.257 25259 10276 1 13 . 1 1 155 155 SER HA H 155 4.091 4.091 3.927 0.164 25259 10277 1 13 . 1 1 155 155 SER CA C 155 59.961 59.961 61.984 -2.023 25259 10278 1 13 . 1 1 155 155 SER CB C 155 60.148 60.148 62.764 -2.616 25259 10279 1 13 . 1 1 155 155 SER H H 155 8.020 8.020 8.066 -0.046 25259 10280 1 13 . 1 1 156 156 ASP N N 156 125.479 125.479 121.188 4.291 25259 10281 1 13 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.369 0.058 25259 10282 1 13 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.967 -2.207 25259 10283 1 13 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.875 -3.002 25259 10284 1 13 . 1 1 156 156 ASP H H 156 8.638 8.638 7.793 0.845 25259 10285 1 13 . 1 1 157 157 ARG N N 157 121.542 121.542 118.970 2.572 25259 10286 1 13 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.055 0.056 25259 10287 1 13 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.179 -2.251 25259 10288 1 13 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.608 -1.792 25259 10289 1 13 . 1 1 157 157 ARG H H 157 7.888 7.888 8.031 -0.143 25259 10290 1 13 . 1 1 158 158 LEU N N 158 124.257 124.257 120.465 3.792 25259 10291 1 13 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.181 0.090 25259 10292 1 13 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.219 -3.006 25259 10293 1 13 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.590 -2.645 25259 10294 1 13 . 1 1 158 158 LEU H H 158 8.442 8.442 8.181 0.261 25259 10295 1 13 . 1 1 159 159 ALA N N 159 124.146 124.146 121.488 2.658 25259 10296 1 13 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.074 0.258 25259 10297 1 13 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.633 -3.201 25259 10298 1 13 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.030 -2.123 25259 10299 1 13 . 1 1 159 159 ALA H H 159 8.086 8.086 8.251 -0.165 25259 10300 1 13 . 1 1 160 160 ASN N N 160 118.093 118.093 116.178 1.915 25259 10301 1 13 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.694 0.298 25259 10302 1 13 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.905 -2.328 25259 10303 1 13 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.627 -0.894 25259 10304 1 13 . 1 1 160 160 ASN H H 160 7.445 7.445 7.630 -0.185 25259 10305 1 13 . 1 1 161 161 GLY N N 161 108.365 108.365 106.942 1.423 25259 10306 1 13 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.387 -1.741 25259 10307 1 13 . 1 1 161 161 GLY H H 161 7.743 7.743 7.958 -0.215 25259 10308 1 13 . 1 1 162 162 ALA N N 162 123.928 123.928 121.182 2.746 25259 10309 1 13 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.143 -0.270 25259 10310 1 13 . 1 1 162 162 ALA CA C 162 49.526 49.526 50.852 -1.326 25259 10311 1 13 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.854 -3.794 25259 10312 1 13 . 1 1 162 162 ALA H H 162 8.035 8.035 7.287 0.748 25259 10313 1 13 . 1 1 163 163 THR N N 163 113.286 113.286 111.256 2.030 25259 10314 1 13 . 1 1 163 163 THR HA H 163 4.703 4.703 4.667 0.036 25259 10315 1 13 . 1 1 163 163 THR CA C 163 57.791 57.791 60.866 -3.075 25259 10316 1 13 . 1 1 163 163 THR CB C 163 68.974 68.974 71.275 -2.301 25259 10317 1 13 . 1 1 163 163 THR H H 163 8.451 8.451 8.524 -0.073 25259 10318 1 13 . 1 1 164 164 GLU N N 164 125.905 125.905 120.659 5.246 25259 10319 1 13 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.502 0.558 25259 10320 1 13 . 1 1 164 164 GLU CA C 164 53.585 53.585 57.028 -3.443 25259 10321 1 13 . 1 1 164 164 GLU CB C 164 29.211 29.211 30.519 -1.308 25259 10322 1 13 . 1 1 164 164 GLU H H 164 8.716 8.716 8.676 0.040 25259 10323 1 14 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.091 -0.416 25259 10324 1 14 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.708 -2.900 25259 10325 1 14 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.262 -3.192 25259 10326 1 14 . 1 1 3 3 ALA N N 3 126.741 126.741 122.988 3.753 25259 10327 1 14 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.415 0.079 25259 10328 1 14 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.669 -1.467 25259 10329 1 14 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.859 -4.041 25259 10330 1 14 . 1 1 3 3 ALA H H 3 8.440 8.440 8.291 0.149 25259 10331 1 14 . 1 1 4 4 THR N N 4 116.015 116.015 113.477 2.538 25259 10332 1 14 . 1 1 4 4 THR HA H 4 4.393 4.393 4.470 -0.077 25259 10333 1 14 . 1 1 4 4 THR CA C 4 59.148 59.148 62.042 -2.894 25259 10334 1 14 . 1 1 4 4 THR CB C 4 67.580 67.580 68.815 -1.235 25259 10335 1 14 . 1 1 4 4 THR H H 4 8.050 8.050 8.143 -0.093 25259 10336 1 14 . 1 1 5 5 LYS N N 5 126.350 126.350 127.201 -0.851 25259 10337 1 14 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.441 0.064 25259 10338 1 14 . 1 1 5 5 LYS CA C 5 53.917 53.917 56.532 -2.615 25259 10339 1 14 . 1 1 5 5 LYS CB C 5 30.684 30.684 32.664 -1.980 25259 10340 1 14 . 1 1 5 5 LYS H H 5 8.332 8.332 8.438 -0.106 25259 10341 1 14 . 1 1 6 6 THR N N 6 118.124 118.124 119.237 -1.113 25259 10342 1 14 . 1 1 6 6 THR HA H 6 4.440 4.440 4.553 -0.113 25259 10343 1 14 . 1 1 6 6 THR CA C 6 59.282 59.282 61.356 -2.074 25259 10344 1 14 . 1 1 6 6 THR CB C 6 67.685 67.685 71.095 -3.410 25259 10345 1 14 . 1 1 6 6 THR H H 6 8.283 8.283 8.448 -0.165 25259 10346 1 14 . 1 1 7 7 GLU N N 7 125.934 125.934 120.127 5.807 25259 10347 1 14 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.649 -0.304 25259 10348 1 14 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.774 -1.593 25259 10349 1 14 . 1 1 7 7 GLU CB C 7 27.816 27.816 31.328 -3.512 25259 10350 1 14 . 1 1 7 7 GLU H H 7 8.487 8.487 8.542 -0.055 25259 10351 1 14 . 1 1 8 8 LYS N N 8 123.945 123.945 120.020 3.925 25259 10352 1 14 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.787 -1.852 25259 10353 1 14 . 1 1 8 8 LYS CB C 8 30.565 30.565 35.140 -4.575 25259 10354 1 14 . 1 1 8 8 LYS H H 8 8.278 8.278 8.798 -0.520 25259 10355 1 14 . 1 1 9 9 ASP N N 9 123.624 123.624 120.690 2.934 25259 10356 1 14 . 1 1 9 9 ASP HA H 9 4.339 4.339 5.077 -0.738 25259 10357 1 14 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.465 -1.342 25259 10358 1 14 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.972 -4.039 25259 10359 1 14 . 1 1 9 9 ASP H H 9 8.277 8.277 8.634 -0.357 25259 10360 1 14 . 1 1 10 10 THR N N 10 116.812 116.812 115.512 1.300 25259 10361 1 14 . 1 1 10 10 THR HA H 10 4.349 4.349 4.552 -0.203 25259 10362 1 14 . 1 1 10 10 THR CA C 10 59.634 59.634 62.030 -2.396 25259 10363 1 14 . 1 1 10 10 THR CB C 10 67.254 67.254 69.810 -2.556 25259 10364 1 14 . 1 1 10 10 THR H H 10 8.049 8.049 8.260 -0.211 25259 10365 1 14 . 1 1 11 11 LEU N N 11 126.610 126.610 124.566 2.044 25259 10366 1 14 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.306 0.086 25259 10367 1 14 . 1 1 11 11 LEU CA C 11 53.078 53.078 55.278 -2.200 25259 10368 1 14 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.667 -3.034 25259 10369 1 14 . 1 1 11 11 LEU H H 11 8.191 8.191 9.072 -0.881 25259 10370 1 14 . 1 1 12 12 GLN N N 12 123.274 123.274 119.117 4.157 25259 10371 1 14 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.848 -0.466 25259 10372 1 14 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.884 -1.310 25259 10373 1 14 . 1 1 12 12 GLN CB C 12 26.803 26.803 30.970 -4.167 25259 10374 1 14 . 1 1 12 12 GLN H H 12 8.280 8.280 8.507 -0.227 25259 10375 1 14 . 1 1 13 13 SER N N 13 119.027 119.027 115.200 3.827 25259 10376 1 14 . 1 1 13 13 SER HA H 13 4.471 4.471 5.060 -0.589 25259 10377 1 14 . 1 1 13 13 SER CA C 13 55.869 55.869 57.714 -1.845 25259 10378 1 14 . 1 1 13 13 SER CB C 13 61.424 61.424 64.963 -3.539 25259 10379 1 14 . 1 1 13 13 SER H H 13 8.178 8.178 8.648 -0.470 25259 10380 1 14 . 1 1 14 14 ALA N N 14 128.314 128.314 124.100 4.214 25259 10381 1 14 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.979 -0.545 25259 10382 1 14 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.809 -2.114 25259 10383 1 14 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.324 -2.243 25259 10384 1 14 . 1 1 14 14 ALA H H 14 8.195 8.195 8.696 -0.501 25259 10385 1 14 . 1 1 15 15 LEU N N 15 125.175 125.175 117.739 7.436 25259 10386 1 14 . 1 1 15 15 LEU HA H 15 4.640 4.640 5.045 -0.405 25259 10387 1 14 . 1 1 15 15 LEU CA C 15 50.604 50.604 52.995 -2.391 25259 10388 1 14 . 1 1 15 15 LEU CB C 15 39.467 39.467 43.153 -3.686 25259 10389 1 14 . 1 1 15 15 LEU H H 15 8.050 8.050 8.668 -0.618 25259 10390 1 14 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.753 -0.249 25259 10391 1 14 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.721 -2.090 25259 10392 1 14 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.714 -3.056 25259 10393 1 14 . 1 1 17 17 VAL N N 17 123.223 123.223 119.812 3.411 25259 10394 1 14 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.367 -0.233 25259 10395 1 14 . 1 1 17 17 VAL CA C 17 59.827 59.827 62.006 -2.179 25259 10396 1 14 . 1 1 17 17 VAL CB C 17 30.377 30.377 32.964 -2.587 25259 10397 1 14 . 1 1 17 17 VAL H H 17 8.134 8.134 8.564 -0.430 25259 10398 1 14 . 1 1 18 18 ILE N N 18 127.777 127.777 118.917 8.860 25259 10399 1 14 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.746 -0.503 25259 10400 1 14 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.286 -1.964 25259 10401 1 14 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.848 -4.594 25259 10402 1 14 . 1 1 18 18 ILE H H 18 8.187 8.187 8.477 -0.290 25259 10403 1 14 . 1 1 19 19 GLU N N 19 128.148 128.148 121.398 6.750 25259 10404 1 14 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.735 -0.398 25259 10405 1 14 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.538 -1.447 25259 10406 1 14 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.023 -3.846 25259 10407 1 14 . 1 1 19 19 GLU H H 19 8.475 8.475 8.813 -0.338 25259 10408 1 14 . 1 1 20 20 ASN N N 20 122.788 122.788 117.429 5.359 25259 10409 1 14 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.762 -0.067 25259 10410 1 14 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.694 -1.872 25259 10411 1 14 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.727 -4.361 25259 10412 1 14 . 1 1 20 20 ASN H H 20 8.477 8.477 8.381 0.096 25259 10413 1 14 . 1 1 21 21 ALA N N 21 127.253 127.253 123.482 3.771 25259 10414 1 14 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.576 -0.255 25259 10415 1 14 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.871 -1.183 25259 10416 1 14 . 1 1 21 21 ALA CB C 21 16.913 16.913 19.157 -2.244 25259 10417 1 14 . 1 1 21 21 ALA H H 21 8.325 8.325 8.603 -0.278 25259 10418 1 14 . 1 1 22 22 GLU N N 22 122.044 122.044 126.087 -4.043 25259 10419 1 14 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.266 0.027 25259 10420 1 14 . 1 1 22 22 GLU CA C 22 54.583 54.583 55.946 -1.363 25259 10421 1 14 . 1 1 22 22 GLU CB C 22 27.285 27.285 27.284 0.001 25259 10422 1 14 . 1 1 22 22 GLU H H 22 8.415 8.415 8.896 -0.481 25259 10423 1 14 . 1 1 23 23 LYS N N 23 123.622 123.622 120.441 3.181 25259 10424 1 14 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.128 0.197 25259 10425 1 14 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.048 -1.552 25259 10426 1 14 . 1 1 23 23 LYS CB C 23 30.653 30.653 32.955 -2.302 25259 10427 1 14 . 1 1 23 23 LYS H H 23 8.127 8.127 7.522 0.605 25259 10428 1 14 . 1 1 24 24 ASN N N 24 120.652 120.652 118.802 1.850 25259 10429 1 14 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.789 0.052 25259 10430 1 14 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.148 -2.485 25259 10431 1 14 . 1 1 24 24 ASN CB C 24 36.775 36.775 38.789 -2.014 25259 10432 1 14 . 1 1 24 24 ASN H H 24 8.424 8.424 8.492 -0.068 25259 10433 1 14 . 1 1 25 25 THR N N 25 117.102 117.102 112.783 4.319 25259 10434 1 14 . 1 1 25 25 THR HA H 25 4.367 4.367 4.681 -0.314 25259 10435 1 14 . 1 1 25 25 THR CA C 25 59.500 59.500 60.812 -1.312 25259 10436 1 14 . 1 1 25 25 THR CB C 25 67.610 67.610 70.813 -3.203 25259 10437 1 14 . 1 1 25 25 THR H H 25 7.852 7.852 8.410 -0.558 25259 10438 1 14 . 1 1 26 26 VAL N N 26 126.491 126.491 120.765 5.726 25259 10439 1 14 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.309 -0.142 25259 10440 1 14 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.628 -1.435 25259 10441 1 14 . 1 1 26 26 VAL CB C 26 29.605 29.605 34.553 -4.948 25259 10442 1 14 . 1 1 26 26 VAL H H 26 8.080 8.080 8.542 -0.462 25259 10443 1 14 . 1 1 27 27 VAL N N 27 132.992 132.992 128.230 4.762 25259 10444 1 14 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.425 -0.344 25259 10445 1 14 . 1 1 27 27 VAL CA C 27 58.984 58.984 61.049 -2.065 25259 10446 1 14 . 1 1 27 27 VAL CB C 27 31.540 31.540 33.820 -2.280 25259 10447 1 14 . 1 1 27 27 VAL H H 27 8.830 8.830 8.962 -0.132 25259 10448 1 14 . 1 1 28 28 THR N N 28 123.576 123.576 121.144 2.432 25259 10449 1 14 . 1 1 28 28 THR HA H 28 5.553 5.553 4.453 1.100 25259 10450 1 14 . 1 1 28 28 THR CA C 28 58.738 58.738 61.352 -2.614 25259 10451 1 14 . 1 1 28 28 THR CB C 28 68.443 68.443 69.060 -0.617 25259 10452 1 14 . 1 1 28 28 THR H H 28 8.165 8.165 8.268 -0.103 25259 10453 1 14 . 1 1 29 29 LYS N N 29 129.099 129.099 126.855 2.244 25259 10454 1 14 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.576 0.366 25259 10455 1 14 . 1 1 29 29 LYS CA C 29 51.779 51.779 54.523 -2.744 25259 10456 1 14 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.762 0.334 25259 10457 1 14 . 1 1 29 29 LYS H H 29 9.273 9.273 7.758 1.515 25259 10458 1 14 . 1 1 30 30 THR N N 30 123.510 123.510 117.906 5.604 25259 10459 1 14 . 1 1 30 30 THR HA H 30 5.428 5.428 4.791 0.637 25259 10460 1 14 . 1 1 30 30 THR CA C 30 59.784 59.784 62.038 -2.254 25259 10461 1 14 . 1 1 30 30 THR CB C 30 67.818 67.818 70.531 -2.713 25259 10462 1 14 . 1 1 30 30 THR H H 30 8.993 8.993 8.380 0.613 25259 10463 1 14 . 1 1 31 31 LEU N N 31 128.293 128.293 124.928 3.365 25259 10464 1 14 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.961 0.259 25259 10465 1 14 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.166 -3.111 25259 10466 1 14 . 1 1 31 31 LEU CB C 31 43.399 43.399 45.968 -2.569 25259 10467 1 14 . 1 1 31 31 LEU H H 31 9.557 9.557 8.613 0.944 25259 10468 1 14 . 1 1 32 32 VAL N N 32 126.919 126.919 120.908 6.011 25259 10469 1 14 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.408 0.043 25259 10470 1 14 . 1 1 32 32 VAL CA C 32 59.664 59.664 60.970 -1.306 25259 10471 1 14 . 1 1 32 32 VAL CB C 32 29.449 29.449 32.127 -2.678 25259 10472 1 14 . 1 1 32 32 VAL H H 32 9.364 9.364 8.789 0.575 25259 10473 1 14 . 1 1 33 33 LEU N N 33 133.503 133.503 129.481 4.022 25259 10474 1 14 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.624 -0.068 25259 10475 1 14 . 1 1 33 33 LEU CA C 33 52.004 52.004 52.426 -0.422 25259 10476 1 14 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.861 -4.014 25259 10477 1 14 . 1 1 33 33 LEU H H 33 8.587 8.587 8.389 0.198 25259 10478 1 14 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.370 0.111 25259 10479 1 14 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.505 -2.060 25259 10480 1 14 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.232 -2.667 25259 10481 1 14 . 1 1 35 35 LYS N N 35 127.420 127.420 119.268 8.152 25259 10482 1 14 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.474 -0.108 25259 10483 1 14 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.318 -1.199 25259 10484 1 14 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.365 -1.771 25259 10485 1 14 . 1 1 35 35 LYS H H 35 8.666 8.666 8.477 0.189 25259 10486 1 14 . 1 1 36 36 SER N N 36 122.222 122.222 116.804 5.418 25259 10487 1 14 . 1 1 36 36 SER HA H 36 4.753 4.753 4.640 0.113 25259 10488 1 14 . 1 1 36 36 SER CA C 36 55.328 55.328 57.564 -2.236 25259 10489 1 14 . 1 1 36 36 SER CB C 36 61.728 61.728 64.717 -2.989 25259 10490 1 14 . 1 1 36 36 SER H H 36 8.771 8.771 8.768 0.003 25259 10491 1 14 . 1 1 37 37 ASP N N 37 126.346 126.346 120.350 5.996 25259 10492 1 14 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.545 -0.091 25259 10493 1 14 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.122 -1.506 25259 10494 1 14 . 1 1 37 37 ASP CB C 37 37.985 37.985 41.037 -3.052 25259 10495 1 14 . 1 1 37 37 ASP H H 37 8.859 8.859 8.653 0.206 25259 10496 1 14 . 1 1 38 38 ASP N N 38 119.171 119.171 119.095 0.076 25259 10497 1 14 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.863 -0.248 25259 10498 1 14 . 1 1 38 38 ASP CA C 38 50.788 50.788 53.629 -2.841 25259 10499 1 14 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.123 -3.488 25259 10500 1 14 . 1 1 38 38 ASP H H 38 7.944 7.944 8.161 -0.217 25259 10501 1 14 . 1 1 39 39 GLY N N 39 110.352 110.352 107.697 2.655 25259 10502 1 14 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.420 -2.659 25259 10503 1 14 . 1 1 39 39 GLY H H 39 8.145 8.145 8.185 -0.040 25259 10504 1 14 . 1 1 40 40 SER N N 40 120.090 120.090 114.931 5.159 25259 10505 1 14 . 1 1 40 40 SER HA H 40 4.877 4.877 5.070 -0.193 25259 10506 1 14 . 1 1 40 40 SER CA C 40 56.525 56.525 57.356 -0.831 25259 10507 1 14 . 1 1 40 40 SER CB C 40 62.245 62.245 65.183 -2.938 25259 10508 1 14 . 1 1 40 40 SER H H 40 8.344 8.344 7.750 0.594 25259 10509 1 14 . 1 1 41 41 GLN N N 41 122.551 122.551 123.698 -1.147 25259 10510 1 14 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.725 0.202 25259 10511 1 14 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.549 -1.135 25259 10512 1 14 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.386 -3.072 25259 10513 1 14 . 1 1 41 41 GLN H H 41 8.627 8.627 9.183 -0.556 25259 10514 1 14 . 1 1 42 42 GLN N N 42 131.724 131.724 118.476 13.248 25259 10515 1 14 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.679 0.932 25259 10516 1 14 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.414 -2.342 25259 10517 1 14 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.394 -2.075 25259 10518 1 14 . 1 1 42 42 GLN H H 42 9.189 9.189 8.715 0.474 25259 10519 1 14 . 1 1 43 43 THR N N 43 122.202 122.202 113.969 8.233 25259 10520 1 14 . 1 1 43 43 THR HA H 43 5.380 5.380 5.087 0.293 25259 10521 1 14 . 1 1 43 43 THR CA C 43 58.863 58.863 61.371 -2.508 25259 10522 1 14 . 1 1 43 43 THR CB C 43 68.893 68.893 72.603 -3.710 25259 10523 1 14 . 1 1 43 43 THR H H 43 9.139 9.139 8.087 1.052 25259 10524 1 14 . 1 1 44 44 GLN N N 44 127.190 127.190 121.700 5.490 25259 10525 1 14 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.240 0.394 25259 10526 1 14 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.751 -3.083 25259 10527 1 14 . 1 1 44 44 GLN CB C 44 28.910 28.910 33.203 -4.293 25259 10528 1 14 . 1 1 44 44 GLN H H 44 9.760 9.760 8.743 1.017 25259 10529 1 14 . 1 1 45 45 THR N N 45 123.479 123.479 119.446 4.033 25259 10530 1 14 . 1 1 45 45 THR HA H 45 5.421 5.421 4.810 0.611 25259 10531 1 14 . 1 1 45 45 THR CA C 45 60.071 60.071 62.654 -2.583 25259 10532 1 14 . 1 1 45 45 THR CB C 45 67.541 67.541 69.923 -2.382 25259 10533 1 14 . 1 1 45 45 THR H H 45 9.518 9.518 8.519 0.999 25259 10534 1 14 . 1 1 46 46 ILE N N 46 133.908 133.908 127.927 5.981 25259 10535 1 14 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.736 0.267 25259 10536 1 14 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.503 -2.032 25259 10537 1 14 . 1 1 46 46 ILE CB C 46 39.945 39.945 38.826 1.119 25259 10538 1 14 . 1 1 46 46 ILE H H 46 9.830 9.830 8.923 0.907 25259 10539 1 14 . 1 1 47 47 THR N N 47 124.701 124.701 123.043 1.658 25259 10540 1 14 . 1 1 47 47 THR HA H 47 6.048 6.048 4.637 1.411 25259 10541 1 14 . 1 1 47 47 THR CA C 47 58.551 58.551 63.601 -5.050 25259 10542 1 14 . 1 1 47 47 THR CB C 47 67.819 67.819 69.255 -1.436 25259 10543 1 14 . 1 1 47 47 THR H H 47 8.843 8.843 8.496 0.347 25259 10544 1 14 . 1 1 48 48 TYR N N 48 127.369 127.369 121.848 5.521 25259 10545 1 14 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.107 0.171 25259 10546 1 14 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.392 -2.663 25259 10547 1 14 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.367 -1.935 25259 10548 1 14 . 1 1 48 48 TYR H H 48 9.638 9.638 8.353 1.285 25259 10549 1 14 . 1 1 49 49 LYS N N 49 122.138 122.138 118.017 4.121 25259 10550 1 14 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.596 0.060 25259 10551 1 14 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.433 -3.461 25259 10552 1 14 . 1 1 49 49 LYS CB C 49 33.603 33.603 33.930 -0.327 25259 10553 1 14 . 1 1 49 49 LYS H H 49 8.560 8.560 8.892 -0.332 25259 10554 1 14 . 1 1 50 50 ASP N N 50 130.208 130.208 120.475 9.733 25259 10555 1 14 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.707 -0.403 25259 10556 1 14 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.846 -0.086 25259 10557 1 14 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.928 -5.589 25259 10558 1 14 . 1 1 50 50 ASP H H 50 9.597 9.597 8.424 1.173 25259 10559 1 14 . 1 1 51 51 LYS N N 51 124.586 124.586 117.789 6.797 25259 10560 1 14 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.373 0.158 25259 10561 1 14 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.455 -2.721 25259 10562 1 14 . 1 1 51 51 LYS CB C 51 30.395 30.395 33.916 -3.521 25259 10563 1 14 . 1 1 51 51 LYS H H 51 8.450 8.450 8.052 0.398 25259 10564 1 14 . 1 1 52 52 THR N N 52 120.044 120.044 115.267 4.777 25259 10565 1 14 . 1 1 52 52 THR HA H 52 4.717 4.717 4.451 0.266 25259 10566 1 14 . 1 1 52 52 THR CA C 52 59.313 59.313 61.227 -1.914 25259 10567 1 14 . 1 1 52 52 THR CB C 52 68.815 68.815 70.988 -2.173 25259 10568 1 14 . 1 1 52 52 THR H H 52 8.658 8.658 7.423 1.235 25259 10569 1 14 . 1 1 53 53 PHE N N 53 128.987 128.987 124.135 4.852 25259 10570 1 14 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.438 -0.155 25259 10571 1 14 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.423 -1.434 25259 10572 1 14 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.298 1.012 25259 10573 1 14 . 1 1 53 53 PHE H H 53 9.218 9.218 8.685 0.533 25259 10574 1 14 . 1 1 54 54 LEU N N 54 124.874 124.874 125.441 -0.567 25259 10575 1 14 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.225 0.704 25259 10576 1 14 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.340 -3.099 25259 10577 1 14 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.526 -2.009 25259 10578 1 14 . 1 1 54 54 LEU H H 54 9.391 9.391 8.776 0.615 25259 10579 1 14 . 1 1 55 55 SER N N 55 115.516 115.516 108.543 6.973 25259 10580 1 14 . 1 1 55 55 SER HA H 55 5.194 5.194 5.444 -0.250 25259 10581 1 14 . 1 1 55 55 SER CA C 55 55.818 55.818 57.058 -1.240 25259 10582 1 14 . 1 1 55 55 SER CB C 55 63.474 63.474 66.919 -3.445 25259 10583 1 14 . 1 1 55 55 SER H H 55 8.736 8.736 7.688 1.048 25259 10584 1 14 . 1 1 56 56 LEU N N 56 124.352 124.352 121.472 2.880 25259 10585 1 14 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.144 0.399 25259 10586 1 14 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.550 -2.913 25259 10587 1 14 . 1 1 56 56 LEU CB C 56 45.513 45.513 45.976 -0.463 25259 10588 1 14 . 1 1 56 56 LEU H H 56 8.328 8.328 8.690 -0.362 25259 10589 1 14 . 1 1 57 57 ALA N N 57 131.450 131.450 130.812 0.638 25259 10590 1 14 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.186 0.319 25259 10591 1 14 . 1 1 57 57 ALA CA C 57 48.202 48.202 49.992 -1.790 25259 10592 1 14 . 1 1 57 57 ALA CB C 57 18.964 18.964 20.302 -1.338 25259 10593 1 14 . 1 1 57 57 ALA H H 57 9.208 9.208 8.360 0.848 25259 10594 1 14 . 1 1 58 58 ILE N N 58 126.248 126.248 126.382 -0.134 25259 10595 1 14 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.258 0.526 25259 10596 1 14 . 1 1 58 58 ILE CA C 58 58.247 58.247 62.127 -3.880 25259 10597 1 14 . 1 1 58 58 ILE CB C 58 38.045 38.045 37.219 0.826 25259 10598 1 14 . 1 1 58 58 ILE H H 58 9.597 9.597 8.116 1.481 25259 10599 1 14 . 1 1 59 59 GLN N N 59 132.065 132.065 128.101 3.964 25259 10600 1 14 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.531 0.716 25259 10601 1 14 . 1 1 59 59 GLN CA C 59 52.164 52.164 56.203 -4.039 25259 10602 1 14 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.761 -1.100 25259 10603 1 14 . 1 1 59 59 GLN H H 59 9.389 9.389 8.652 0.737 25259 10604 1 14 . 1 1 60 60 GLN N N 60 130.314 130.314 118.249 12.065 25259 10605 1 14 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.822 0.387 25259 10606 1 14 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.388 -3.367 25259 10607 1 14 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.660 -4.184 25259 10608 1 14 . 1 1 60 60 GLN H H 60 9.471 9.471 8.813 0.658 25259 10609 1 14 . 1 1 61 61 LYS N N 61 131.044 131.044 124.912 6.132 25259 10610 1 14 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.159 0.256 25259 10611 1 14 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.290 -3.170 25259 10612 1 14 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.927 -3.510 25259 10613 1 14 . 1 1 61 61 LYS H H 61 8.893 8.893 9.113 -0.220 25259 10614 1 14 . 1 1 62 62 ARG N N 62 125.397 125.397 121.985 3.412 25259 10615 1 14 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.299 -0.296 25259 10616 1 14 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.602 -2.511 25259 10617 1 14 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.767 -1.889 25259 10618 1 14 . 1 1 62 62 ARG H H 62 9.120 9.120 8.647 0.473 25259 10619 1 14 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.858 0.117 25259 10620 1 14 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.758 -3.261 25259 10621 1 14 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.411 -2.527 25259 10622 1 14 . 1 1 64 64 VAL N N 64 121.305 121.305 114.739 6.566 25259 10623 1 14 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.621 -0.597 25259 10624 1 14 . 1 1 64 64 VAL CA C 64 59.677 59.677 59.711 -0.034 25259 10625 1 14 . 1 1 64 64 VAL CB C 64 30.365 30.365 34.613 -4.248 25259 10626 1 14 . 1 1 64 64 VAL H H 64 7.520 7.520 8.595 -1.075 25259 10627 1 14 . 1 1 65 65 SER N N 65 123.215 123.215 115.397 7.818 25259 10628 1 14 . 1 1 65 65 SER HA H 65 4.521 4.521 4.839 -0.318 25259 10629 1 14 . 1 1 65 65 SER CA C 65 54.897 54.897 56.647 -1.750 25259 10630 1 14 . 1 1 65 65 SER CB C 65 62.564 62.564 65.752 -3.188 25259 10631 1 14 . 1 1 65 65 SER H H 65 8.080 8.080 8.448 -0.368 25259 10632 1 14 . 1 1 66 66 ASP N N 66 123.802 123.802 122.005 1.797 25259 10633 1 14 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.456 -0.027 25259 10634 1 14 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.822 -1.444 25259 10635 1 14 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.509 -2.471 25259 10636 1 14 . 1 1 66 66 ASP H H 66 8.900 8.900 8.885 0.015 25259 10637 1 14 . 1 1 67 67 GLU N N 67 121.943 121.943 120.188 1.755 25259 10638 1 14 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.032 0.157 25259 10639 1 14 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.051 -1.611 25259 10640 1 14 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.590 -2.805 25259 10641 1 14 . 1 1 67 67 GLU H H 67 8.717 8.717 8.430 0.287 25259 10642 1 14 . 1 1 68 68 LEU N N 68 125.458 125.458 120.928 4.530 25259 10643 1 14 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.126 0.217 25259 10644 1 14 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.108 -2.636 25259 10645 1 14 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.363 -1.959 25259 10646 1 14 . 1 1 68 68 LEU H H 68 7.820 7.820 7.888 -0.068 25259 10647 1 14 . 1 1 69 69 LYS N N 69 123.868 123.868 119.169 4.699 25259 10648 1 14 . 1 1 69 69 LYS HA H 69 4.006 4.006 3.975 0.030 25259 10649 1 14 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.709 -2.092 25259 10650 1 14 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.992 -1.955 25259 10651 1 14 . 1 1 69 69 LYS H H 69 8.690 8.690 8.214 0.476 25259 10652 1 14 . 1 1 70 70 THR N N 70 117.109 117.109 117.214 -0.105 25259 10653 1 14 . 1 1 70 70 THR HA H 70 4.088 4.088 3.906 0.182 25259 10654 1 14 . 1 1 70 70 THR CA C 70 63.879 63.879 66.763 -2.884 25259 10655 1 14 . 1 1 70 70 THR CB C 70 66.383 66.383 68.767 -2.384 25259 10656 1 14 . 1 1 70 70 THR H H 70 7.935 7.935 7.780 0.155 25259 10657 1 14 . 1 1 71 71 TYR N N 71 127.006 127.006 122.264 4.742 25259 10658 1 14 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.227 -0.022 25259 10659 1 14 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.923 -1.698 25259 10660 1 14 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.153 -1.608 25259 10661 1 14 . 1 1 71 71 TYR H H 71 7.683 7.683 7.734 -0.051 25259 10662 1 14 . 1 1 72 72 ILE N N 72 125.064 125.064 120.121 4.943 25259 10663 1 14 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.726 -0.047 25259 10664 1 14 . 1 1 72 72 ILE CA C 72 62.895 62.895 64.990 -2.095 25259 10665 1 14 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.882 -1.606 25259 10666 1 14 . 1 1 72 72 ILE H H 72 9.083 9.083 7.641 1.442 25259 10667 1 14 . 1 1 73 73 ASP N N 73 124.900 124.900 119.486 5.414 25259 10668 1 14 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.406 -0.017 25259 10669 1 14 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.895 -1.857 25259 10670 1 14 . 1 1 73 73 ASP CB C 73 38.107 38.107 41.148 -3.041 25259 10671 1 14 . 1 1 73 73 ASP H H 73 8.751 8.751 8.042 0.709 25259 10672 1 14 . 1 1 74 74 GLN N N 74 117.025 117.025 117.086 -0.061 25259 10673 1 14 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.066 0.072 25259 10674 1 14 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.022 -3.212 25259 10675 1 14 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.311 -1.747 25259 10676 1 14 . 1 1 74 74 GLN H H 74 7.447 7.447 8.226 -0.779 25259 10677 1 14 . 1 1 75 75 HIS N N 75 116.494 116.494 114.136 2.358 25259 10678 1 14 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.726 -0.010 25259 10679 1 14 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.515 -2.449 25259 10680 1 14 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.114 -4.812 25259 10681 1 14 . 1 1 75 75 HIS H H 75 8.402 8.402 8.007 0.395 25259 10682 1 14 . 1 1 76 76 GLY N N 76 112.564 112.564 105.731 6.833 25259 10683 1 14 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.907 -3.011 25259 10684 1 14 . 1 1 76 76 GLY H H 76 9.091 9.091 7.561 1.530 25259 10685 1 14 . 1 1 77 77 VAL N N 77 124.763 124.763 120.259 4.504 25259 10686 1 14 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.849 -0.284 25259 10687 1 14 . 1 1 77 77 VAL CA C 77 64.951 64.951 64.444 0.507 25259 10688 1 14 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.275 -2.437 25259 10689 1 14 . 1 1 77 77 VAL H H 77 8.927 8.927 8.715 0.212 25259 10690 1 14 . 1 1 78 78 GLU N N 78 124.388 124.388 120.718 3.670 25259 10691 1 14 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.038 0.110 25259 10692 1 14 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.921 -1.605 25259 10693 1 14 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.657 -2.198 25259 10694 1 14 . 1 1 78 78 GLU H H 78 8.781 8.781 8.633 0.148 25259 10695 1 14 . 1 1 79 79 GLU N N 79 121.887 121.887 117.643 4.244 25259 10696 1 14 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.158 0.030 25259 10697 1 14 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.860 -2.315 25259 10698 1 14 . 1 1 79 79 GLU CB C 79 27.033 27.033 28.589 -1.556 25259 10699 1 14 . 1 1 79 79 GLU H H 79 9.231 9.231 8.721 0.510 25259 10700 1 14 . 1 1 80 80 THR N N 80 120.781 120.781 117.142 3.639 25259 10701 1 14 . 1 1 80 80 THR HA H 80 4.059 4.059 3.892 0.167 25259 10702 1 14 . 1 1 80 80 THR CA C 80 65.487 65.487 66.474 -0.987 25259 10703 1 14 . 1 1 80 80 THR CB C 80 64.369 64.369 68.631 -4.262 25259 10704 1 14 . 1 1 80 80 THR H H 80 7.858 7.858 8.295 -0.437 25259 10705 1 14 . 1 1 81 81 GLN N N 81 125.303 125.303 121.164 4.139 25259 10706 1 14 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.928 0.116 25259 10707 1 14 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.319 -2.349 25259 10708 1 14 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.434 -2.357 25259 10709 1 14 . 1 1 81 81 GLN H H 81 8.765 8.765 7.771 0.994 25259 10710 1 14 . 1 1 82 82 LYS N N 82 120.458 120.458 119.665 0.793 25259 10711 1 14 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.926 0.163 25259 10712 1 14 . 1 1 82 82 LYS CA C 82 57.312 57.312 59.046 -1.734 25259 10713 1 14 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.870 -1.716 25259 10714 1 14 . 1 1 82 82 LYS H H 82 7.521 7.521 7.769 -0.248 25259 10715 1 14 . 1 1 83 83 ALA N N 83 125.234 125.234 122.203 3.031 25259 10716 1 14 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.780 0.437 25259 10717 1 14 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.717 -2.275 25259 10718 1 14 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.500 -2.213 25259 10719 1 14 . 1 1 83 83 ALA H H 83 7.782 7.782 7.554 0.228 25259 10720 1 14 . 1 1 84 84 LEU N N 84 123.348 123.348 117.679 5.669 25259 10721 1 14 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.881 0.177 25259 10722 1 14 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.462 -1.963 25259 10723 1 14 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.191 -1.883 25259 10724 1 14 . 1 1 84 84 LEU H H 84 8.590 8.590 7.659 0.931 25259 10725 1 14 . 1 1 85 85 LEU N N 85 122.872 122.872 119.574 3.298 25259 10726 1 14 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.954 0.216 25259 10727 1 14 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.543 -2.147 25259 10728 1 14 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.334 -1.593 25259 10729 1 14 . 1 1 85 85 LEU H H 85 7.892 7.892 7.438 0.454 25259 10730 1 14 . 1 1 86 86 GLU N N 86 122.713 122.713 118.960 3.753 25259 10731 1 14 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.961 0.124 25259 10732 1 14 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.224 -2.479 25259 10733 1 14 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.610 -2.707 25259 10734 1 14 . 1 1 86 86 GLU H H 86 8.124 8.124 8.243 -0.119 25259 10735 1 14 . 1 1 87 87 ALA N N 87 123.163 123.163 120.828 2.335 25259 10736 1 14 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.097 0.044 25259 10737 1 14 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.485 -2.217 25259 10738 1 14 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.662 -3.030 25259 10739 1 14 . 1 1 87 87 ALA H H 87 7.765 7.765 7.512 0.253 25259 10740 1 14 . 1 1 88 88 GLU N N 88 121.945 121.945 117.919 4.026 25259 10741 1 14 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.188 -0.104 25259 10742 1 14 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.282 -1.347 25259 10743 1 14 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.360 -1.333 25259 10744 1 14 . 1 1 88 88 GLU H H 88 7.846 7.846 7.849 -0.003 25259 10745 1 14 . 1 1 89 89 GLU N N 89 117.978 117.978 119.990 -2.012 25259 10746 1 14 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.174 -0.081 25259 10747 1 14 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.812 -3.598 25259 10748 1 14 . 1 1 89 89 GLU CB C 89 27.407 27.407 28.963 -1.556 25259 10749 1 14 . 1 1 89 89 GLU H H 89 7.634 7.634 7.947 -0.313 25259 10750 1 14 . 1 1 90 90 LYS N N 90 117.519 117.519 114.778 2.741 25259 10751 1 14 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.453 -0.022 25259 10752 1 14 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.034 -2.016 25259 10753 1 14 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.707 -1.676 25259 10754 1 14 . 1 1 90 90 LYS H H 90 7.247 7.247 7.405 -0.158 25259 10755 1 14 . 1 1 91 91 ASP N N 91 124.888 124.888 123.175 1.713 25259 10756 1 14 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.544 0.139 25259 10757 1 14 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.596 -3.397 25259 10758 1 14 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.413 -2.832 25259 10759 1 14 . 1 1 91 91 ASP H H 91 7.370 7.370 7.503 -0.133 25259 10760 1 14 . 1 1 92 92 LYS N N 92 129.311 129.311 126.216 3.095 25259 10761 1 14 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.999 0.014 25259 10762 1 14 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.662 -2.446 25259 10763 1 14 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.574 -2.559 25259 10764 1 14 . 1 1 92 92 LYS H H 92 8.795 8.795 8.761 0.034 25259 10765 1 14 . 1 1 93 93 SER N N 93 118.112 118.112 115.677 2.435 25259 10766 1 14 . 1 1 93 93 SER HA H 93 4.439 4.439 4.251 0.188 25259 10767 1 14 . 1 1 93 93 SER CA C 93 58.945 58.945 61.092 -2.147 25259 10768 1 14 . 1 1 93 93 SER CB C 93 60.278 60.278 63.000 -2.722 25259 10769 1 14 . 1 1 93 93 SER H H 93 8.488 8.488 8.314 0.174 25259 10770 1 14 . 1 1 94 94 ILE N N 94 128.950 128.950 123.382 5.568 25259 10771 1 14 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.400 0.082 25259 10772 1 14 . 1 1 94 94 ILE CA C 94 62.349 62.349 65.064 -2.716 25259 10773 1 14 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.931 -3.178 25259 10774 1 14 . 1 1 94 94 ILE H H 94 7.722 7.722 8.117 -0.395 25259 10775 1 14 . 1 1 95 95 ILE N N 95 123.598 123.598 119.256 4.342 25259 10776 1 14 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.514 0.081 25259 10777 1 14 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.512 -2.765 25259 10778 1 14 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.463 -1.491 25259 10779 1 14 . 1 1 95 95 ILE H H 95 8.378 8.378 8.122 0.256 25259 10780 1 14 . 1 1 96 96 GLU N N 96 118.317 118.317 118.351 -0.034 25259 10781 1 14 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.914 0.070 25259 10782 1 14 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.327 -2.832 25259 10783 1 14 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.615 -2.442 25259 10784 1 14 . 1 1 96 96 GLU H H 96 7.680 7.680 7.566 0.114 25259 10785 1 14 . 1 1 97 97 ALA N N 97 124.797 124.797 120.643 4.154 25259 10786 1 14 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.983 -0.158 25259 10787 1 14 . 1 1 97 97 ALA CA C 97 52.297 52.297 53.892 -1.595 25259 10788 1 14 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.597 -2.608 25259 10789 1 14 . 1 1 97 97 ALA H H 97 7.383 7.383 7.155 0.228 25259 10790 1 14 . 1 1 98 98 ARG N N 98 115.469 115.469 115.940 -0.471 25259 10791 1 14 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.375 -0.069 25259 10792 1 14 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.257 -0.767 25259 10793 1 14 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.520 -1.282 25259 10794 1 14 . 1 1 98 98 ARG H H 98 8.229 8.229 7.744 0.485 25259 10795 1 14 . 1 1 99 99 LYS N N 99 120.219 120.219 117.701 2.518 25259 10796 1 14 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.141 0.117 25259 10797 1 14 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.279 -2.038 25259 10798 1 14 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.723 -2.227 25259 10799 1 14 . 1 1 99 99 LYS H H 99 7.270 7.270 7.406 -0.136 25259 10800 1 14 . 1 1 100 100 LEU N N 100 123.800 123.800 120.008 3.792 25259 10801 1 14 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.431 -0.090 25259 10802 1 14 . 1 1 100 100 LEU CA C 100 52.079 52.079 53.970 -1.891 25259 10803 1 14 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.069 -2.938 25259 10804 1 14 . 1 1 100 100 LEU H H 100 7.837 7.837 7.744 0.093 25259 10805 1 14 . 1 1 101 101 ALA N N 101 130.512 130.512 124.084 6.428 25259 10806 1 14 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.470 -0.094 25259 10807 1 14 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.127 -2.723 25259 10808 1 14 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.952 -3.156 25259 10809 1 14 . 1 1 101 101 ALA H H 101 8.213 8.213 8.967 -0.754 25259 10810 1 14 . 1 1 102 102 GLY N N 102 110.659 110.659 105.565 5.094 25259 10811 1 14 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.806 -0.913 25259 10812 1 14 . 1 1 102 102 GLY H H 102 8.738 8.738 7.999 0.739 25259 10813 1 14 . 1 1 103 103 PHE N N 103 123.097 123.097 122.492 0.605 25259 10814 1 14 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.164 0.056 25259 10815 1 14 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.487 -2.719 25259 10816 1 14 . 1 1 103 103 PHE CB C 103 40.574 40.574 41.650 -1.076 25259 10817 1 14 . 1 1 103 103 PHE H H 103 7.514 7.514 7.535 -0.021 25259 10818 1 14 . 1 1 104 104 LYS N N 104 130.652 130.652 126.653 3.999 25259 10819 1 14 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.473 -0.353 25259 10820 1 14 . 1 1 104 104 LYS CA C 104 52.979 52.979 53.793 -0.814 25259 10821 1 14 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.532 -2.296 25259 10822 1 14 . 1 1 104 104 LYS H H 104 7.473 7.473 8.327 -0.854 25259 10823 1 14 . 1 1 105 105 LEU N N 105 127.372 127.372 124.449 2.923 25259 10824 1 14 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.903 0.093 25259 10825 1 14 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.145 -2.409 25259 10826 1 14 . 1 1 105 105 LEU CB C 105 43.964 43.964 44.749 -0.785 25259 10827 1 14 . 1 1 105 105 LEU H H 105 8.393 8.393 8.174 0.219 25259 10828 1 14 . 1 1 106 106 GLU N N 106 129.358 129.358 125.496 3.862 25259 10829 1 14 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.834 0.010 25259 10830 1 14 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.856 -2.066 25259 10831 1 14 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.385 -1.756 25259 10832 1 14 . 1 1 106 106 GLU H H 106 8.849 8.849 8.888 -0.039 25259 10833 1 14 . 1 1 107 107 THR N N 107 131.118 131.118 113.218 17.900 25259 10834 1 14 . 1 1 107 107 THR HA H 107 5.110 5.110 5.164 -0.054 25259 10835 1 14 . 1 1 107 107 THR CA C 107 59.832 59.832 61.137 -1.305 25259 10836 1 14 . 1 1 107 107 THR CB C 107 66.671 66.671 71.926 -5.255 25259 10837 1 14 . 1 1 107 107 THR H H 107 9.433 9.433 8.236 1.197 25259 10838 1 14 . 1 1 108 108 LYS N N 108 129.114 129.114 119.792 9.322 25259 10839 1 14 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.645 0.179 25259 10840 1 14 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.100 -2.906 25259 10841 1 14 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.152 -0.764 25259 10842 1 14 . 1 1 108 108 LYS H H 108 9.410 9.410 9.047 0.363 25259 10843 1 14 . 1 1 109 109 LEU N N 109 129.323 129.323 123.290 6.033 25259 10844 1 14 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.516 0.188 25259 10845 1 14 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.477 -2.369 25259 10846 1 14 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.335 -2.680 25259 10847 1 14 . 1 1 109 109 LEU H H 109 8.862 8.862 8.568 0.294 25259 10848 1 14 . 1 1 110 110 LEU N N 110 129.123 129.123 127.678 1.445 25259 10849 1 14 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.233 -0.010 25259 10850 1 14 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.486 -2.704 25259 10851 1 14 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.376 -1.715 25259 10852 1 14 . 1 1 110 110 LEU H H 110 8.373 8.373 8.613 -0.240 25259 10853 1 14 . 1 1 111 111 SER N N 111 114.587 114.587 110.732 3.855 25259 10854 1 14 . 1 1 111 111 SER HA H 111 4.557 4.557 4.545 0.012 25259 10855 1 14 . 1 1 111 111 SER CA C 111 53.889 53.889 57.031 -3.142 25259 10856 1 14 . 1 1 111 111 SER CB C 111 61.830 61.830 64.418 -2.588 25259 10857 1 14 . 1 1 111 111 SER H H 111 8.400 8.400 7.843 0.557 25259 10858 1 14 . 1 1 112 112 ALA N N 112 118.269 118.269 123.126 -4.857 25259 10859 1 14 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.249 0.060 25259 10860 1 14 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.574 -3.360 25259 10861 1 14 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.469 -1.881 25259 10862 1 14 . 1 1 112 112 ALA H H 112 8.556 8.556 8.617 -0.061 25259 10863 1 14 . 1 1 113 113 THR N N 113 102.878 102.878 103.078 -0.200 25259 10864 1 14 . 1 1 113 113 THR HA H 113 4.662 4.662 4.492 0.170 25259 10865 1 14 . 1 1 113 113 THR CA C 113 58.689 58.689 61.271 -2.582 25259 10866 1 14 . 1 1 113 113 THR CB C 113 67.905 67.905 69.015 -1.110 25259 10867 1 14 . 1 1 113 113 THR H H 113 8.065 8.065 7.726 0.339 25259 10868 1 14 . 1 1 114 114 GLU N N 114 126.514 126.514 118.954 7.560 25259 10869 1 14 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.076 -0.062 25259 10870 1 14 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.355 -1.348 25259 10871 1 14 . 1 1 114 114 GLU CB C 114 32.913 32.913 33.463 -0.550 25259 10872 1 14 . 1 1 114 114 GLU H H 114 7.357 7.357 7.939 -0.582 25259 10873 1 14 . 1 1 115 115 LEU N N 115 128.058 128.058 115.822 12.236 25259 10874 1 14 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.277 -0.355 25259 10875 1 14 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.248 -1.924 25259 10876 1 14 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.611 -2.472 25259 10877 1 14 . 1 1 115 115 LEU H H 115 8.930 8.930 8.965 -0.035 25259 10878 1 14 . 1 1 116 116 GLN N N 116 126.540 126.540 118.841 7.699 25259 10879 1 14 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.137 0.578 25259 10880 1 14 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.691 -2.991 25259 10881 1 14 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.372 -1.080 25259 10882 1 14 . 1 1 116 116 GLN H H 116 9.221 9.221 8.846 0.375 25259 10883 1 14 . 1 1 117 117 THR N N 117 125.213 125.213 121.826 3.387 25259 10884 1 14 . 1 1 117 117 THR HA H 117 5.353 5.353 5.348 0.005 25259 10885 1 14 . 1 1 117 117 THR CA C 117 58.926 58.926 60.687 -1.761 25259 10886 1 14 . 1 1 117 117 THR CB C 117 68.948 68.948 71.797 -2.849 25259 10887 1 14 . 1 1 117 117 THR H H 117 9.030 9.030 8.824 0.206 25259 10888 1 14 . 1 1 118 118 THR N N 118 127.799 127.799 117.499 10.300 25259 10889 1 14 . 1 1 118 118 THR HA H 118 5.527 5.527 5.161 0.366 25259 10890 1 14 . 1 1 118 118 THR CA C 118 59.201 59.201 62.123 -2.922 25259 10891 1 14 . 1 1 118 118 THR CB C 118 67.721 67.721 72.251 -4.530 25259 10892 1 14 . 1 1 118 118 THR H H 118 9.459 9.459 8.937 0.522 25259 10893 1 14 . 1 1 119 119 THR N N 119 129.258 129.258 121.553 7.705 25259 10894 1 14 . 1 1 119 119 THR HA H 119 4.885 4.885 4.545 0.340 25259 10895 1 14 . 1 1 119 119 THR CA C 119 58.463 58.463 61.461 -2.998 25259 10896 1 14 . 1 1 119 119 THR CB C 119 67.459 67.459 69.892 -2.433 25259 10897 1 14 . 1 1 119 119 THR H H 119 9.147 9.147 8.903 0.244 25259 10898 1 14 . 1 1 120 120 SER N N 120 123.389 123.389 121.899 1.490 25259 10899 1 14 . 1 1 120 120 SER HA H 120 5.328 5.328 4.779 0.549 25259 10900 1 14 . 1 1 120 120 SER CA C 120 54.386 54.386 56.675 -2.289 25259 10901 1 14 . 1 1 120 120 SER CB C 120 63.031 63.031 63.397 -0.366 25259 10902 1 14 . 1 1 120 120 SER H H 120 8.786 8.786 8.419 0.367 25259 10903 1 14 . 1 1 121 121 PHE N N 121 121.245 121.245 127.724 -6.479 25259 10904 1 14 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.794 0.318 25259 10905 1 14 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.386 -3.194 25259 10906 1 14 . 1 1 121 121 PHE CB C 121 40.265 40.265 38.242 2.023 25259 10907 1 14 . 1 1 121 121 PHE H H 121 8.831 8.831 9.036 -0.205 25259 10908 1 14 . 1 1 122 122 ASP N N 122 124.765 124.765 126.567 -1.802 25259 10909 1 14 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.820 0.020 25259 10910 1 14 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.710 -3.873 25259 10911 1 14 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.209 -1.724 25259 10912 1 14 . 1 1 122 122 ASP H H 122 8.819 8.819 8.827 -0.008 25259 10913 1 14 . 1 1 123 123 PHE N N 123 124.303 124.303 123.131 1.172 25259 10914 1 14 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.211 0.463 25259 10915 1 14 . 1 1 123 123 PHE CA C 123 57.798 57.798 61.695 -3.897 25259 10916 1 14 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.826 -3.286 25259 10917 1 14 . 1 1 123 123 PHE H H 123 8.262 8.262 8.050 0.212 25259 10918 1 14 . 1 1 124 124 GLN N N 124 120.792 120.792 118.212 2.580 25259 10919 1 14 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.120 0.314 25259 10920 1 14 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.673 -2.590 25259 10921 1 14 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.949 -1.820 25259 10922 1 14 . 1 1 124 124 GLN H H 124 8.954 8.954 8.216 0.738 25259 10923 1 14 . 1 1 125 125 VAL N N 125 114.091 114.091 110.520 3.571 25259 10924 1 14 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.338 0.071 25259 10925 1 14 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.286 -1.988 25259 10926 1 14 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.222 -0.650 25259 10927 1 14 . 1 1 125 125 VAL H H 125 7.026 7.026 7.941 -0.915 25259 10928 1 14 . 1 1 126 126 LEU N N 126 125.158 125.158 123.669 1.489 25259 10929 1 14 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.548 -0.073 25259 10930 1 14 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.398 -1.223 25259 10931 1 14 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.160 -1.107 25259 10932 1 14 . 1 1 126 126 LEU H H 126 8.106 8.106 7.569 0.537 25259 10933 1 14 . 1 1 127 127 ASP N N 127 130.026 130.026 129.585 0.441 25259 10934 1 14 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.672 0.169 25259 10935 1 14 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.914 -3.716 25259 10936 1 14 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.370 -2.681 25259 10937 1 14 . 1 1 127 127 ASP H H 127 9.129 9.129 8.934 0.195 25259 10938 1 14 . 1 1 128 128 VAL N N 128 128.833 128.833 124.515 4.318 25259 10939 1 14 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.659 -0.135 25259 10940 1 14 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.411 -2.743 25259 10941 1 14 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.752 -2.257 25259 10942 1 14 . 1 1 128 128 VAL H H 128 8.288 8.288 7.985 0.303 25259 10943 1 14 . 1 1 129 129 LYS N N 129 123.914 123.914 120.578 3.336 25259 10944 1 14 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.952 0.091 25259 10945 1 14 . 1 1 129 129 LYS CA C 129 56.789 56.789 60.016 -3.227 25259 10946 1 14 . 1 1 129 129 LYS CB C 129 28.937 28.937 32.338 -3.401 25259 10947 1 14 . 1 1 129 129 LYS H H 129 8.226 8.226 8.345 -0.119 25259 10948 1 14 . 1 1 130 130 LYS N N 130 121.888 121.888 117.789 4.099 25259 10949 1 14 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.095 -0.010 25259 10950 1 14 . 1 1 130 130 LYS CA C 130 56.146 56.146 58.413 -2.268 25259 10951 1 14 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.106 -1.766 25259 10952 1 14 . 1 1 130 130 LYS H H 130 7.590 7.590 7.839 -0.249 25259 10953 1 14 . 1 1 131 131 ALA N N 131 123.088 123.088 122.280 0.808 25259 10954 1 14 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.217 -0.290 25259 10955 1 14 . 1 1 131 131 ALA CA C 131 52.402 52.402 54.934 -2.532 25259 10956 1 14 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.833 -2.386 25259 10957 1 14 . 1 1 131 131 ALA H H 131 8.506 8.506 8.071 0.435 25259 10958 1 14 . 1 1 132 132 SER N N 132 110.456 110.456 113.580 -3.124 25259 10959 1 14 . 1 1 132 132 SER HA H 132 4.117 4.117 4.094 0.023 25259 10960 1 14 . 1 1 132 132 SER CA C 132 58.289 58.289 61.273 -2.984 25259 10961 1 14 . 1 1 132 132 SER CB C 132 61.034 61.034 62.940 -1.906 25259 10962 1 14 . 1 1 132 132 SER H H 132 7.986 7.986 8.348 -0.362 25259 10963 1 14 . 1 1 133 133 GLN N N 133 119.034 119.034 118.767 0.267 25259 10964 1 14 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.391 0.011 25259 10965 1 14 . 1 1 133 133 GLN CA C 133 52.525 52.525 55.492 -2.967 25259 10966 1 14 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.623 -1.389 25259 10967 1 14 . 1 1 133 133 GLN H H 133 7.233 7.233 7.517 -0.284 25259 10968 1 14 . 1 1 134 134 LEU N N 134 123.291 123.291 120.772 2.519 25259 10969 1 14 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.679 -0.286 25259 10970 1 14 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.453 -1.137 25259 10971 1 14 . 1 1 134 134 LEU CB C 134 38.847 38.847 43.111 -4.264 25259 10972 1 14 . 1 1 134 134 LEU H H 134 7.411 7.411 7.528 -0.117 25259 10973 1 14 . 1 1 135 135 GLU N N 135 128.446 128.446 122.792 5.654 25259 10974 1 14 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.894 0.052 25259 10975 1 14 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.290 -1.906 25259 10976 1 14 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.878 -2.582 25259 10977 1 14 . 1 1 135 135 GLU H H 135 8.986 8.986 8.944 0.042 25259 10978 1 14 . 1 1 136 136 HIS N N 136 117.593 117.593 117.402 0.191 25259 10979 1 14 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.384 -0.001 25259 10980 1 14 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.677 -1.992 25259 10981 1 14 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.898 -1.485 25259 10982 1 14 . 1 1 136 136 HIS H H 136 9.226 9.226 7.828 1.398 25259 10983 1 14 . 1 1 137 137 LEU N N 137 115.463 115.463 116.844 -1.381 25259 10984 1 14 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.337 0.170 25259 10985 1 14 . 1 1 137 137 LEU CA C 137 51.948 51.948 55.602 -3.654 25259 10986 1 14 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.079 -2.272 25259 10987 1 14 . 1 1 137 137 LEU H H 137 7.090 7.090 7.675 -0.585 25259 10988 1 14 . 1 1 138 138 LYS N N 138 124.686 124.686 120.459 4.227 25259 10989 1 14 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.088 0.081 25259 10990 1 14 . 1 1 138 138 LYS CA C 138 57.158 57.158 59.534 -2.376 25259 10991 1 14 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.345 -2.257 25259 10992 1 14 . 1 1 138 138 LYS H H 138 7.698 7.698 7.873 -0.175 25259 10993 1 14 . 1 1 139 139 ASN N N 139 118.077 118.077 114.133 3.944 25259 10994 1 14 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.557 0.116 25259 10995 1 14 . 1 1 139 139 ASN CA C 139 51.782 51.782 54.114 -2.332 25259 10996 1 14 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.451 -2.634 25259 10997 1 14 . 1 1 139 139 ASN H H 139 8.485 8.485 8.411 0.074 25259 10998 1 14 . 1 1 140 140 ILE N N 140 120.880 120.880 121.009 -0.129 25259 10999 1 14 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.056 -0.026 25259 11000 1 14 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.454 -1.888 25259 11001 1 14 . 1 1 140 140 ILE CB C 140 35.774 35.774 37.981 -2.207 25259 11002 1 14 . 1 1 140 140 ILE H H 140 7.549 7.549 7.336 0.213 25259 11003 1 14 . 1 1 141 141 GLY N N 141 110.676 110.676 115.417 -4.741 25259 11004 1 14 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.722 -0.058 25259 11005 1 14 . 1 1 141 141 GLY H H 141 7.663 7.663 8.576 -0.913 25259 11006 1 14 . 1 1 142 142 LEU N N 142 123.857 123.857 123.598 0.259 25259 11007 1 14 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.832 -0.139 25259 11008 1 14 . 1 1 142 142 LEU CA C 142 55.193 55.193 58.113 -2.920 25259 11009 1 14 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.367 -0.758 25259 11010 1 14 . 1 1 142 142 LEU H H 142 8.496 8.496 7.810 0.686 25259 11011 1 14 . 1 1 143 143 GLU N N 143 118.407 118.407 118.129 0.278 25259 11012 1 14 . 1 1 143 143 GLU HA H 143 3.786 3.786 4.022 -0.236 25259 11013 1 14 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.039 -1.817 25259 11014 1 14 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.126 -2.613 25259 11015 1 14 . 1 1 143 143 GLU H H 143 8.672 8.672 8.506 0.166 25259 11016 1 14 . 1 1 144 144 ASN N N 144 118.477 118.477 116.704 1.773 25259 11017 1 14 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.440 0.002 25259 11018 1 14 . 1 1 144 144 ASN CA C 144 52.712 52.712 55.313 -2.601 25259 11019 1 14 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.387 -2.432 25259 11020 1 14 . 1 1 144 144 ASN H H 144 7.656 7.656 8.265 -0.609 25259 11021 1 14 . 1 1 145 145 LEU N N 145 125.354 125.354 119.770 5.584 25259 11022 1 14 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.952 -0.155 25259 11023 1 14 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.127 -0.804 25259 11024 1 14 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.496 -2.923 25259 11025 1 14 . 1 1 145 145 LEU H H 145 7.758 7.758 7.910 -0.152 25259 11026 1 14 . 1 1 146 146 LEU N N 146 116.372 116.372 118.282 -1.910 25259 11027 1 14 . 1 1 146 146 LEU HA H 146 3.876 3.876 4.091 -0.215 25259 11028 1 14 . 1 1 146 146 LEU CA C 146 53.243 53.243 54.778 -1.535 25259 11029 1 14 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.125 -1.228 25259 11030 1 14 . 1 1 146 146 LEU H H 146 7.242 7.242 7.725 -0.483 25259 11031 1 14 . 1 1 147 147 LYS N N 147 120.054 120.054 121.490 -1.436 25259 11032 1 14 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.396 -0.084 25259 11033 1 14 . 1 1 147 147 LYS CA C 147 54.623 54.623 56.201 -1.578 25259 11034 1 14 . 1 1 147 147 LYS CB C 147 30.260 30.260 33.938 -3.678 25259 11035 1 14 . 1 1 147 147 LYS H H 147 7.185 7.185 8.634 -1.449 25259 11036 1 14 . 1 1 148 148 ASN N N 148 119.498 119.498 119.465 0.033 25259 11037 1 14 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.929 0.033 25259 11038 1 14 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.812 -2.038 25259 11039 1 14 . 1 1 148 148 ASN CB C 148 39.486 39.486 39.817 -0.331 25259 11040 1 14 . 1 1 148 148 ASN H H 148 7.698 7.698 7.804 -0.106 25259 11041 1 14 . 1 1 149 149 GLU N N 149 122.834 122.834 117.602 5.232 25259 11042 1 14 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.761 -0.160 25259 11043 1 14 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.133 -1.913 25259 11044 1 14 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.697 -2.887 25259 11045 1 14 . 1 1 149 149 GLU H H 149 8.767 8.767 8.593 0.174 25259 11046 1 14 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.876 0.732 25259 11047 1 14 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.462 -1.220 25259 11048 1 14 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.338 -3.243 25259 11049 1 14 . 1 1 151 151 SER N N 151 112.839 112.839 110.785 2.054 25259 11050 1 14 . 1 1 151 151 SER HA H 151 3.835 3.835 4.518 -0.683 25259 11051 1 14 . 1 1 151 151 SER CA C 151 59.270 59.270 57.000 2.270 25259 11052 1 14 . 1 1 151 151 SER CB C 151 59.451 59.451 62.507 -3.056 25259 11053 1 14 . 1 1 151 151 SER H H 151 8.519 8.519 7.752 0.767 25259 11054 1 14 . 1 1 152 152 LYS N N 152 126.710 126.710 124.068 2.642 25259 11055 1 14 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.033 0.215 25259 11056 1 14 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.552 -3.787 25259 11057 1 14 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.429 -2.172 25259 11058 1 14 . 1 1 152 152 LYS H H 152 7.006 7.006 7.424 -0.418 25259 11059 1 14 . 1 1 153 153 TYR N N 153 123.239 123.239 117.039 6.200 25259 11060 1 14 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.424 -0.166 25259 11061 1 14 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.585 0.724 25259 11062 1 14 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.400 -1.066 25259 11063 1 14 . 1 1 153 153 TYR H H 153 8.058 8.058 8.160 -0.102 25259 11064 1 14 . 1 1 154 154 ILE N N 154 120.253 120.253 121.027 -0.774 25259 11065 1 14 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.115 0.258 25259 11066 1 14 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.154 -2.040 25259 11067 1 14 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.069 -1.121 25259 11068 1 14 . 1 1 154 154 ILE H H 154 8.193 8.193 7.807 0.386 25259 11069 1 14 . 1 1 155 155 SER N N 155 117.178 117.178 114.660 2.518 25259 11070 1 14 . 1 1 155 155 SER HA H 155 4.091 4.091 4.095 -0.004 25259 11071 1 14 . 1 1 155 155 SER CA C 155 59.961 59.961 61.484 -1.523 25259 11072 1 14 . 1 1 155 155 SER CB C 155 60.148 60.148 62.873 -2.725 25259 11073 1 14 . 1 1 155 155 SER H H 155 8.020 8.020 7.899 0.121 25259 11074 1 14 . 1 1 156 156 ASP N N 156 125.479 125.479 122.042 3.437 25259 11075 1 14 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.387 0.040 25259 11076 1 14 . 1 1 156 156 ASP CA C 156 54.760 54.760 57.376 -2.616 25259 11077 1 14 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.029 -3.155 25259 11078 1 14 . 1 1 156 156 ASP H H 156 8.638 8.638 7.534 1.104 25259 11079 1 14 . 1 1 157 157 ARG N N 157 121.542 121.542 120.069 1.473 25259 11080 1 14 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.175 -0.064 25259 11081 1 14 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.565 -2.636 25259 11082 1 14 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.634 -1.817 25259 11083 1 14 . 1 1 157 157 ARG H H 157 7.888 7.888 8.283 -0.395 25259 11084 1 14 . 1 1 158 158 LEU N N 158 124.257 124.257 117.467 6.790 25259 11085 1 14 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.350 -0.079 25259 11086 1 14 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.553 -2.340 25259 11087 1 14 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.136 -2.191 25259 11088 1 14 . 1 1 158 158 LEU H H 158 8.442 8.442 7.840 0.602 25259 11089 1 14 . 1 1 159 159 ALA N N 159 124.146 124.146 119.629 4.517 25259 11090 1 14 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.197 0.135 25259 11091 1 14 . 1 1 159 159 ALA CA C 159 51.432 51.432 53.329 -1.897 25259 11092 1 14 . 1 1 159 159 ALA CB C 159 15.907 15.907 19.191 -3.284 25259 11093 1 14 . 1 1 159 159 ALA H H 159 8.086 8.086 7.416 0.670 25259 11094 1 14 . 1 1 160 160 ASN N N 160 118.093 118.093 115.774 2.319 25259 11095 1 14 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.536 0.456 25259 11096 1 14 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.991 -3.414 25259 11097 1 14 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.495 -0.762 25259 11098 1 14 . 1 1 160 160 ASN H H 160 7.445 7.445 8.083 -0.638 25259 11099 1 14 . 1 1 161 161 GLY N N 161 108.365 108.365 104.616 3.749 25259 11100 1 14 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.873 -1.227 25259 11101 1 14 . 1 1 161 161 GLY H H 161 7.743 7.743 7.511 0.232 25259 11102 1 14 . 1 1 162 162 ALA N N 162 123.928 123.928 123.739 0.189 25259 11103 1 14 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.889 -0.016 25259 11104 1 14 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.899 -2.373 25259 11105 1 14 . 1 1 162 162 ALA CB C 162 18.060 18.060 20.315 -2.255 25259 11106 1 14 . 1 1 162 162 ALA H H 162 8.035 8.035 7.942 0.093 25259 11107 1 14 . 1 1 163 163 THR N N 163 113.286 113.286 111.246 2.040 25259 11108 1 14 . 1 1 163 163 THR HA H 163 4.703 4.703 4.693 0.010 25259 11109 1 14 . 1 1 163 163 THR CA C 163 57.791 57.791 60.380 -2.589 25259 11110 1 14 . 1 1 163 163 THR CB C 163 68.974 68.974 71.332 -2.358 25259 11111 1 14 . 1 1 163 163 THR H H 163 8.451 8.451 8.717 -0.266 25259 11112 1 14 . 1 1 164 164 GLU N N 164 125.905 125.905 120.034 5.871 25259 11113 1 14 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.371 0.689 25259 11114 1 14 . 1 1 164 164 GLU CA C 164 53.585 53.585 56.537 -2.952 25259 11115 1 14 . 1 1 164 164 GLU CB C 164 29.211 29.211 30.885 -1.674 25259 11116 1 14 . 1 1 164 164 GLU H H 164 8.716 8.716 8.617 0.099 25259 11117 1 15 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.117 -0.442 25259 11118 1 15 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.670 -2.862 25259 11119 1 15 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.166 -3.096 25259 11120 1 15 . 1 1 3 3 ALA N N 3 126.741 126.741 123.173 3.568 25259 11121 1 15 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.650 -0.156 25259 11122 1 15 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.923 -1.721 25259 11123 1 15 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.837 -4.019 25259 11124 1 15 . 1 1 3 3 ALA H H 3 8.440 8.440 8.479 -0.039 25259 11125 1 15 . 1 1 4 4 THR N N 4 116.015 116.015 112.043 3.972 25259 11126 1 15 . 1 1 4 4 THR HA H 4 4.393 4.393 4.588 -0.195 25259 11127 1 15 . 1 1 4 4 THR CA C 4 59.148 59.148 61.227 -2.079 25259 11128 1 15 . 1 1 4 4 THR CB C 4 67.580 67.580 70.195 -2.615 25259 11129 1 15 . 1 1 4 4 THR H H 4 8.050 8.050 8.131 -0.081 25259 11130 1 15 . 1 1 5 5 LYS N N 5 126.350 126.350 120.791 5.559 25259 11131 1 15 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.526 -0.021 25259 11132 1 15 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.760 -1.843 25259 11133 1 15 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.266 -3.582 25259 11134 1 15 . 1 1 5 5 LYS H H 5 8.332 8.332 8.096 0.236 25259 11135 1 15 . 1 1 6 6 THR N N 6 118.124 118.124 113.480 4.644 25259 11136 1 15 . 1 1 6 6 THR HA H 6 4.440 4.440 4.463 -0.023 25259 11137 1 15 . 1 1 6 6 THR CA C 6 59.282 59.282 61.541 -2.259 25259 11138 1 15 . 1 1 6 6 THR CB C 6 67.685 67.685 69.562 -1.877 25259 11139 1 15 . 1 1 6 6 THR H H 6 8.283 8.283 8.144 0.139 25259 11140 1 15 . 1 1 7 7 GLU N N 7 125.934 125.934 123.245 2.689 25259 11141 1 15 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.549 -0.205 25259 11142 1 15 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.747 -1.566 25259 11143 1 15 . 1 1 7 7 GLU CB C 7 27.816 27.816 30.769 -2.953 25259 11144 1 15 . 1 1 7 7 GLU H H 7 8.487 8.487 8.381 0.106 25259 11145 1 15 . 1 1 8 8 LYS N N 8 123.945 123.945 121.727 2.218 25259 11146 1 15 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.744 -1.809 25259 11147 1 15 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.548 -2.983 25259 11148 1 15 . 1 1 8 8 LYS H H 8 8.278 8.278 8.311 -0.033 25259 11149 1 15 . 1 1 9 9 ASP N N 9 123.624 123.624 125.260 -1.636 25259 11150 1 15 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.534 -0.195 25259 11151 1 15 . 1 1 9 9 ASP CA C 9 52.123 52.123 54.492 -2.369 25259 11152 1 15 . 1 1 9 9 ASP CB C 9 38.933 38.933 41.627 -2.694 25259 11153 1 15 . 1 1 9 9 ASP H H 9 8.277 8.277 8.612 -0.335 25259 11154 1 15 . 1 1 10 10 THR N N 10 116.812 116.812 117.953 -1.141 25259 11155 1 15 . 1 1 10 10 THR HA H 10 4.349 4.349 4.454 -0.105 25259 11156 1 15 . 1 1 10 10 THR CA C 10 59.634 59.634 61.896 -2.262 25259 11157 1 15 . 1 1 10 10 THR CB C 10 67.254 67.254 69.177 -1.923 25259 11158 1 15 . 1 1 10 10 THR H H 10 8.049 8.049 8.155 -0.106 25259 11159 1 15 . 1 1 11 11 LEU N N 11 126.610 126.610 123.011 3.599 25259 11160 1 15 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.264 0.128 25259 11161 1 15 . 1 1 11 11 LEU CA C 11 53.078 53.078 55.961 -2.883 25259 11162 1 15 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.374 -2.741 25259 11163 1 15 . 1 1 11 11 LEU H H 11 8.191 8.191 7.938 0.253 25259 11164 1 15 . 1 1 12 12 GLN N N 12 123.274 123.274 119.837 3.437 25259 11165 1 15 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.599 -0.217 25259 11166 1 15 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.357 -0.783 25259 11167 1 15 . 1 1 12 12 GLN CB C 12 26.803 26.803 30.785 -3.982 25259 11168 1 15 . 1 1 12 12 GLN H H 12 8.280 8.280 8.326 -0.046 25259 11169 1 15 . 1 1 13 13 SER N N 13 119.027 119.027 117.148 1.879 25259 11170 1 15 . 1 1 13 13 SER HA H 13 4.471 4.471 4.647 -0.176 25259 11171 1 15 . 1 1 13 13 SER CA C 13 55.869 55.869 58.227 -2.358 25259 11172 1 15 . 1 1 13 13 SER CB C 13 61.424 61.424 63.284 -1.860 25259 11173 1 15 . 1 1 13 13 SER H H 13 8.178 8.178 8.502 -0.324 25259 11174 1 15 . 1 1 14 14 ALA N N 14 128.314 128.314 127.365 0.949 25259 11175 1 15 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.594 -0.160 25259 11176 1 15 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.674 -1.978 25259 11177 1 15 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.692 -2.611 25259 11178 1 15 . 1 1 14 14 ALA H H 14 8.195 8.195 8.314 -0.119 25259 11179 1 15 . 1 1 15 15 LEU N N 15 125.175 125.175 121.517 3.658 25259 11180 1 15 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.760 -0.120 25259 11181 1 15 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.170 -2.566 25259 11182 1 15 . 1 1 15 15 LEU CB C 15 39.467 39.467 42.395 -2.928 25259 11183 1 15 . 1 1 15 15 LEU H H 15 8.050 8.050 8.351 -0.301 25259 11184 1 15 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.506 -0.002 25259 11185 1 15 . 1 1 16 16 PRO CA C 16 60.631 60.631 63.151 -2.519 25259 11186 1 15 . 1 1 16 16 PRO CB C 16 29.658 29.658 30.699 -1.041 25259 11187 1 15 . 1 1 17 17 VAL N N 17 123.223 123.223 125.248 -2.025 25259 11188 1 15 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.197 -0.063 25259 11189 1 15 . 1 1 17 17 VAL CA C 17 59.827 59.827 62.302 -2.475 25259 11190 1 15 . 1 1 17 17 VAL CB C 17 30.377 30.377 32.693 -2.316 25259 11191 1 15 . 1 1 17 17 VAL H H 17 8.134 8.134 7.969 0.165 25259 11192 1 15 . 1 1 18 18 ILE N N 18 127.777 127.777 121.258 6.519 25259 11193 1 15 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.773 -0.530 25259 11194 1 15 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.230 -1.908 25259 11195 1 15 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.640 -4.386 25259 11196 1 15 . 1 1 18 18 ILE H H 18 8.187 8.187 8.668 -0.481 25259 11197 1 15 . 1 1 19 19 GLU N N 19 128.148 128.148 121.426 6.722 25259 11198 1 15 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.674 -0.337 25259 11199 1 15 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.724 -1.633 25259 11200 1 15 . 1 1 19 19 GLU CB C 19 28.176 28.176 31.152 -2.976 25259 11201 1 15 . 1 1 19 19 GLU H H 19 8.475 8.475 8.649 -0.174 25259 11202 1 15 . 1 1 20 20 ASN N N 20 122.788 122.788 118.176 4.612 25259 11203 1 15 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.065 -0.370 25259 11204 1 15 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.842 -2.020 25259 11205 1 15 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.482 -4.116 25259 11206 1 15 . 1 1 20 20 ASN H H 20 8.477 8.477 8.440 0.037 25259 11207 1 15 . 1 1 21 21 ALA N N 21 127.253 127.253 122.852 4.401 25259 11208 1 15 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.655 -0.334 25259 11209 1 15 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.823 -1.135 25259 11210 1 15 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.634 -3.721 25259 11211 1 15 . 1 1 21 21 ALA H H 21 8.325 8.325 8.316 0.009 25259 11212 1 15 . 1 1 22 22 GLU N N 22 122.044 122.044 120.612 1.432 25259 11213 1 15 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.422 -0.129 25259 11214 1 15 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.456 -1.873 25259 11215 1 15 . 1 1 22 22 GLU CB C 22 27.285 27.285 30.279 -2.994 25259 11216 1 15 . 1 1 22 22 GLU H H 22 8.415 8.415 8.671 -0.256 25259 11217 1 15 . 1 1 23 23 LYS N N 23 123.622 123.622 127.613 -3.991 25259 11218 1 15 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.296 0.029 25259 11219 1 15 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.116 -1.620 25259 11220 1 15 . 1 1 23 23 LYS CB C 23 30.653 30.653 31.805 -1.152 25259 11221 1 15 . 1 1 23 23 LYS H H 23 8.127 8.127 8.604 -0.477 25259 11222 1 15 . 1 1 24 24 ASN N N 24 120.652 120.652 121.013 -0.361 25259 11223 1 15 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.893 -0.052 25259 11224 1 15 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.622 -1.959 25259 11225 1 15 . 1 1 24 24 ASN CB C 24 36.775 36.775 40.521 -3.746 25259 11226 1 15 . 1 1 24 24 ASN H H 24 8.424 8.424 7.975 0.449 25259 11227 1 15 . 1 1 25 25 THR N N 25 117.102 117.102 115.368 1.734 25259 11228 1 15 . 1 1 25 25 THR HA H 25 4.367 4.367 4.080 0.287 25259 11229 1 15 . 1 1 25 25 THR CA C 25 59.500 59.500 62.324 -2.824 25259 11230 1 15 . 1 1 25 25 THR CB C 25 67.610 67.610 68.826 -1.216 25259 11231 1 15 . 1 1 25 25 THR H H 25 7.852 7.852 8.483 -0.631 25259 11232 1 15 . 1 1 26 26 VAL N N 26 126.491 126.491 125.989 0.502 25259 11233 1 15 . 1 1 26 26 VAL HA H 26 4.167 4.167 3.958 0.209 25259 11234 1 15 . 1 1 26 26 VAL CA C 26 60.193 60.193 62.613 -2.420 25259 11235 1 15 . 1 1 26 26 VAL CB C 26 29.605 29.605 32.434 -2.829 25259 11236 1 15 . 1 1 26 26 VAL H H 26 8.080 8.080 8.149 -0.069 25259 11237 1 15 . 1 1 27 27 VAL N N 27 132.992 132.992 127.407 5.585 25259 11238 1 15 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.196 -0.115 25259 11239 1 15 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.863 -1.879 25259 11240 1 15 . 1 1 27 27 VAL CB C 27 31.540 31.540 34.179 -2.639 25259 11241 1 15 . 1 1 27 27 VAL H H 27 8.830 8.830 8.945 -0.115 25259 11242 1 15 . 1 1 28 28 THR N N 28 123.576 123.576 122.915 0.661 25259 11243 1 15 . 1 1 28 28 THR HA H 28 5.553 5.553 4.532 1.021 25259 11244 1 15 . 1 1 28 28 THR CA C 28 58.738 58.738 61.738 -3.000 25259 11245 1 15 . 1 1 28 28 THR CB C 28 68.443 68.443 69.172 -0.729 25259 11246 1 15 . 1 1 28 28 THR H H 28 8.165 8.165 8.437 -0.272 25259 11247 1 15 . 1 1 29 29 LYS N N 29 129.099 129.099 127.894 1.205 25259 11248 1 15 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.801 0.141 25259 11249 1 15 . 1 1 29 29 LYS CA C 29 51.779 51.779 54.762 -2.983 25259 11250 1 15 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.676 0.420 25259 11251 1 15 . 1 1 29 29 LYS H H 29 9.273 9.273 9.000 0.273 25259 11252 1 15 . 1 1 30 30 THR N N 30 123.510 123.510 114.861 8.649 25259 11253 1 15 . 1 1 30 30 THR HA H 30 5.428 5.428 5.306 0.122 25259 11254 1 15 . 1 1 30 30 THR CA C 30 59.784 59.784 61.031 -1.247 25259 11255 1 15 . 1 1 30 30 THR CB C 30 67.818 67.818 70.484 -2.667 25259 11256 1 15 . 1 1 30 30 THR H H 30 8.993 8.993 8.046 0.947 25259 11257 1 15 . 1 1 31 31 LEU N N 31 128.293 128.293 122.584 5.709 25259 11258 1 15 . 1 1 31 31 LEU HA H 31 5.220 5.220 5.165 0.055 25259 11259 1 15 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.139 -3.084 25259 11260 1 15 . 1 1 31 31 LEU CB C 31 43.399 43.399 46.279 -2.880 25259 11261 1 15 . 1 1 31 31 LEU H H 31 9.557 9.557 8.107 1.450 25259 11262 1 15 . 1 1 32 32 VAL N N 32 126.919 126.919 119.756 7.163 25259 11263 1 15 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.358 0.093 25259 11264 1 15 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.376 -1.712 25259 11265 1 15 . 1 1 32 32 VAL CB C 32 29.449 29.449 31.754 -2.305 25259 11266 1 15 . 1 1 32 32 VAL H H 32 9.364 9.364 8.761 0.603 25259 11267 1 15 . 1 1 33 33 LEU N N 33 133.503 133.503 127.596 5.907 25259 11268 1 15 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.341 0.215 25259 11269 1 15 . 1 1 33 33 LEU CA C 33 52.004 52.004 54.586 -2.582 25259 11270 1 15 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.253 -4.406 25259 11271 1 15 . 1 1 33 33 LEU H H 33 8.587 8.587 8.232 0.355 25259 11272 1 15 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.471 0.010 25259 11273 1 15 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.337 -1.892 25259 11274 1 15 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.103 -2.538 25259 11275 1 15 . 1 1 35 35 LYS N N 35 127.420 127.420 116.927 10.493 25259 11276 1 15 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.197 0.169 25259 11277 1 15 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.366 -2.247 25259 11278 1 15 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.831 -2.237 25259 11279 1 15 . 1 1 35 35 LYS H H 35 8.666 8.666 8.146 0.520 25259 11280 1 15 . 1 1 36 36 SER N N 36 122.222 122.222 116.566 5.656 25259 11281 1 15 . 1 1 36 36 SER HA H 36 4.753 4.753 4.778 -0.025 25259 11282 1 15 . 1 1 36 36 SER CA C 36 55.328 55.328 57.761 -2.433 25259 11283 1 15 . 1 1 36 36 SER CB C 36 61.728 61.728 62.943 -1.215 25259 11284 1 15 . 1 1 36 36 SER H H 36 8.771 8.771 8.576 0.195 25259 11285 1 15 . 1 1 37 37 ASP N N 37 126.346 126.346 122.733 3.613 25259 11286 1 15 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.297 0.157 25259 11287 1 15 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.331 -2.715 25259 11288 1 15 . 1 1 37 37 ASP CB C 37 37.985 37.985 39.885 -1.900 25259 11289 1 15 . 1 1 37 37 ASP H H 37 8.859 8.859 8.719 0.140 25259 11290 1 15 . 1 1 38 38 ASP N N 38 119.171 119.171 120.274 -1.103 25259 11291 1 15 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.644 -0.029 25259 11292 1 15 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.555 -3.767 25259 11293 1 15 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.490 -3.855 25259 11294 1 15 . 1 1 38 38 ASP H H 38 7.944 7.944 8.230 -0.286 25259 11295 1 15 . 1 1 39 39 GLY N N 39 110.352 110.352 108.084 2.268 25259 11296 1 15 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.241 -2.480 25259 11297 1 15 . 1 1 39 39 GLY H H 39 8.145 8.145 8.269 -0.124 25259 11298 1 15 . 1 1 40 40 SER N N 40 120.090 120.090 114.908 5.182 25259 11299 1 15 . 1 1 40 40 SER HA H 40 4.877 4.877 4.837 0.040 25259 11300 1 15 . 1 1 40 40 SER CA C 40 56.525 56.525 58.935 -2.410 25259 11301 1 15 . 1 1 40 40 SER CB C 40 62.245 62.245 65.061 -2.816 25259 11302 1 15 . 1 1 40 40 SER H H 40 8.344 8.344 7.785 0.559 25259 11303 1 15 . 1 1 41 41 GLN N N 41 122.551 122.551 121.649 0.902 25259 11304 1 15 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.671 0.256 25259 11305 1 15 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.814 -1.400 25259 11306 1 15 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.299 -2.985 25259 11307 1 15 . 1 1 41 41 GLN H H 41 8.627 8.627 8.940 -0.313 25259 11308 1 15 . 1 1 42 42 GLN N N 42 131.724 131.724 118.624 13.100 25259 11309 1 15 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.657 0.954 25259 11310 1 15 . 1 1 42 42 GLN CA C 42 52.072 52.072 55.250 -3.178 25259 11311 1 15 . 1 1 42 42 GLN CB C 42 30.319 30.319 31.723 -1.404 25259 11312 1 15 . 1 1 42 42 GLN H H 42 9.189 9.189 8.736 0.453 25259 11313 1 15 . 1 1 43 43 THR N N 43 122.202 122.202 115.243 6.959 25259 11314 1 15 . 1 1 43 43 THR HA H 43 5.380 5.380 4.885 0.495 25259 11315 1 15 . 1 1 43 43 THR CA C 43 58.863 58.863 60.603 -1.740 25259 11316 1 15 . 1 1 43 43 THR CB C 43 68.893 68.893 71.787 -2.894 25259 11317 1 15 . 1 1 43 43 THR H H 43 9.139 9.139 8.374 0.765 25259 11318 1 15 . 1 1 44 44 GLN N N 44 127.190 127.190 120.614 6.576 25259 11319 1 15 . 1 1 44 44 GLN HA H 44 5.634 5.634 4.960 0.674 25259 11320 1 15 . 1 1 44 44 GLN CA C 44 51.668 51.668 55.021 -3.353 25259 11321 1 15 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.137 -3.227 25259 11322 1 15 . 1 1 44 44 GLN H H 44 9.760 9.760 8.380 1.379 25259 11323 1 15 . 1 1 45 45 THR N N 45 123.479 123.479 121.153 2.326 25259 11324 1 15 . 1 1 45 45 THR HA H 45 5.421 5.421 4.743 0.678 25259 11325 1 15 . 1 1 45 45 THR CA C 45 60.071 60.071 63.051 -2.980 25259 11326 1 15 . 1 1 45 45 THR CB C 45 67.541 67.541 69.323 -1.782 25259 11327 1 15 . 1 1 45 45 THR H H 45 9.518 9.518 9.037 0.481 25259 11328 1 15 . 1 1 46 46 ILE N N 46 133.908 133.908 129.783 4.125 25259 11329 1 15 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.731 0.272 25259 11330 1 15 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.760 -2.289 25259 11331 1 15 . 1 1 46 46 ILE CB C 46 39.945 39.945 40.586 -0.641 25259 11332 1 15 . 1 1 46 46 ILE H H 46 9.830 9.830 9.247 0.583 25259 11333 1 15 . 1 1 47 47 THR N N 47 124.701 124.701 124.766 -0.065 25259 11334 1 15 . 1 1 47 47 THR HA H 47 6.048 6.048 5.511 0.537 25259 11335 1 15 . 1 1 47 47 THR CA C 47 58.551 58.551 61.141 -2.590 25259 11336 1 15 . 1 1 47 47 THR CB C 47 67.819 67.819 69.981 -2.162 25259 11337 1 15 . 1 1 47 47 THR H H 47 8.843 8.843 8.416 0.427 25259 11338 1 15 . 1 1 48 48 TYR N N 48 127.369 127.369 121.948 5.421 25259 11339 1 15 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.193 0.085 25259 11340 1 15 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.036 -2.307 25259 11341 1 15 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.442 -2.010 25259 11342 1 15 . 1 1 48 48 TYR H H 48 9.638 9.638 8.746 0.892 25259 11343 1 15 . 1 1 49 49 LYS N N 49 122.138 122.138 117.177 4.961 25259 11344 1 15 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.674 -0.018 25259 11345 1 15 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.879 -2.907 25259 11346 1 15 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.722 -1.119 25259 11347 1 15 . 1 1 49 49 LYS H H 49 8.560 8.560 8.820 -0.260 25259 11348 1 15 . 1 1 50 50 ASP N N 50 130.208 130.208 119.714 10.494 25259 11349 1 15 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.799 -0.495 25259 11350 1 15 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.962 -0.202 25259 11351 1 15 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.732 -5.393 25259 11352 1 15 . 1 1 50 50 ASP H H 50 9.597 9.597 8.320 1.277 25259 11353 1 15 . 1 1 51 51 LYS N N 51 124.586 124.586 119.060 5.526 25259 11354 1 15 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.378 0.153 25259 11355 1 15 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.437 -2.703 25259 11356 1 15 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.118 -3.723 25259 11357 1 15 . 1 1 51 51 LYS H H 51 8.450 8.450 8.145 0.305 25259 11358 1 15 . 1 1 52 52 THR N N 52 120.044 120.044 114.025 6.019 25259 11359 1 15 . 1 1 52 52 THR HA H 52 4.717 4.717 4.499 0.218 25259 11360 1 15 . 1 1 52 52 THR CA C 52 59.313 59.313 60.963 -1.650 25259 11361 1 15 . 1 1 52 52 THR CB C 52 68.815 68.815 71.255 -2.440 25259 11362 1 15 . 1 1 52 52 THR H H 52 8.658 8.658 7.664 0.994 25259 11363 1 15 . 1 1 53 53 PHE N N 53 128.987 128.987 123.726 5.261 25259 11364 1 15 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.348 -0.065 25259 11365 1 15 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.356 -1.367 25259 11366 1 15 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.565 0.746 25259 11367 1 15 . 1 1 53 53 PHE H H 53 9.218 9.218 8.698 0.520 25259 11368 1 15 . 1 1 54 54 LEU N N 54 124.874 124.874 125.886 -1.012 25259 11369 1 15 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.247 0.682 25259 11370 1 15 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.797 -2.556 25259 11371 1 15 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.490 -1.973 25259 11372 1 15 . 1 1 54 54 LEU H H 54 9.391 9.391 8.590 0.801 25259 11373 1 15 . 1 1 55 55 SER N N 55 115.516 115.516 107.895 7.621 25259 11374 1 15 . 1 1 55 55 SER HA H 55 5.194 5.194 5.150 0.044 25259 11375 1 15 . 1 1 55 55 SER CA C 55 55.818 55.818 57.412 -1.594 25259 11376 1 15 . 1 1 55 55 SER CB C 55 63.474 63.474 66.760 -3.285 25259 11377 1 15 . 1 1 55 55 SER H H 55 8.736 8.736 7.577 1.159 25259 11378 1 15 . 1 1 56 56 LEU N N 56 124.352 124.352 122.341 2.011 25259 11379 1 15 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.327 0.216 25259 11380 1 15 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.255 -2.618 25259 11381 1 15 . 1 1 56 56 LEU CB C 56 45.513 45.513 45.927 -0.414 25259 11382 1 15 . 1 1 56 56 LEU H H 56 8.328 8.328 9.178 -0.850 25259 11383 1 15 . 1 1 57 57 ALA N N 57 131.450 131.450 131.042 0.408 25259 11384 1 15 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.172 0.333 25259 11385 1 15 . 1 1 57 57 ALA CA C 57 48.202 48.202 49.866 -1.664 25259 11386 1 15 . 1 1 57 57 ALA CB C 57 18.964 18.964 20.418 -1.454 25259 11387 1 15 . 1 1 57 57 ALA H H 57 9.208 9.208 9.085 0.123 25259 11388 1 15 . 1 1 58 58 ILE N N 58 126.248 126.248 126.625 -0.377 25259 11389 1 15 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.283 0.501 25259 11390 1 15 . 1 1 58 58 ILE CA C 58 58.247 58.247 62.368 -4.121 25259 11391 1 15 . 1 1 58 58 ILE CB C 58 38.045 38.045 38.278 -0.233 25259 11392 1 15 . 1 1 58 58 ILE H H 58 9.597 9.597 8.197 1.400 25259 11393 1 15 . 1 1 59 59 GLN N N 59 132.065 132.065 127.844 4.221 25259 11394 1 15 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.675 0.572 25259 11395 1 15 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.838 -3.674 25259 11396 1 15 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.913 -1.252 25259 11397 1 15 . 1 1 59 59 GLN H H 59 9.389 9.389 8.492 0.897 25259 11398 1 15 . 1 1 60 60 GLN N N 60 130.314 130.314 117.590 12.724 25259 11399 1 15 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.904 0.305 25259 11400 1 15 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.701 -2.680 25259 11401 1 15 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.720 -4.244 25259 11402 1 15 . 1 1 60 60 GLN H H 60 9.471 9.471 8.752 0.719 25259 11403 1 15 . 1 1 61 61 LYS N N 61 131.044 131.044 122.017 9.027 25259 11404 1 15 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.174 0.241 25259 11405 1 15 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.118 -2.998 25259 11406 1 15 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.843 -4.426 25259 11407 1 15 . 1 1 61 61 LYS H H 61 8.893 8.893 8.926 -0.033 25259 11408 1 15 . 1 1 62 62 ARG N N 62 125.397 125.397 118.885 6.512 25259 11409 1 15 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.215 -0.212 25259 11410 1 15 . 1 1 62 62 ARG CA C 62 51.091 51.091 54.207 -3.116 25259 11411 1 15 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.108 -1.230 25259 11412 1 15 . 1 1 62 62 ARG H H 62 9.120 9.120 8.362 0.758 25259 11413 1 15 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.813 0.162 25259 11414 1 15 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.577 -3.080 25259 11415 1 15 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.255 -2.372 25259 11416 1 15 . 1 1 64 64 VAL N N 64 121.305 121.305 117.372 3.933 25259 11417 1 15 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.186 -0.162 25259 11418 1 15 . 1 1 64 64 VAL CA C 64 59.677 59.677 61.731 -2.054 25259 11419 1 15 . 1 1 64 64 VAL CB C 64 30.365 30.365 31.783 -1.418 25259 11420 1 15 . 1 1 64 64 VAL H H 64 7.520 7.520 7.975 -0.455 25259 11421 1 15 . 1 1 65 65 SER N N 65 123.215 123.215 114.819 8.396 25259 11422 1 15 . 1 1 65 65 SER HA H 65 4.521 4.521 4.821 -0.300 25259 11423 1 15 . 1 1 65 65 SER CA C 65 54.897 54.897 57.607 -2.710 25259 11424 1 15 . 1 1 65 65 SER CB C 65 62.564 62.564 65.740 -3.176 25259 11425 1 15 . 1 1 65 65 SER H H 65 8.080 8.080 7.994 0.086 25259 11426 1 15 . 1 1 66 66 ASP N N 66 123.802 123.802 121.958 1.844 25259 11427 1 15 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.593 -0.164 25259 11428 1 15 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.542 -1.164 25259 11429 1 15 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.091 -3.053 25259 11430 1 15 . 1 1 66 66 ASP H H 66 8.900 8.900 8.647 0.253 25259 11431 1 15 . 1 1 67 67 GLU N N 67 121.943 121.943 120.688 1.255 25259 11432 1 15 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.030 0.159 25259 11433 1 15 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.559 -2.119 25259 11434 1 15 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.593 -2.808 25259 11435 1 15 . 1 1 67 67 GLU H H 67 8.717 8.717 8.478 0.239 25259 11436 1 15 . 1 1 68 68 LEU N N 68 125.458 125.458 120.134 5.324 25259 11437 1 15 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.191 0.152 25259 11438 1 15 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.088 -2.616 25259 11439 1 15 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.231 -1.827 25259 11440 1 15 . 1 1 68 68 LEU H H 68 7.820 7.820 7.838 -0.018 25259 11441 1 15 . 1 1 69 69 LYS N N 69 123.868 123.868 119.014 4.854 25259 11442 1 15 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.048 -0.042 25259 11443 1 15 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.513 -1.895 25259 11444 1 15 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.796 -1.759 25259 11445 1 15 . 1 1 69 69 LYS H H 69 8.690 8.690 7.752 0.938 25259 11446 1 15 . 1 1 70 70 THR N N 70 117.109 117.109 116.378 0.731 25259 11447 1 15 . 1 1 70 70 THR HA H 70 4.088 4.088 4.040 0.048 25259 11448 1 15 . 1 1 70 70 THR CA C 70 63.879 63.879 66.351 -2.472 25259 11449 1 15 . 1 1 70 70 THR CB C 70 66.383 66.383 68.663 -2.280 25259 11450 1 15 . 1 1 70 70 THR H H 70 7.935 7.935 7.679 0.256 25259 11451 1 15 . 1 1 71 71 TYR N N 71 127.006 127.006 123.231 3.775 25259 11452 1 15 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.249 -0.044 25259 11453 1 15 . 1 1 71 71 TYR CA C 71 60.225 60.225 62.083 -1.858 25259 11454 1 15 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.362 -1.817 25259 11455 1 15 . 1 1 71 71 TYR H H 71 7.683 7.683 7.633 0.050 25259 11456 1 15 . 1 1 72 72 ILE N N 72 125.064 125.064 120.823 4.241 25259 11457 1 15 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.648 0.031 25259 11458 1 15 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.404 -2.509 25259 11459 1 15 . 1 1 72 72 ILE CB C 72 36.276 36.276 38.037 -1.761 25259 11460 1 15 . 1 1 72 72 ILE H H 72 9.083 9.083 7.889 1.194 25259 11461 1 15 . 1 1 73 73 ASP N N 73 124.900 124.900 118.720 6.180 25259 11462 1 15 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.407 -0.018 25259 11463 1 15 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.736 -1.698 25259 11464 1 15 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.821 -2.713 25259 11465 1 15 . 1 1 73 73 ASP H H 73 8.751 8.751 8.193 0.558 25259 11466 1 15 . 1 1 74 74 GLN N N 74 117.025 117.025 116.690 0.335 25259 11467 1 15 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.078 0.060 25259 11468 1 15 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.041 -3.231 25259 11469 1 15 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.784 -2.220 25259 11470 1 15 . 1 1 74 74 GLN H H 74 7.447 7.447 7.629 -0.182 25259 11471 1 15 . 1 1 75 75 HIS N N 75 116.494 116.494 114.671 1.823 25259 11472 1 15 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.561 0.155 25259 11473 1 15 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.697 -2.631 25259 11474 1 15 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.565 -5.263 25259 11475 1 15 . 1 1 75 75 HIS H H 75 8.402 8.402 7.881 0.521 25259 11476 1 15 . 1 1 76 76 GLY N N 76 112.564 112.564 106.565 5.999 25259 11477 1 15 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.548 -2.652 25259 11478 1 15 . 1 1 76 76 GLY H H 76 9.091 9.091 7.532 1.559 25259 11479 1 15 . 1 1 77 77 VAL N N 77 124.763 124.763 121.158 3.605 25259 11480 1 15 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.787 -0.222 25259 11481 1 15 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.393 -0.442 25259 11482 1 15 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.083 -2.245 25259 11483 1 15 . 1 1 77 77 VAL H H 77 8.927 8.927 8.665 0.262 25259 11484 1 15 . 1 1 78 78 GLU N N 78 124.388 124.388 118.342 6.046 25259 11485 1 15 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.094 0.054 25259 11486 1 15 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.354 -1.038 25259 11487 1 15 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.882 -2.423 25259 11488 1 15 . 1 1 78 78 GLU H H 78 8.781 8.781 8.590 0.191 25259 11489 1 15 . 1 1 79 79 GLU N N 79 121.887 121.887 116.611 5.276 25259 11490 1 15 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.309 -0.121 25259 11491 1 15 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.275 -1.730 25259 11492 1 15 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.642 -2.609 25259 11493 1 15 . 1 1 79 79 GLU H H 79 9.231 9.231 7.875 1.356 25259 11494 1 15 . 1 1 80 80 THR N N 80 120.781 120.781 117.762 3.019 25259 11495 1 15 . 1 1 80 80 THR HA H 80 4.059 4.059 4.089 -0.030 25259 11496 1 15 . 1 1 80 80 THR CA C 80 65.487 65.487 66.614 -1.127 25259 11497 1 15 . 1 1 80 80 THR CB C 80 64.369 64.369 68.551 -4.182 25259 11498 1 15 . 1 1 80 80 THR H H 80 7.858 7.858 7.949 -0.091 25259 11499 1 15 . 1 1 81 81 GLN N N 81 125.303 125.303 121.001 4.302 25259 11500 1 15 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.847 0.197 25259 11501 1 15 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.398 -2.429 25259 11502 1 15 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.417 -2.340 25259 11503 1 15 . 1 1 81 81 GLN H H 81 8.765 8.765 7.995 0.770 25259 11504 1 15 . 1 1 82 82 LYS N N 82 120.458 120.458 118.644 1.814 25259 11505 1 15 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.910 0.179 25259 11506 1 15 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.883 -1.571 25259 11507 1 15 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.866 -1.712 25259 11508 1 15 . 1 1 82 82 LYS H H 82 7.521 7.521 7.962 -0.441 25259 11509 1 15 . 1 1 83 83 ALA N N 83 125.234 125.234 121.495 3.739 25259 11510 1 15 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.745 0.472 25259 11511 1 15 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.582 -2.140 25259 11512 1 15 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.111 -1.824 25259 11513 1 15 . 1 1 83 83 ALA H H 83 7.782 7.782 7.267 0.515 25259 11514 1 15 . 1 1 84 84 LEU N N 84 123.348 123.348 118.404 4.944 25259 11515 1 15 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.911 0.147 25259 11516 1 15 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.429 -1.930 25259 11517 1 15 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.405 -2.097 25259 11518 1 15 . 1 1 84 84 LEU H H 84 8.590 8.590 7.364 1.226 25259 11519 1 15 . 1 1 85 85 LEU N N 85 122.872 122.872 119.258 3.614 25259 11520 1 15 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.951 0.219 25259 11521 1 15 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.496 -2.100 25259 11522 1 15 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.418 -1.677 25259 11523 1 15 . 1 1 85 85 LEU H H 85 7.892 7.892 7.637 0.255 25259 11524 1 15 . 1 1 86 86 GLU N N 86 122.713 122.713 118.573 4.140 25259 11525 1 15 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.936 0.149 25259 11526 1 15 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.072 -2.327 25259 11527 1 15 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.249 -2.346 25259 11528 1 15 . 1 1 86 86 GLU H H 86 8.124 8.124 8.248 -0.124 25259 11529 1 15 . 1 1 87 87 ALA N N 87 123.163 123.163 120.516 2.647 25259 11530 1 15 . 1 1 87 87 ALA HA H 87 4.141 4.141 3.999 0.142 25259 11531 1 15 . 1 1 87 87 ALA CA C 87 52.268 52.268 55.079 -2.811 25259 11532 1 15 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.354 -2.722 25259 11533 1 15 . 1 1 87 87 ALA H H 87 7.765 7.765 7.648 0.117 25259 11534 1 15 . 1 1 88 88 GLU N N 88 121.945 121.945 116.969 4.976 25259 11535 1 15 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.162 -0.078 25259 11536 1 15 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.468 -1.533 25259 11537 1 15 . 1 1 88 88 GLU CB C 88 28.027 28.027 28.988 -0.961 25259 11538 1 15 . 1 1 88 88 GLU H H 88 7.846 7.846 7.940 -0.094 25259 11539 1 15 . 1 1 89 89 GLU N N 89 117.978 117.978 118.207 -0.229 25259 11540 1 15 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.106 -0.013 25259 11541 1 15 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.574 -3.360 25259 11542 1 15 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.132 -1.725 25259 11543 1 15 . 1 1 89 89 GLU H H 89 7.634 7.634 7.848 -0.214 25259 11544 1 15 . 1 1 90 90 LYS N N 90 117.519 117.519 116.146 1.373 25259 11545 1 15 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.472 -0.041 25259 11546 1 15 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.085 -2.067 25259 11547 1 15 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.596 -1.565 25259 11548 1 15 . 1 1 90 90 LYS H H 90 7.247 7.247 7.354 -0.107 25259 11549 1 15 . 1 1 91 91 ASP N N 91 124.888 124.888 122.120 2.768 25259 11550 1 15 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.642 0.041 25259 11551 1 15 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.142 -2.943 25259 11552 1 15 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.716 -3.135 25259 11553 1 15 . 1 1 91 91 ASP H H 91 7.370 7.370 7.470 -0.100 25259 11554 1 15 . 1 1 92 92 LYS N N 92 129.311 129.311 127.185 2.126 25259 11555 1 15 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.971 0.042 25259 11556 1 15 . 1 1 92 92 LYS CA C 92 57.216 57.216 58.877 -1.661 25259 11557 1 15 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.526 -2.511 25259 11558 1 15 . 1 1 92 92 LYS H H 92 8.795 8.795 8.826 -0.031 25259 11559 1 15 . 1 1 93 93 SER N N 93 118.112 118.112 115.501 2.611 25259 11560 1 15 . 1 1 93 93 SER HA H 93 4.439 4.439 4.251 0.188 25259 11561 1 15 . 1 1 93 93 SER CA C 93 58.945 58.945 60.892 -1.948 25259 11562 1 15 . 1 1 93 93 SER CB C 93 60.278 60.278 63.184 -2.906 25259 11563 1 15 . 1 1 93 93 SER H H 93 8.488 8.488 8.139 0.349 25259 11564 1 15 . 1 1 94 94 ILE N N 94 128.950 128.950 123.357 5.593 25259 11565 1 15 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.483 -0.001 25259 11566 1 15 . 1 1 94 94 ILE CA C 94 62.349 62.349 65.437 -3.088 25259 11567 1 15 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.825 -3.072 25259 11568 1 15 . 1 1 94 94 ILE H H 94 7.722 7.722 8.277 -0.555 25259 11569 1 15 . 1 1 95 95 ILE N N 95 123.598 123.598 120.053 3.545 25259 11570 1 15 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.424 0.171 25259 11571 1 15 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.731 -2.984 25259 11572 1 15 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.496 -1.524 25259 11573 1 15 . 1 1 95 95 ILE H H 95 8.378 8.378 8.189 0.189 25259 11574 1 15 . 1 1 96 96 GLU N N 96 118.317 118.317 118.797 -0.480 25259 11575 1 15 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.888 0.096 25259 11576 1 15 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.595 -3.100 25259 11577 1 15 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.517 -2.344 25259 11578 1 15 . 1 1 96 96 GLU H H 96 7.680 7.680 7.658 0.022 25259 11579 1 15 . 1 1 97 97 ALA N N 97 124.797 124.797 122.054 2.743 25259 11580 1 15 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.877 -0.052 25259 11581 1 15 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.732 -2.435 25259 11582 1 15 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.528 -2.539 25259 11583 1 15 . 1 1 97 97 ALA H H 97 7.383 7.383 7.723 -0.340 25259 11584 1 15 . 1 1 98 98 ARG N N 98 115.469 115.469 115.712 -0.243 25259 11585 1 15 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.205 0.101 25259 11586 1 15 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.906 -1.416 25259 11587 1 15 . 1 1 98 98 ARG CB C 98 28.238 28.238 30.005 -1.767 25259 11588 1 15 . 1 1 98 98 ARG H H 98 8.229 8.229 7.931 0.298 25259 11589 1 15 . 1 1 99 99 LYS N N 99 120.219 120.219 116.928 3.291 25259 11590 1 15 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.153 0.105 25259 11591 1 15 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.158 -1.917 25259 11592 1 15 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.501 -2.005 25259 11593 1 15 . 1 1 99 99 LYS H H 99 7.270 7.270 7.401 -0.131 25259 11594 1 15 . 1 1 100 100 LEU N N 100 123.800 123.800 121.545 2.255 25259 11595 1 15 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.328 0.013 25259 11596 1 15 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.673 -2.594 25259 11597 1 15 . 1 1 100 100 LEU CB C 100 39.131 39.131 41.579 -2.448 25259 11598 1 15 . 1 1 100 100 LEU H H 100 7.837 7.837 7.517 0.320 25259 11599 1 15 . 1 1 101 101 ALA N N 101 130.512 130.512 124.106 6.406 25259 11600 1 15 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.513 -0.137 25259 11601 1 15 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.688 -2.284 25259 11602 1 15 . 1 1 101 101 ALA CB C 101 15.796 15.796 19.037 -3.241 25259 11603 1 15 . 1 1 101 101 ALA H H 101 8.213 8.213 8.914 -0.701 25259 11604 1 15 . 1 1 102 102 GLY N N 102 110.659 110.659 105.810 4.849 25259 11605 1 15 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.891 -0.997 25259 11606 1 15 . 1 1 102 102 GLY H H 102 8.738 8.738 8.265 0.473 25259 11607 1 15 . 1 1 103 103 PHE N N 103 123.097 123.097 121.350 1.747 25259 11608 1 15 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.295 -0.075 25259 11609 1 15 . 1 1 103 103 PHE CA C 103 53.768 53.768 57.111 -3.343 25259 11610 1 15 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.526 -1.952 25259 11611 1 15 . 1 1 103 103 PHE H H 103 7.514 7.514 7.470 0.044 25259 11612 1 15 . 1 1 104 104 LYS N N 104 130.652 130.652 122.966 7.686 25259 11613 1 15 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.286 -0.166 25259 11614 1 15 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.888 -1.909 25259 11615 1 15 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.362 -2.125 25259 11616 1 15 . 1 1 104 104 LYS H H 104 7.473 7.473 7.105 0.368 25259 11617 1 15 . 1 1 105 105 LEU N N 105 127.372 127.372 122.701 4.671 25259 11618 1 15 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.972 0.024 25259 11619 1 15 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.427 -1.691 25259 11620 1 15 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.768 -1.804 25259 11621 1 15 . 1 1 105 105 LEU H H 105 8.393 8.393 8.210 0.183 25259 11622 1 15 . 1 1 106 106 GLU N N 106 129.358 129.358 125.236 4.122 25259 11623 1 15 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.674 0.170 25259 11624 1 15 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.481 -2.691 25259 11625 1 15 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.993 -2.365 25259 11626 1 15 . 1 1 106 106 GLU H H 106 8.849 8.849 8.843 0.006 25259 11627 1 15 . 1 1 107 107 THR N N 107 131.118 131.118 118.191 12.927 25259 11628 1 15 . 1 1 107 107 THR HA H 107 5.110 5.110 4.959 0.151 25259 11629 1 15 . 1 1 107 107 THR CA C 107 59.832 59.832 61.321 -1.489 25259 11630 1 15 . 1 1 107 107 THR CB C 107 66.671 66.671 70.641 -3.970 25259 11631 1 15 . 1 1 107 107 THR H H 107 9.433 9.433 8.261 1.172 25259 11632 1 15 . 1 1 108 108 LYS N N 108 129.114 129.114 127.171 1.943 25259 11633 1 15 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.569 0.255 25259 11634 1 15 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.491 -2.297 25259 11635 1 15 . 1 1 108 108 LYS CB C 108 34.388 34.388 34.894 -0.506 25259 11636 1 15 . 1 1 108 108 LYS H H 108 9.410 9.410 8.644 0.766 25259 11637 1 15 . 1 1 109 109 LEU N N 109 129.323 129.323 127.850 1.473 25259 11638 1 15 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.109 0.595 25259 11639 1 15 . 1 1 109 109 LEU CA C 109 52.108 52.108 56.522 -4.414 25259 11640 1 15 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.685 -3.030 25259 11641 1 15 . 1 1 109 109 LEU H H 109 8.862 8.862 8.863 -0.001 25259 11642 1 15 . 1 1 110 110 LEU N N 110 129.123 129.123 126.173 2.950 25259 11643 1 15 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.535 -0.312 25259 11644 1 15 . 1 1 110 110 LEU CA C 110 53.782 53.782 55.245 -1.463 25259 11645 1 15 . 1 1 110 110 LEU CB C 110 40.661 40.661 43.209 -2.548 25259 11646 1 15 . 1 1 110 110 LEU H H 110 8.373 8.373 8.796 -0.423 25259 11647 1 15 . 1 1 111 111 SER N N 111 114.587 114.587 113.134 1.453 25259 11648 1 15 . 1 1 111 111 SER HA H 111 4.557 4.557 4.642 -0.085 25259 11649 1 15 . 1 1 111 111 SER CA C 111 53.889 53.889 57.847 -3.958 25259 11650 1 15 . 1 1 111 111 SER CB C 111 61.830 61.830 64.681 -2.851 25259 11651 1 15 . 1 1 111 111 SER H H 111 8.400 8.400 7.863 0.537 25259 11652 1 15 . 1 1 112 112 ALA N N 112 118.269 118.269 122.588 -4.319 25259 11653 1 15 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.387 -0.078 25259 11654 1 15 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.408 -3.194 25259 11655 1 15 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.636 -2.048 25259 11656 1 15 . 1 1 112 112 ALA H H 112 8.556 8.556 8.604 -0.048 25259 11657 1 15 . 1 1 113 113 THR N N 113 102.878 102.878 103.013 -0.135 25259 11658 1 15 . 1 1 113 113 THR HA H 113 4.662 4.662 4.443 0.219 25259 11659 1 15 . 1 1 113 113 THR CA C 113 58.689 58.689 61.774 -3.085 25259 11660 1 15 . 1 1 113 113 THR CB C 113 67.905 67.905 69.910 -2.005 25259 11661 1 15 . 1 1 113 113 THR H H 113 8.065 8.065 7.869 0.196 25259 11662 1 15 . 1 1 114 114 GLU N N 114 126.514 126.514 120.969 5.545 25259 11663 1 15 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.091 -0.077 25259 11664 1 15 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.661 -1.654 25259 11665 1 15 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.399 -1.486 25259 11666 1 15 . 1 1 114 114 GLU H H 114 7.357 7.357 7.569 -0.212 25259 11667 1 15 . 1 1 115 115 LEU N N 115 128.058 128.058 117.511 10.547 25259 11668 1 15 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.021 -0.099 25259 11669 1 15 . 1 1 115 115 LEU CA C 115 51.324 51.324 53.135 -1.810 25259 11670 1 15 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.879 -1.740 25259 11671 1 15 . 1 1 115 115 LEU H H 115 8.930 8.930 8.762 0.168 25259 11672 1 15 . 1 1 116 116 GLN N N 116 126.540 126.540 116.094 10.446 25259 11673 1 15 . 1 1 116 116 GLN HA H 116 5.715 5.715 4.720 0.995 25259 11674 1 15 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.812 -3.112 25259 11675 1 15 . 1 1 116 116 GLN CB C 116 32.292 32.292 32.640 -0.348 25259 11676 1 15 . 1 1 116 116 GLN H H 116 9.221 9.221 8.579 0.642 25259 11677 1 15 . 1 1 117 117 THR N N 117 125.213 125.213 116.078 9.135 25259 11678 1 15 . 1 1 117 117 THR HA H 117 5.353 5.353 5.418 -0.065 25259 11679 1 15 . 1 1 117 117 THR CA C 117 58.926 58.926 61.060 -2.134 25259 11680 1 15 . 1 1 117 117 THR CB C 117 68.948 68.948 72.449 -3.501 25259 11681 1 15 . 1 1 117 117 THR H H 117 9.030 9.030 8.529 0.501 25259 11682 1 15 . 1 1 118 118 THR N N 118 127.799 127.799 117.526 10.273 25259 11683 1 15 . 1 1 118 118 THR HA H 118 5.527 5.527 4.987 0.540 25259 11684 1 15 . 1 1 118 118 THR CA C 118 59.201 59.201 61.986 -2.785 25259 11685 1 15 . 1 1 118 118 THR CB C 118 67.721 67.721 72.314 -4.593 25259 11686 1 15 . 1 1 118 118 THR H H 118 9.459 9.459 8.919 0.540 25259 11687 1 15 . 1 1 119 119 THR N N 119 129.258 129.258 121.519 7.739 25259 11688 1 15 . 1 1 119 119 THR HA H 119 4.885 4.885 4.548 0.337 25259 11689 1 15 . 1 1 119 119 THR CA C 119 58.463 58.463 61.035 -2.572 25259 11690 1 15 . 1 1 119 119 THR CB C 119 67.459 67.459 69.887 -2.428 25259 11691 1 15 . 1 1 119 119 THR H H 119 9.147 9.147 8.954 0.193 25259 11692 1 15 . 1 1 120 120 SER N N 120 123.389 123.389 121.343 2.046 25259 11693 1 15 . 1 1 120 120 SER HA H 120 5.328 5.328 4.532 0.796 25259 11694 1 15 . 1 1 120 120 SER CA C 120 54.386 54.386 57.626 -3.240 25259 11695 1 15 . 1 1 120 120 SER CB C 120 63.031 63.031 63.427 -0.396 25259 11696 1 15 . 1 1 120 120 SER H H 120 8.786 8.786 7.777 1.009 25259 11697 1 15 . 1 1 121 121 PHE N N 121 121.245 121.245 127.978 -6.733 25259 11698 1 15 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.864 0.248 25259 11699 1 15 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.563 -3.371 25259 11700 1 15 . 1 1 121 121 PHE CB C 121 40.265 40.265 39.585 0.680 25259 11701 1 15 . 1 1 121 121 PHE H H 121 8.831 8.831 9.170 -0.339 25259 11702 1 15 . 1 1 122 122 ASP N N 122 124.765 124.765 127.033 -2.268 25259 11703 1 15 . 1 1 122 122 ASP HA H 122 4.840 4.840 5.028 -0.188 25259 11704 1 15 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.228 -3.391 25259 11705 1 15 . 1 1 122 122 ASP CB C 122 38.485 38.485 39.668 -1.183 25259 11706 1 15 . 1 1 122 122 ASP H H 122 8.819 8.819 9.123 -0.304 25259 11707 1 15 . 1 1 123 123 PHE N N 123 124.303 124.303 122.515 1.788 25259 11708 1 15 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.330 0.344 25259 11709 1 15 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.187 -2.389 25259 11710 1 15 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.690 -3.150 25259 11711 1 15 . 1 1 123 123 PHE H H 123 8.262 8.262 8.348 -0.086 25259 11712 1 15 . 1 1 124 124 GLN N N 124 120.792 120.792 116.740 4.052 25259 11713 1 15 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.233 0.201 25259 11714 1 15 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.136 -2.053 25259 11715 1 15 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.256 -2.127 25259 11716 1 15 . 1 1 124 124 GLN H H 124 8.954 8.954 8.222 0.732 25259 11717 1 15 . 1 1 125 125 VAL N N 125 114.091 114.091 112.008 2.083 25259 11718 1 15 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.417 -0.008 25259 11719 1 15 . 1 1 125 125 VAL CA C 125 59.298 59.298 62.008 -2.709 25259 11720 1 15 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.593 -1.021 25259 11721 1 15 . 1 1 125 125 VAL H H 125 7.026 7.026 7.946 -0.920 25259 11722 1 15 . 1 1 126 126 LEU N N 126 125.158 125.158 123.795 1.363 25259 11723 1 15 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.350 0.125 25259 11724 1 15 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.792 -1.617 25259 11725 1 15 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.755 -0.702 25259 11726 1 15 . 1 1 126 126 LEU H H 126 8.106 8.106 7.875 0.231 25259 11727 1 15 . 1 1 127 127 ASP N N 127 130.026 130.026 128.026 2.000 25259 11728 1 15 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.554 0.287 25259 11729 1 15 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.000 -2.802 25259 11730 1 15 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.257 -2.568 25259 11731 1 15 . 1 1 127 127 ASP H H 127 9.129 9.129 8.868 0.261 25259 11732 1 15 . 1 1 128 128 VAL N N 128 128.833 128.833 125.388 3.445 25259 11733 1 15 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.400 0.124 25259 11734 1 15 . 1 1 128 128 VAL CA C 128 63.668 63.668 65.665 -1.997 25259 11735 1 15 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.267 -1.772 25259 11736 1 15 . 1 1 128 128 VAL H H 128 8.288 8.288 8.023 0.265 25259 11737 1 15 . 1 1 129 129 LYS N N 129 123.914 123.914 118.425 5.489 25259 11738 1 15 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.952 0.091 25259 11739 1 15 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.805 -2.016 25259 11740 1 15 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.753 -2.816 25259 11741 1 15 . 1 1 129 129 LYS H H 129 8.226 8.226 7.623 0.603 25259 11742 1 15 . 1 1 130 130 LYS N N 130 121.888 121.888 116.856 5.032 25259 11743 1 15 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.235 -0.150 25259 11744 1 15 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.259 -1.113 25259 11745 1 15 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.984 -2.644 25259 11746 1 15 . 1 1 130 130 LYS H H 130 7.590 7.590 7.620 -0.030 25259 11747 1 15 . 1 1 131 131 ALA N N 131 123.088 123.088 123.266 -0.178 25259 11748 1 15 . 1 1 131 131 ALA HA H 131 3.927 3.927 3.965 -0.038 25259 11749 1 15 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.079 -2.677 25259 11750 1 15 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.442 -1.995 25259 11751 1 15 . 1 1 131 131 ALA H H 131 8.506 8.506 8.100 0.406 25259 11752 1 15 . 1 1 132 132 SER N N 132 110.456 110.456 111.334 -0.878 25259 11753 1 15 . 1 1 132 132 SER HA H 132 4.117 4.117 4.102 0.015 25259 11754 1 15 . 1 1 132 132 SER CA C 132 58.289 58.289 59.996 -1.707 25259 11755 1 15 . 1 1 132 132 SER CB C 132 61.034 61.034 63.191 -2.157 25259 11756 1 15 . 1 1 132 132 SER H H 132 7.986 7.986 7.816 0.170 25259 11757 1 15 . 1 1 133 133 GLN N N 133 119.034 119.034 119.248 -0.214 25259 11758 1 15 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.351 0.051 25259 11759 1 15 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.491 -1.966 25259 11760 1 15 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.709 -1.475 25259 11761 1 15 . 1 1 133 133 GLN H H 133 7.233 7.233 7.440 -0.207 25259 11762 1 15 . 1 1 134 134 LEU N N 134 123.291 123.291 121.745 1.546 25259 11763 1 15 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.299 0.094 25259 11764 1 15 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.344 -1.028 25259 11765 1 15 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.227 -3.380 25259 11766 1 15 . 1 1 134 134 LEU H H 134 7.411 7.411 7.445 -0.034 25259 11767 1 15 . 1 1 135 135 GLU N N 135 128.446 128.446 126.945 1.501 25259 11768 1 15 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.808 0.138 25259 11769 1 15 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.512 -2.128 25259 11770 1 15 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.724 -2.428 25259 11771 1 15 . 1 1 135 135 GLU H H 135 8.986 8.986 9.083 -0.097 25259 11772 1 15 . 1 1 136 136 HIS N N 136 117.593 117.593 111.805 5.788 25259 11773 1 15 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.449 -0.066 25259 11774 1 15 . 1 1 136 136 HIS CA C 136 56.685 56.685 57.611 -0.926 25259 11775 1 15 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.507 -1.094 25259 11776 1 15 . 1 1 136 136 HIS H H 136 9.226 9.226 8.071 1.155 25259 11777 1 15 . 1 1 137 137 LEU N N 137 115.463 115.463 117.548 -2.085 25259 11778 1 15 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.570 -0.063 25259 11779 1 15 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.490 -2.542 25259 11780 1 15 . 1 1 137 137 LEU CB C 137 39.807 39.807 43.145 -3.338 25259 11781 1 15 . 1 1 137 137 LEU H H 137 7.090 7.090 8.083 -0.993 25259 11782 1 15 . 1 1 138 138 LYS N N 138 124.686 124.686 121.240 3.446 25259 11783 1 15 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.205 -0.036 25259 11784 1 15 . 1 1 138 138 LYS CA C 138 57.158 57.158 59.047 -1.889 25259 11785 1 15 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.160 -2.072 25259 11786 1 15 . 1 1 138 138 LYS H H 138 7.698 7.698 8.047 -0.349 25259 11787 1 15 . 1 1 139 139 ASN N N 139 118.077 118.077 113.536 4.541 25259 11788 1 15 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.628 0.045 25259 11789 1 15 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.732 -1.950 25259 11790 1 15 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.770 -2.953 25259 11791 1 15 . 1 1 139 139 ASN H H 139 8.485 8.485 8.197 0.288 25259 11792 1 15 . 1 1 140 140 ILE N N 140 120.880 120.880 120.647 0.233 25259 11793 1 15 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.161 -0.131 25259 11794 1 15 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.455 -1.889 25259 11795 1 15 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.365 -2.591 25259 11796 1 15 . 1 1 140 140 ILE H H 140 7.549 7.549 7.670 -0.121 25259 11797 1 15 . 1 1 141 141 GLY N N 141 110.676 110.676 114.772 -4.096 25259 11798 1 15 . 1 1 141 141 GLY CA C 141 44.664 44.664 45.196 -0.532 25259 11799 1 15 . 1 1 141 141 GLY H H 141 7.663 7.663 8.733 -1.070 25259 11800 1 15 . 1 1 142 142 LEU N N 142 123.857 123.857 123.004 0.853 25259 11801 1 15 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.854 -0.161 25259 11802 1 15 . 1 1 142 142 LEU CA C 142 55.193 55.193 58.036 -2.843 25259 11803 1 15 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.684 -1.075 25259 11804 1 15 . 1 1 142 142 LEU H H 142 8.496 8.496 7.612 0.884 25259 11805 1 15 . 1 1 143 143 GLU N N 143 118.407 118.407 115.009 3.398 25259 11806 1 15 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.966 -0.180 25259 11807 1 15 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.379 -1.157 25259 11808 1 15 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.959 -2.446 25259 11809 1 15 . 1 1 143 143 GLU H H 143 8.672 8.672 8.553 0.119 25259 11810 1 15 . 1 1 144 144 ASN N N 144 118.477 118.477 117.499 0.978 25259 11811 1 15 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.581 -0.139 25259 11812 1 15 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.623 -1.911 25259 11813 1 15 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.725 -2.770 25259 11814 1 15 . 1 1 144 144 ASN H H 144 7.656 7.656 7.283 0.373 25259 11815 1 15 . 1 1 145 145 LEU N N 145 125.354 125.354 122.630 2.724 25259 11816 1 15 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.517 0.280 25259 11817 1 15 . 1 1 145 145 LEU CA C 145 56.323 56.323 58.014 -1.691 25259 11818 1 15 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.702 -2.129 25259 11819 1 15 . 1 1 145 145 LEU H H 145 7.758 7.758 8.395 -0.637 25259 11820 1 15 . 1 1 146 146 LEU N N 146 116.372 116.372 114.173 2.199 25259 11821 1 15 . 1 1 146 146 LEU HA H 146 3.876 3.876 4.201 -0.325 25259 11822 1 15 . 1 1 146 146 LEU CA C 146 53.243 53.243 56.344 -3.102 25259 11823 1 15 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.736 -2.839 25259 11824 1 15 . 1 1 146 146 LEU H H 146 7.242 7.242 7.796 -0.554 25259 11825 1 15 . 1 1 147 147 LYS N N 147 120.054 120.054 116.121 3.933 25259 11826 1 15 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.241 0.071 25259 11827 1 15 . 1 1 147 147 LYS CA C 147 54.623 54.623 56.675 -2.052 25259 11828 1 15 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.445 -2.185 25259 11829 1 15 . 1 1 147 147 LYS H H 147 7.185 7.185 7.870 -0.685 25259 11830 1 15 . 1 1 148 148 ASN N N 148 119.498 119.498 116.221 3.277 25259 11831 1 15 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.887 0.075 25259 11832 1 15 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.692 -1.918 25259 11833 1 15 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.742 -1.256 25259 11834 1 15 . 1 1 148 148 ASN H H 148 7.698 7.698 7.616 0.082 25259 11835 1 15 . 1 1 149 149 GLU N N 149 122.834 122.834 118.223 4.611 25259 11836 1 15 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.361 0.240 25259 11837 1 15 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.686 -2.467 25259 11838 1 15 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.287 -2.477 25259 11839 1 15 . 1 1 149 149 GLU H H 149 8.767 8.767 8.628 0.139 25259 11840 1 15 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.919 0.689 25259 11841 1 15 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.443 -1.201 25259 11842 1 15 . 1 1 150 150 PRO CB C 150 28.095 28.095 30.978 -2.883 25259 11843 1 15 . 1 1 151 151 SER N N 151 112.839 112.839 111.432 1.407 25259 11844 1 15 . 1 1 151 151 SER HA H 151 3.835 3.835 4.458 -0.623 25259 11845 1 15 . 1 1 151 151 SER CA C 151 59.270 59.270 59.369 -0.099 25259 11846 1 15 . 1 1 151 151 SER CB C 151 59.451 59.451 63.190 -3.739 25259 11847 1 15 . 1 1 151 151 SER H H 151 8.519 8.519 8.200 0.319 25259 11848 1 15 . 1 1 152 152 LYS N N 152 126.710 126.710 123.613 3.097 25259 11849 1 15 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.095 0.153 25259 11850 1 15 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.504 -3.739 25259 11851 1 15 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.713 -2.456 25259 11852 1 15 . 1 1 152 152 LYS H H 152 7.006 7.006 7.438 -0.432 25259 11853 1 15 . 1 1 153 153 TYR N N 153 123.239 123.239 117.279 5.960 25259 11854 1 15 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.410 -0.152 25259 11855 1 15 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.934 0.374 25259 11856 1 15 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.435 -1.101 25259 11857 1 15 . 1 1 153 153 TYR H H 153 8.058 8.058 7.944 0.114 25259 11858 1 15 . 1 1 154 154 ILE N N 154 120.253 120.253 121.109 -0.856 25259 11859 1 15 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.175 0.198 25259 11860 1 15 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.062 -1.948 25259 11861 1 15 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.273 -1.325 25259 11862 1 15 . 1 1 154 154 ILE H H 154 8.193 8.193 7.765 0.428 25259 11863 1 15 . 1 1 155 155 SER N N 155 117.178 117.178 115.010 2.168 25259 11864 1 15 . 1 1 155 155 SER HA H 155 4.091 4.091 3.972 0.119 25259 11865 1 15 . 1 1 155 155 SER CA C 155 59.961 59.961 61.569 -1.608 25259 11866 1 15 . 1 1 155 155 SER CB C 155 60.148 60.148 62.768 -2.620 25259 11867 1 15 . 1 1 155 155 SER H H 155 8.020 8.020 7.792 0.228 25259 11868 1 15 . 1 1 156 156 ASP N N 156 125.479 125.479 120.890 4.589 25259 11869 1 15 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.365 0.062 25259 11870 1 15 . 1 1 156 156 ASP CA C 156 54.760 54.760 57.328 -2.568 25259 11871 1 15 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.008 -3.135 25259 11872 1 15 . 1 1 156 156 ASP H H 156 8.638 8.638 7.654 0.984 25259 11873 1 15 . 1 1 157 157 ARG N N 157 121.542 121.542 119.383 2.159 25259 11874 1 15 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.087 0.024 25259 11875 1 15 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.012 -2.084 25259 11876 1 15 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.617 -1.801 25259 11877 1 15 . 1 1 157 157 ARG H H 157 7.888 7.888 7.663 0.225 25259 11878 1 15 . 1 1 158 158 LEU N N 158 124.257 124.257 120.496 3.761 25259 11879 1 15 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.321 -0.050 25259 11880 1 15 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.368 -2.155 25259 11881 1 15 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.256 -1.311 25259 11882 1 15 . 1 1 158 158 LEU H H 158 8.442 8.442 7.658 0.784 25259 11883 1 15 . 1 1 159 159 ALA N N 159 124.146 124.146 121.204 2.942 25259 11884 1 15 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.089 0.243 25259 11885 1 15 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.702 -3.270 25259 11886 1 15 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.389 -2.482 25259 11887 1 15 . 1 1 159 159 ALA H H 159 8.086 8.086 8.275 -0.189 25259 11888 1 15 . 1 1 160 160 ASN N N 160 118.093 118.093 114.457 3.636 25259 11889 1 15 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.752 0.240 25259 11890 1 15 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.089 -2.512 25259 11891 1 15 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.213 -1.480 25259 11892 1 15 . 1 1 160 160 ASN H H 160 7.445 7.445 7.658 -0.213 25259 11893 1 15 . 1 1 161 161 GLY N N 161 108.365 108.365 107.416 0.949 25259 11894 1 15 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.184 -1.538 25259 11895 1 15 . 1 1 161 161 GLY H H 161 7.743 7.743 7.883 -0.140 25259 11896 1 15 . 1 1 162 162 ALA N N 162 123.928 123.928 122.585 1.343 25259 11897 1 15 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.712 0.161 25259 11898 1 15 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.884 -2.358 25259 11899 1 15 . 1 1 162 162 ALA CB C 162 18.060 18.060 20.395 -2.334 25259 11900 1 15 . 1 1 162 162 ALA H H 162 8.035 8.035 7.713 0.322 25259 11901 1 15 . 1 1 163 163 THR N N 163 113.286 113.286 110.937 2.349 25259 11902 1 15 . 1 1 163 163 THR HA H 163 4.703 4.703 4.641 0.062 25259 11903 1 15 . 1 1 163 163 THR CA C 163 57.791 57.791 59.960 -2.169 25259 11904 1 15 . 1 1 163 163 THR CB C 163 68.974 68.974 71.058 -2.084 25259 11905 1 15 . 1 1 163 163 THR H H 163 8.451 8.451 8.098 0.353 25259 11906 1 15 . 1 1 164 164 GLU N N 164 125.905 125.905 118.865 7.040 25259 11907 1 15 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.622 0.438 25259 11908 1 15 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.422 -1.837 25259 11909 1 15 . 1 1 164 164 GLU CB C 164 29.211 29.211 31.481 -2.270 25259 11910 1 15 . 1 1 164 164 GLU H H 164 8.716 8.716 8.461 0.255 25259 11911 1 16 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.099 -0.424 25259 11912 1 16 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.611 -2.803 25259 11913 1 16 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.176 -3.106 25259 11914 1 16 . 1 1 3 3 ALA N N 3 126.741 126.741 121.693 5.048 25259 11915 1 16 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.797 -0.303 25259 11916 1 16 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.538 -1.336 25259 11917 1 16 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.320 -4.502 25259 11918 1 16 . 1 1 3 3 ALA H H 3 8.440 8.440 8.765 -0.325 25259 11919 1 16 . 1 1 4 4 THR N N 4 116.015 116.015 113.802 2.213 25259 11920 1 16 . 1 1 4 4 THR HA H 4 4.393 4.393 4.790 -0.397 25259 11921 1 16 . 1 1 4 4 THR CA C 4 59.148 59.148 62.241 -3.093 25259 11922 1 16 . 1 1 4 4 THR CB C 4 67.580 67.580 69.251 -1.671 25259 11923 1 16 . 1 1 4 4 THR H H 4 8.050 8.050 8.357 -0.307 25259 11924 1 16 . 1 1 5 5 LYS N N 5 126.350 126.350 120.622 5.728 25259 11925 1 16 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.790 -0.285 25259 11926 1 16 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.647 -1.730 25259 11927 1 16 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.749 -4.065 25259 11928 1 16 . 1 1 5 5 LYS H H 5 8.332 8.332 8.516 -0.184 25259 11929 1 16 . 1 1 6 6 THR N N 6 118.124 118.124 113.771 4.353 25259 11930 1 16 . 1 1 6 6 THR HA H 6 4.440 4.440 4.614 -0.174 25259 11931 1 16 . 1 1 6 6 THR CA C 6 59.282 59.282 61.736 -2.454 25259 11932 1 16 . 1 1 6 6 THR CB C 6 67.685 67.685 69.867 -2.182 25259 11933 1 16 . 1 1 6 6 THR H H 6 8.283 8.283 8.165 0.118 25259 11934 1 16 . 1 1 7 7 GLU N N 7 125.934 125.934 122.155 3.779 25259 11935 1 16 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.887 -0.543 25259 11936 1 16 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.465 -1.284 25259 11937 1 16 . 1 1 7 7 GLU CB C 7 27.816 27.816 32.417 -4.601 25259 11938 1 16 . 1 1 7 7 GLU H H 7 8.487 8.487 8.621 -0.134 25259 11939 1 16 . 1 1 8 8 LYS N N 8 123.945 123.945 119.621 4.324 25259 11940 1 16 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.508 -1.573 25259 11941 1 16 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.593 -3.028 25259 11942 1 16 . 1 1 8 8 LYS H H 8 8.278 8.278 8.192 0.086 25259 11943 1 16 . 1 1 9 9 ASP N N 9 123.624 123.624 119.640 3.984 25259 11944 1 16 . 1 1 9 9 ASP HA H 9 4.339 4.339 5.040 -0.701 25259 11945 1 16 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.662 -1.539 25259 11946 1 16 . 1 1 9 9 ASP CB C 9 38.933 38.933 43.194 -4.261 25259 11947 1 16 . 1 1 9 9 ASP H H 9 8.277 8.277 8.613 -0.336 25259 11948 1 16 . 1 1 10 10 THR N N 10 116.812 116.812 116.569 0.243 25259 11949 1 16 . 1 1 10 10 THR HA H 10 4.349 4.349 4.544 -0.195 25259 11950 1 16 . 1 1 10 10 THR CA C 10 59.634 59.634 62.194 -2.560 25259 11951 1 16 . 1 1 10 10 THR CB C 10 67.254 67.254 69.894 -2.640 25259 11952 1 16 . 1 1 10 10 THR H H 10 8.049 8.049 8.487 -0.438 25259 11953 1 16 . 1 1 11 11 LEU N N 11 126.610 126.610 126.259 0.351 25259 11954 1 16 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.383 0.009 25259 11955 1 16 . 1 1 11 11 LEU CA C 11 53.078 53.078 55.768 -2.690 25259 11956 1 16 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.550 -2.917 25259 11957 1 16 . 1 1 11 11 LEU H H 11 8.191 8.191 8.518 -0.327 25259 11958 1 16 . 1 1 12 12 GLN N N 12 123.274 123.274 119.762 3.512 25259 11959 1 16 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.863 -0.481 25259 11960 1 16 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.926 -1.352 25259 11961 1 16 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.475 -4.672 25259 11962 1 16 . 1 1 12 12 GLN H H 12 8.280 8.280 8.817 -0.537 25259 11963 1 16 . 1 1 13 13 SER N N 13 119.027 119.027 114.833 4.194 25259 11964 1 16 . 1 1 13 13 SER HA H 13 4.471 4.471 5.378 -0.907 25259 11965 1 16 . 1 1 13 13 SER CA C 13 55.869 55.869 56.990 -1.121 25259 11966 1 16 . 1 1 13 13 SER CB C 13 61.424 61.424 65.744 -4.320 25259 11967 1 16 . 1 1 13 13 SER H H 13 8.178 8.178 8.827 -0.649 25259 11968 1 16 . 1 1 14 14 ALA N N 14 128.314 128.314 122.955 5.359 25259 11969 1 16 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.551 -0.117 25259 11970 1 16 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.683 -1.987 25259 11971 1 16 . 1 1 14 14 ALA CB C 14 17.081 17.081 20.192 -3.111 25259 11972 1 16 . 1 1 14 14 ALA H H 14 8.195 8.195 8.239 -0.044 25259 11973 1 16 . 1 1 15 15 LEU N N 15 125.175 125.175 119.115 6.060 25259 11974 1 16 . 1 1 15 15 LEU HA H 15 4.640 4.640 5.218 -0.578 25259 11975 1 16 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.158 -2.554 25259 11976 1 16 . 1 1 15 15 LEU CB C 15 39.467 39.467 42.925 -3.458 25259 11977 1 16 . 1 1 15 15 LEU H H 15 8.050 8.050 8.744 -0.694 25259 11978 1 16 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.631 -0.127 25259 11979 1 16 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.992 -2.361 25259 11980 1 16 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.587 -2.929 25259 11981 1 16 . 1 1 17 17 VAL N N 17 123.223 123.223 118.257 4.966 25259 11982 1 16 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.345 -0.211 25259 11983 1 16 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.043 -1.216 25259 11984 1 16 . 1 1 17 17 VAL CB C 17 30.377 30.377 33.868 -3.491 25259 11985 1 16 . 1 1 17 17 VAL H H 17 8.134 8.134 8.113 0.021 25259 11986 1 16 . 1 1 18 18 ILE N N 18 127.777 127.777 124.288 3.489 25259 11987 1 16 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.368 -0.125 25259 11988 1 16 . 1 1 18 18 ILE CA C 18 58.322 58.322 61.622 -3.300 25259 11989 1 16 . 1 1 18 18 ILE CB C 18 36.254 36.254 37.574 -1.320 25259 11990 1 16 . 1 1 18 18 ILE H H 18 8.187 8.187 8.265 -0.078 25259 11991 1 16 . 1 1 19 19 GLU N N 19 128.148 128.148 125.422 2.726 25259 11992 1 16 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.655 -0.319 25259 11993 1 16 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.446 -1.355 25259 11994 1 16 . 1 1 19 19 GLU CB C 19 28.176 28.176 31.328 -3.152 25259 11995 1 16 . 1 1 19 19 GLU H H 19 8.475 8.475 8.892 -0.417 25259 11996 1 16 . 1 1 20 20 ASN N N 20 122.788 122.788 118.955 3.833 25259 11997 1 16 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.206 -0.511 25259 11998 1 16 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.302 -1.480 25259 11999 1 16 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.596 -4.231 25259 12000 1 16 . 1 1 20 20 ASN H H 20 8.477 8.477 8.935 -0.458 25259 12001 1 16 . 1 1 21 21 ALA N N 21 127.253 127.253 123.345 3.908 25259 12002 1 16 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.283 0.038 25259 12003 1 16 . 1 1 21 21 ALA CA C 21 50.688 50.688 52.703 -2.014 25259 12004 1 16 . 1 1 21 21 ALA CB C 21 16.913 16.913 19.439 -2.526 25259 12005 1 16 . 1 1 21 21 ALA H H 21 8.325 8.325 8.492 -0.167 25259 12006 1 16 . 1 1 22 22 GLU N N 22 122.044 122.044 120.422 1.622 25259 12007 1 16 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.485 -0.192 25259 12008 1 16 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.555 -1.972 25259 12009 1 16 . 1 1 22 22 GLU CB C 22 27.285 27.285 29.850 -2.565 25259 12010 1 16 . 1 1 22 22 GLU H H 22 8.415 8.415 8.549 -0.134 25259 12011 1 16 . 1 1 23 23 LYS N N 23 123.622 123.622 122.208 1.414 25259 12012 1 16 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.595 -0.270 25259 12013 1 16 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.191 -1.695 25259 12014 1 16 . 1 1 23 23 LYS CB C 23 30.653 30.653 34.749 -4.096 25259 12015 1 16 . 1 1 23 23 LYS H H 23 8.127 8.127 8.409 -0.282 25259 12016 1 16 . 1 1 24 24 ASN N N 24 120.652 120.652 120.489 0.163 25259 12017 1 16 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.765 0.076 25259 12018 1 16 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.818 -2.155 25259 12019 1 16 . 1 1 24 24 ASN CB C 24 36.775 36.775 41.086 -4.311 25259 12020 1 16 . 1 1 24 24 ASN H H 24 8.424 8.424 8.297 0.127 25259 12021 1 16 . 1 1 25 25 THR N N 25 117.102 117.102 115.877 1.225 25259 12022 1 16 . 1 1 25 25 THR HA H 25 4.367 4.367 4.226 0.141 25259 12023 1 16 . 1 1 25 25 THR CA C 25 59.500 59.500 62.597 -3.097 25259 12024 1 16 . 1 1 25 25 THR CB C 25 67.610 67.610 68.163 -0.553 25259 12025 1 16 . 1 1 25 25 THR H H 25 7.852 7.852 8.448 -0.596 25259 12026 1 16 . 1 1 26 26 VAL N N 26 126.491 126.491 127.107 -0.616 25259 12027 1 16 . 1 1 26 26 VAL HA H 26 4.167 4.167 3.930 0.237 25259 12028 1 16 . 1 1 26 26 VAL CA C 26 60.193 60.193 63.455 -3.262 25259 12029 1 16 . 1 1 26 26 VAL CB C 26 29.605 29.605 32.088 -2.483 25259 12030 1 16 . 1 1 26 26 VAL H H 26 8.080 8.080 8.317 -0.237 25259 12031 1 16 . 1 1 27 27 VAL N N 27 132.992 132.992 127.623 5.369 25259 12032 1 16 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.438 -0.357 25259 12033 1 16 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.825 -1.841 25259 12034 1 16 . 1 1 27 27 VAL CB C 27 31.540 31.540 35.239 -3.699 25259 12035 1 16 . 1 1 27 27 VAL H H 27 8.830 8.830 8.791 0.039 25259 12036 1 16 . 1 1 28 28 THR N N 28 123.576 123.576 117.991 5.585 25259 12037 1 16 . 1 1 28 28 THR HA H 28 5.553 5.553 4.660 0.893 25259 12038 1 16 . 1 1 28 28 THR CA C 28 58.738 58.738 61.030 -2.292 25259 12039 1 16 . 1 1 28 28 THR CB C 28 68.443 68.443 69.929 -1.486 25259 12040 1 16 . 1 1 28 28 THR H H 28 8.165 8.165 8.385 -0.220 25259 12041 1 16 . 1 1 29 29 LYS N N 29 129.099 129.099 127.573 1.526 25259 12042 1 16 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.721 0.221 25259 12043 1 16 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.562 -3.783 25259 12044 1 16 . 1 1 29 29 LYS CB C 29 35.096 35.096 36.702 -1.606 25259 12045 1 16 . 1 1 29 29 LYS H H 29 9.273 9.273 8.525 0.748 25259 12046 1 16 . 1 1 30 30 THR N N 30 123.510 123.510 119.693 3.817 25259 12047 1 16 . 1 1 30 30 THR HA H 30 5.428 5.428 5.304 0.124 25259 12048 1 16 . 1 1 30 30 THR CA C 30 59.784 59.784 61.789 -2.005 25259 12049 1 16 . 1 1 30 30 THR CB C 30 67.818 67.818 71.957 -4.139 25259 12050 1 16 . 1 1 30 30 THR H H 30 8.993 8.993 8.318 0.675 25259 12051 1 16 . 1 1 31 31 LEU N N 31 128.293 128.293 123.324 4.969 25259 12052 1 16 . 1 1 31 31 LEU HA H 31 5.220 5.220 5.099 0.121 25259 12053 1 16 . 1 1 31 31 LEU CA C 31 50.055 50.055 52.704 -2.649 25259 12054 1 16 . 1 1 31 31 LEU CB C 31 43.399 43.399 44.618 -1.219 25259 12055 1 16 . 1 1 31 31 LEU H H 31 9.557 9.557 9.151 0.406 25259 12056 1 16 . 1 1 32 32 VAL N N 32 126.919 126.919 122.314 4.605 25259 12057 1 16 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.236 0.215 25259 12058 1 16 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.576 -1.912 25259 12059 1 16 . 1 1 32 32 VAL CB C 32 29.449 29.449 31.553 -2.104 25259 12060 1 16 . 1 1 32 32 VAL H H 32 9.364 9.364 8.824 0.540 25259 12061 1 16 . 1 1 33 33 LEU N N 33 133.503 133.503 129.412 4.091 25259 12062 1 16 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.424 0.132 25259 12063 1 16 . 1 1 33 33 LEU CA C 33 52.004 52.004 52.809 -0.805 25259 12064 1 16 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.396 -3.549 25259 12065 1 16 . 1 1 33 33 LEU H H 33 8.587 8.587 7.818 0.769 25259 12066 1 16 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.515 -0.034 25259 12067 1 16 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.263 -1.818 25259 12068 1 16 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.286 -2.721 25259 12069 1 16 . 1 1 35 35 LYS N N 35 127.420 127.420 119.394 8.026 25259 12070 1 16 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.289 0.077 25259 12071 1 16 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.939 -1.820 25259 12072 1 16 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.791 -2.197 25259 12073 1 16 . 1 1 35 35 LYS H H 35 8.666 8.666 8.303 0.363 25259 12074 1 16 . 1 1 36 36 SER N N 36 122.222 122.222 113.727 8.495 25259 12075 1 16 . 1 1 36 36 SER HA H 36 4.753 4.753 4.611 0.142 25259 12076 1 16 . 1 1 36 36 SER CA C 36 55.328 55.328 57.054 -1.726 25259 12077 1 16 . 1 1 36 36 SER CB C 36 61.728 61.728 65.124 -3.396 25259 12078 1 16 . 1 1 36 36 SER H H 36 8.771 8.771 7.938 0.833 25259 12079 1 16 . 1 1 37 37 ASP N N 37 126.346 126.346 120.439 5.907 25259 12080 1 16 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.582 -0.128 25259 12081 1 16 . 1 1 37 37 ASP CA C 37 54.616 54.616 55.627 -1.011 25259 12082 1 16 . 1 1 37 37 ASP CB C 37 37.985 37.985 41.092 -3.107 25259 12083 1 16 . 1 1 37 37 ASP H H 37 8.859 8.859 8.434 0.425 25259 12084 1 16 . 1 1 38 38 ASP N N 38 119.171 119.171 118.231 0.940 25259 12085 1 16 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.827 -0.212 25259 12086 1 16 . 1 1 38 38 ASP CA C 38 50.788 50.788 52.907 -2.119 25259 12087 1 16 . 1 1 38 38 ASP CB C 38 37.635 37.635 40.405 -2.770 25259 12088 1 16 . 1 1 38 38 ASP H H 38 7.944 7.944 7.704 0.240 25259 12089 1 16 . 1 1 39 39 GLY N N 39 110.352 110.352 109.271 1.081 25259 12090 1 16 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.979 -3.218 25259 12091 1 16 . 1 1 39 39 GLY H H 39 8.145 8.145 7.876 0.269 25259 12092 1 16 . 1 1 40 40 SER N N 40 120.090 120.090 118.794 1.296 25259 12093 1 16 . 1 1 40 40 SER HA H 40 4.877 4.877 4.439 0.439 25259 12094 1 16 . 1 1 40 40 SER CA C 40 56.525 56.525 59.322 -2.797 25259 12095 1 16 . 1 1 40 40 SER CB C 40 62.245 62.245 62.782 -0.537 25259 12096 1 16 . 1 1 40 40 SER H H 40 8.344 8.344 7.828 0.516 25259 12097 1 16 . 1 1 41 41 GLN N N 41 122.551 122.551 127.022 -4.471 25259 12098 1 16 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.576 0.351 25259 12099 1 16 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.086 -1.672 25259 12100 1 16 . 1 1 41 41 GLN CB C 41 30.314 30.314 32.791 -2.477 25259 12101 1 16 . 1 1 41 41 GLN H H 41 8.627 8.627 8.758 -0.131 25259 12102 1 16 . 1 1 42 42 GLN N N 42 131.724 131.724 122.640 9.084 25259 12103 1 16 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.696 0.915 25259 12104 1 16 . 1 1 42 42 GLN CA C 42 52.072 52.072 53.618 -1.546 25259 12105 1 16 . 1 1 42 42 GLN CB C 42 30.319 30.319 31.844 -1.525 25259 12106 1 16 . 1 1 42 42 GLN H H 42 9.189 9.189 8.615 0.574 25259 12107 1 16 . 1 1 43 43 THR N N 43 122.202 122.202 114.014 8.188 25259 12108 1 16 . 1 1 43 43 THR HA H 43 5.380 5.380 5.210 0.170 25259 12109 1 16 . 1 1 43 43 THR CA C 43 58.863 58.863 60.725 -1.862 25259 12110 1 16 . 1 1 43 43 THR CB C 43 68.893 68.893 72.165 -3.272 25259 12111 1 16 . 1 1 43 43 THR H H 43 9.139 9.139 8.369 0.770 25259 12112 1 16 . 1 1 44 44 GLN N N 44 127.190 127.190 121.487 5.703 25259 12113 1 16 . 1 1 44 44 GLN HA H 44 5.634 5.634 4.764 0.870 25259 12114 1 16 . 1 1 44 44 GLN CA C 44 51.668 51.668 55.429 -3.761 25259 12115 1 16 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.839 -3.929 25259 12116 1 16 . 1 1 44 44 GLN H H 44 9.760 9.760 8.644 1.116 25259 12117 1 16 . 1 1 45 45 THR N N 45 123.479 123.479 119.821 3.658 25259 12118 1 16 . 1 1 45 45 THR HA H 45 5.421 5.421 5.248 0.173 25259 12119 1 16 . 1 1 45 45 THR CA C 45 60.071 60.071 61.240 -1.169 25259 12120 1 16 . 1 1 45 45 THR CB C 45 67.541 67.541 70.365 -2.824 25259 12121 1 16 . 1 1 45 45 THR H H 45 9.518 9.518 8.882 0.636 25259 12122 1 16 . 1 1 46 46 ILE N N 46 133.908 133.908 124.526 9.382 25259 12123 1 16 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.591 0.412 25259 12124 1 16 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.980 -2.509 25259 12125 1 16 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.563 0.382 25259 12126 1 16 . 1 1 46 46 ILE H H 46 9.830 9.830 9.268 0.562 25259 12127 1 16 . 1 1 47 47 THR N N 47 124.701 124.701 124.364 0.337 25259 12128 1 16 . 1 1 47 47 THR HA H 47 6.048 6.048 4.885 1.163 25259 12129 1 16 . 1 1 47 47 THR CA C 47 58.551 58.551 62.912 -4.361 25259 12130 1 16 . 1 1 47 47 THR CB C 47 67.819 67.819 69.406 -1.587 25259 12131 1 16 . 1 1 47 47 THR H H 47 8.843 8.843 8.491 0.352 25259 12132 1 16 . 1 1 48 48 TYR N N 48 127.369 127.369 123.852 3.517 25259 12133 1 16 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.092 0.186 25259 12134 1 16 . 1 1 48 48 TYR CA C 48 53.729 53.729 55.844 -2.115 25259 12135 1 16 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.562 -2.130 25259 12136 1 16 . 1 1 48 48 TYR H H 48 9.638 9.638 8.152 1.486 25259 12137 1 16 . 1 1 49 49 LYS N N 49 122.138 122.138 117.197 4.941 25259 12138 1 16 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.555 0.101 25259 12139 1 16 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.749 -2.777 25259 12140 1 16 . 1 1 49 49 LYS CB C 49 33.603 33.603 35.076 -1.473 25259 12141 1 16 . 1 1 49 49 LYS H H 49 8.560 8.560 8.763 -0.203 25259 12142 1 16 . 1 1 50 50 ASP N N 50 130.208 130.208 120.804 9.404 25259 12143 1 16 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.756 -0.453 25259 12144 1 16 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.344 -0.584 25259 12145 1 16 . 1 1 50 50 ASP CB C 50 37.339 37.339 43.404 -6.066 25259 12146 1 16 . 1 1 50 50 ASP H H 50 9.597 9.597 8.504 1.093 25259 12147 1 16 . 1 1 51 51 LYS N N 51 124.586 124.586 117.065 7.521 25259 12148 1 16 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.571 -0.040 25259 12149 1 16 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.107 -2.373 25259 12150 1 16 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.426 -4.031 25259 12151 1 16 . 1 1 51 51 LYS H H 51 8.450 8.450 8.288 0.162 25259 12152 1 16 . 1 1 52 52 THR N N 52 120.044 120.044 113.625 6.419 25259 12153 1 16 . 1 1 52 52 THR HA H 52 4.717 4.717 4.532 0.185 25259 12154 1 16 . 1 1 52 52 THR CA C 52 59.313 59.313 61.183 -1.870 25259 12155 1 16 . 1 1 52 52 THR CB C 52 68.815 68.815 71.254 -2.439 25259 12156 1 16 . 1 1 52 52 THR H H 52 8.658 8.658 7.721 0.937 25259 12157 1 16 . 1 1 53 53 PHE N N 53 128.987 128.987 124.220 4.767 25259 12158 1 16 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.522 -0.239 25259 12159 1 16 . 1 1 53 53 PHE CA C 53 57.989 57.989 58.565 -0.576 25259 12160 1 16 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.546 0.765 25259 12161 1 16 . 1 1 53 53 PHE H H 53 9.218 9.218 8.608 0.610 25259 12162 1 16 . 1 1 54 54 LEU N N 54 124.874 124.874 125.612 -0.738 25259 12163 1 16 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.191 0.738 25259 12164 1 16 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.205 -2.964 25259 12165 1 16 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.758 -2.241 25259 12166 1 16 . 1 1 54 54 LEU H H 54 9.391 9.391 8.249 1.142 25259 12167 1 16 . 1 1 55 55 SER N N 55 115.516 115.516 108.068 7.448 25259 12168 1 16 . 1 1 55 55 SER HA H 55 5.194 5.194 5.387 -0.193 25259 12169 1 16 . 1 1 55 55 SER CA C 55 55.818 55.818 57.475 -1.657 25259 12170 1 16 . 1 1 55 55 SER CB C 55 63.474 63.474 67.126 -3.652 25259 12171 1 16 . 1 1 55 55 SER H H 55 8.736 8.736 7.733 1.003 25259 12172 1 16 . 1 1 56 56 LEU N N 56 124.352 124.352 122.008 2.344 25259 12173 1 16 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.194 0.349 25259 12174 1 16 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.481 -2.844 25259 12175 1 16 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.196 -0.683 25259 12176 1 16 . 1 1 56 56 LEU H H 56 8.328 8.328 8.874 -0.546 25259 12177 1 16 . 1 1 57 57 ALA N N 57 131.450 131.450 130.710 0.740 25259 12178 1 16 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.400 0.105 25259 12179 1 16 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.566 -2.365 25259 12180 1 16 . 1 1 57 57 ALA CB C 57 18.964 18.964 20.899 -1.935 25259 12181 1 16 . 1 1 57 57 ALA H H 57 9.208 9.208 8.304 0.904 25259 12182 1 16 . 1 1 58 58 ILE N N 58 126.248 126.248 126.641 -0.393 25259 12183 1 16 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.308 0.476 25259 12184 1 16 . 1 1 58 58 ILE CA C 58 58.247 58.247 62.127 -3.880 25259 12185 1 16 . 1 1 58 58 ILE CB C 58 38.045 38.045 38.247 -0.202 25259 12186 1 16 . 1 1 58 58 ILE H H 58 9.597 9.597 8.457 1.140 25259 12187 1 16 . 1 1 59 59 GLN N N 59 132.065 132.065 128.266 3.799 25259 12188 1 16 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.522 0.725 25259 12189 1 16 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.782 -3.618 25259 12190 1 16 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.512 -0.851 25259 12191 1 16 . 1 1 59 59 GLN H H 59 9.389 9.389 8.506 0.883 25259 12192 1 16 . 1 1 60 60 GLN N N 60 130.314 130.314 117.850 12.464 25259 12193 1 16 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.724 0.485 25259 12194 1 16 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.300 -2.280 25259 12195 1 16 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.508 -4.032 25259 12196 1 16 . 1 1 60 60 GLN H H 60 9.471 9.471 8.858 0.613 25259 12197 1 16 . 1 1 61 61 LYS N N 61 131.044 131.044 123.166 7.878 25259 12198 1 16 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.069 0.346 25259 12199 1 16 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.103 -2.983 25259 12200 1 16 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.306 -2.889 25259 12201 1 16 . 1 1 61 61 LYS H H 61 8.893 8.893 8.670 0.223 25259 12202 1 16 . 1 1 62 62 ARG N N 62 125.397 125.397 123.564 1.833 25259 12203 1 16 . 1 1 62 62 ARG HA H 62 5.003 5.003 4.969 0.034 25259 12204 1 16 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.075 -1.984 25259 12205 1 16 . 1 1 62 62 ARG CB C 62 29.878 29.878 32.517 -2.639 25259 12206 1 16 . 1 1 62 62 ARG H H 62 9.120 9.120 8.078 1.042 25259 12207 1 16 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.857 0.118 25259 12208 1 16 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.650 -3.153 25259 12209 1 16 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.254 -2.370 25259 12210 1 16 . 1 1 64 64 VAL N N 64 121.305 121.305 114.660 6.645 25259 12211 1 16 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.550 -0.526 25259 12212 1 16 . 1 1 64 64 VAL CA C 64 59.677 59.677 60.963 -1.286 25259 12213 1 16 . 1 1 64 64 VAL CB C 64 30.365 30.365 35.604 -5.239 25259 12214 1 16 . 1 1 64 64 VAL H H 64 7.520 7.520 8.358 -0.838 25259 12215 1 16 . 1 1 65 65 SER N N 65 123.215 123.215 114.226 8.989 25259 12216 1 16 . 1 1 65 65 SER HA H 65 4.521 4.521 4.662 -0.141 25259 12217 1 16 . 1 1 65 65 SER CA C 65 54.897 54.897 58.349 -3.451 25259 12218 1 16 . 1 1 65 65 SER CB C 65 62.564 62.564 63.616 -1.052 25259 12219 1 16 . 1 1 65 65 SER H H 65 8.080 8.080 8.602 -0.522 25259 12220 1 16 . 1 1 66 66 ASP N N 66 123.802 123.802 120.865 2.937 25259 12221 1 16 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.696 -0.267 25259 12222 1 16 . 1 1 66 66 ASP CA C 66 55.378 55.378 54.961 0.417 25259 12223 1 16 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.022 -2.984 25259 12224 1 16 . 1 1 66 66 ASP H H 66 8.900 8.900 8.061 0.839 25259 12225 1 16 . 1 1 67 67 GLU N N 67 121.943 121.943 120.678 1.265 25259 12226 1 16 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.078 0.111 25259 12227 1 16 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.404 -1.964 25259 12228 1 16 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.546 -2.761 25259 12229 1 16 . 1 1 67 67 GLU H H 67 8.717 8.717 8.598 0.119 25259 12230 1 16 . 1 1 68 68 LEU N N 68 125.458 125.458 120.261 5.197 25259 12231 1 16 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.365 -0.022 25259 12232 1 16 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.112 -2.640 25259 12233 1 16 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.742 -2.338 25259 12234 1 16 . 1 1 68 68 LEU H H 68 7.820 7.820 7.835 -0.015 25259 12235 1 16 . 1 1 69 69 LYS N N 69 123.868 123.868 120.225 3.643 25259 12236 1 16 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.025 -0.019 25259 12237 1 16 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.512 -1.895 25259 12238 1 16 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.815 -1.778 25259 12239 1 16 . 1 1 69 69 LYS H H 69 8.690 8.690 8.489 0.201 25259 12240 1 16 . 1 1 70 70 THR N N 70 117.109 117.109 116.290 0.819 25259 12241 1 16 . 1 1 70 70 THR HA H 70 4.088 4.088 3.974 0.114 25259 12242 1 16 . 1 1 70 70 THR CA C 70 63.879 63.879 66.956 -3.077 25259 12243 1 16 . 1 1 70 70 THR CB C 70 66.383 66.383 68.581 -2.198 25259 12244 1 16 . 1 1 70 70 THR H H 70 7.935 7.935 8.124 -0.189 25259 12245 1 16 . 1 1 71 71 TYR N N 71 127.006 127.006 123.217 3.789 25259 12246 1 16 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.340 -0.135 25259 12247 1 16 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.738 -1.513 25259 12248 1 16 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.124 -1.579 25259 12249 1 16 . 1 1 71 71 TYR H H 71 7.683 7.683 7.612 0.071 25259 12250 1 16 . 1 1 72 72 ILE N N 72 125.064 125.064 120.747 4.317 25259 12251 1 16 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.776 -0.097 25259 12252 1 16 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.299 -2.404 25259 12253 1 16 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.911 -1.635 25259 12254 1 16 . 1 1 72 72 ILE H H 72 9.083 9.083 8.419 0.664 25259 12255 1 16 . 1 1 73 73 ASP N N 73 124.900 124.900 119.538 5.362 25259 12256 1 16 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.476 -0.087 25259 12257 1 16 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.553 -1.516 25259 12258 1 16 . 1 1 73 73 ASP CB C 73 38.107 38.107 41.010 -2.903 25259 12259 1 16 . 1 1 73 73 ASP H H 73 8.751 8.751 8.179 0.572 25259 12260 1 16 . 1 1 74 74 GLN N N 74 117.025 117.025 117.233 -0.208 25259 12261 1 16 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.852 0.286 25259 12262 1 16 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.269 -3.459 25259 12263 1 16 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.195 -1.631 25259 12264 1 16 . 1 1 74 74 GLN H H 74 7.447 7.447 7.952 -0.505 25259 12265 1 16 . 1 1 75 75 HIS N N 75 116.494 116.494 114.384 2.110 25259 12266 1 16 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.767 -0.051 25259 12267 1 16 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.346 -2.280 25259 12268 1 16 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.013 -4.711 25259 12269 1 16 . 1 1 75 75 HIS H H 75 8.402 8.402 8.184 0.218 25259 12270 1 16 . 1 1 76 76 GLY N N 76 112.564 112.564 107.019 5.545 25259 12271 1 16 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.539 -2.643 25259 12272 1 16 . 1 1 76 76 GLY H H 76 9.091 9.091 7.929 1.162 25259 12273 1 16 . 1 1 77 77 VAL N N 77 124.763 124.763 121.316 3.447 25259 12274 1 16 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.709 -0.144 25259 12275 1 16 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.665 -0.714 25259 12276 1 16 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.278 -2.440 25259 12277 1 16 . 1 1 77 77 VAL H H 77 8.927 8.927 8.717 0.210 25259 12278 1 16 . 1 1 78 78 GLU N N 78 124.388 124.388 117.515 6.873 25259 12279 1 16 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.074 0.074 25259 12280 1 16 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.367 -1.052 25259 12281 1 16 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.955 -2.496 25259 12282 1 16 . 1 1 78 78 GLU H H 78 8.781 8.781 8.630 0.151 25259 12283 1 16 . 1 1 79 79 GLU N N 79 121.887 121.887 117.851 4.036 25259 12284 1 16 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.224 -0.036 25259 12285 1 16 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.442 -1.897 25259 12286 1 16 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.849 -2.816 25259 12287 1 16 . 1 1 79 79 GLU H H 79 9.231 9.231 7.851 1.380 25259 12288 1 16 . 1 1 80 80 THR N N 80 120.781 120.781 117.722 3.059 25259 12289 1 16 . 1 1 80 80 THR HA H 80 4.059 4.059 3.485 0.574 25259 12290 1 16 . 1 1 80 80 THR CA C 80 65.487 65.487 66.800 -1.313 25259 12291 1 16 . 1 1 80 80 THR CB C 80 64.369 64.369 68.366 -3.997 25259 12292 1 16 . 1 1 80 80 THR H H 80 7.858 7.858 8.409 -0.551 25259 12293 1 16 . 1 1 81 81 GLN N N 81 125.303 125.303 120.952 4.351 25259 12294 1 16 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.898 0.146 25259 12295 1 16 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.144 -2.175 25259 12296 1 16 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.409 -2.332 25259 12297 1 16 . 1 1 81 81 GLN H H 81 8.765 8.765 7.662 1.103 25259 12298 1 16 . 1 1 82 82 LYS N N 82 120.458 120.458 118.118 2.340 25259 12299 1 16 . 1 1 82 82 LYS HA H 82 4.089 4.089 4.019 0.070 25259 12300 1 16 . 1 1 82 82 LYS CA C 82 57.312 57.312 57.991 -0.679 25259 12301 1 16 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.931 -1.777 25259 12302 1 16 . 1 1 82 82 LYS H H 82 7.521 7.521 7.961 -0.440 25259 12303 1 16 . 1 1 83 83 ALA N N 83 125.234 125.234 123.043 2.191 25259 12304 1 16 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.800 0.417 25259 12305 1 16 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.687 -2.245 25259 12306 1 16 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.611 -2.324 25259 12307 1 16 . 1 1 83 83 ALA H H 83 7.782 7.782 7.010 0.772 25259 12308 1 16 . 1 1 84 84 LEU N N 84 123.348 123.348 117.632 5.716 25259 12309 1 16 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.983 0.075 25259 12310 1 16 . 1 1 84 84 LEU CA C 84 55.499 55.499 56.648 -1.149 25259 12311 1 16 . 1 1 84 84 LEU CB C 84 39.308 39.308 39.869 -0.561 25259 12312 1 16 . 1 1 84 84 LEU H H 84 8.590 8.590 7.345 1.245 25259 12313 1 16 . 1 1 85 85 LEU N N 85 122.872 122.872 119.923 2.949 25259 12314 1 16 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.881 0.289 25259 12315 1 16 . 1 1 85 85 LEU CA C 85 55.396 55.396 58.041 -2.645 25259 12316 1 16 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.237 -2.496 25259 12317 1 16 . 1 1 85 85 LEU H H 85 7.892 7.892 7.539 0.353 25259 12318 1 16 . 1 1 86 86 GLU N N 86 122.713 122.713 118.356 4.357 25259 12319 1 16 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.147 -0.062 25259 12320 1 16 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.902 -2.157 25259 12321 1 16 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.783 -2.880 25259 12322 1 16 . 1 1 86 86 GLU H H 86 8.124 8.124 8.011 0.114 25259 12323 1 16 . 1 1 87 87 ALA N N 87 123.163 123.163 121.769 1.394 25259 12324 1 16 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.137 0.004 25259 12325 1 16 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.608 -2.340 25259 12326 1 16 . 1 1 87 87 ALA CB C 87 15.632 15.632 19.244 -3.612 25259 12327 1 16 . 1 1 87 87 ALA H H 87 7.765 7.765 7.392 0.373 25259 12328 1 16 . 1 1 88 88 GLU N N 88 121.945 121.945 118.406 3.539 25259 12329 1 16 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.009 0.075 25259 12330 1 16 . 1 1 88 88 GLU CA C 88 56.935 56.935 59.012 -2.077 25259 12331 1 16 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.287 -1.260 25259 12332 1 16 . 1 1 88 88 GLU H H 88 7.846 7.846 8.521 -0.675 25259 12333 1 16 . 1 1 89 89 GLU N N 89 117.978 117.978 117.349 0.629 25259 12334 1 16 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.051 0.042 25259 12335 1 16 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.549 -3.335 25259 12336 1 16 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.539 -2.132 25259 12337 1 16 . 1 1 89 89 GLU H H 89 7.634 7.634 8.286 -0.652 25259 12338 1 16 . 1 1 90 90 LYS N N 90 117.519 117.519 112.106 5.413 25259 12339 1 16 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.559 -0.128 25259 12340 1 16 . 1 1 90 90 LYS CA C 90 53.018 53.018 54.990 -1.972 25259 12341 1 16 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.834 -1.803 25259 12342 1 16 . 1 1 90 90 LYS H H 90 7.247 7.247 7.860 -0.613 25259 12343 1 16 . 1 1 91 91 ASP N N 91 124.888 124.888 123.338 1.550 25259 12344 1 16 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.700 -0.017 25259 12345 1 16 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.351 -2.152 25259 12346 1 16 . 1 1 91 91 ASP CB C 91 39.581 39.581 39.370 0.211 25259 12347 1 16 . 1 1 91 91 ASP H H 91 7.370 7.370 7.729 -0.359 25259 12348 1 16 . 1 1 92 92 LYS N N 92 129.311 129.311 121.328 7.983 25259 12349 1 16 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.671 0.342 25259 12350 1 16 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.909 -2.693 25259 12351 1 16 . 1 1 92 92 LYS CB C 92 30.015 30.015 31.279 -1.264 25259 12352 1 16 . 1 1 92 92 LYS H H 92 8.795 8.795 8.514 0.281 25259 12353 1 16 . 1 1 93 93 SER N N 93 118.112 118.112 114.960 3.152 25259 12354 1 16 . 1 1 93 93 SER HA H 93 4.439 4.439 4.056 0.383 25259 12355 1 16 . 1 1 93 93 SER CA C 93 58.945 58.945 61.646 -2.701 25259 12356 1 16 . 1 1 93 93 SER CB C 93 60.278 60.278 63.219 -2.941 25259 12357 1 16 . 1 1 93 93 SER H H 93 8.488 8.488 8.024 0.464 25259 12358 1 16 . 1 1 94 94 ILE N N 94 128.950 128.950 120.027 8.923 25259 12359 1 16 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.657 -0.175 25259 12360 1 16 . 1 1 94 94 ILE CA C 94 62.349 62.349 63.644 -1.295 25259 12361 1 16 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.430 -2.677 25259 12362 1 16 . 1 1 94 94 ILE H H 94 7.722 7.722 7.842 -0.120 25259 12363 1 16 . 1 1 95 95 ILE N N 95 123.598 123.598 121.853 1.745 25259 12364 1 16 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.597 -0.002 25259 12365 1 16 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.549 -2.802 25259 12366 1 16 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.663 -1.691 25259 12367 1 16 . 1 1 95 95 ILE H H 95 8.378 8.378 7.074 1.304 25259 12368 1 16 . 1 1 96 96 GLU N N 96 118.317 118.317 117.671 0.646 25259 12369 1 16 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.971 0.013 25259 12370 1 16 . 1 1 96 96 GLU CA C 96 56.495 56.495 58.572 -2.077 25259 12371 1 16 . 1 1 96 96 GLU CB C 96 27.173 27.173 28.976 -1.803 25259 12372 1 16 . 1 1 96 96 GLU H H 96 7.680 7.680 8.166 -0.486 25259 12373 1 16 . 1 1 97 97 ALA N N 97 124.797 124.797 120.547 4.250 25259 12374 1 16 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.943 -0.118 25259 12375 1 16 . 1 1 97 97 ALA CA C 97 52.297 52.297 53.639 -1.342 25259 12376 1 16 . 1 1 97 97 ALA CB C 97 14.989 14.989 18.219 -3.230 25259 12377 1 16 . 1 1 97 97 ALA H H 97 7.383 7.383 7.385 -0.002 25259 12378 1 16 . 1 1 98 98 ARG N N 98 115.469 115.469 117.838 -2.369 25259 12379 1 16 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.278 0.028 25259 12380 1 16 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.697 -2.207 25259 12381 1 16 . 1 1 98 98 ARG CB C 98 28.238 28.238 30.391 -2.153 25259 12382 1 16 . 1 1 98 98 ARG H H 98 8.229 8.229 8.223 0.006 25259 12383 1 16 . 1 1 99 99 LYS N N 99 120.219 120.219 117.440 2.779 25259 12384 1 16 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.146 0.112 25259 12385 1 16 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.037 -1.796 25259 12386 1 16 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.427 -1.931 25259 12387 1 16 . 1 1 99 99 LYS H H 99 7.270 7.270 7.488 -0.218 25259 12388 1 16 . 1 1 100 100 LEU N N 100 123.800 123.800 122.071 1.729 25259 12389 1 16 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.299 0.042 25259 12390 1 16 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.415 -2.336 25259 12391 1 16 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.453 -3.322 25259 12392 1 16 . 1 1 100 100 LEU H H 100 7.837 7.837 7.709 0.128 25259 12393 1 16 . 1 1 101 101 ALA N N 101 130.512 130.512 126.167 4.345 25259 12394 1 16 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.364 0.012 25259 12395 1 16 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.971 -2.567 25259 12396 1 16 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.440 -2.644 25259 12397 1 16 . 1 1 101 101 ALA H H 101 8.213 8.213 8.823 -0.610 25259 12398 1 16 . 1 1 102 102 GLY N N 102 110.659 110.659 106.203 4.456 25259 12399 1 16 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.303 -1.410 25259 12400 1 16 . 1 1 102 102 GLY H H 102 8.738 8.738 7.388 1.350 25259 12401 1 16 . 1 1 103 103 PHE N N 103 123.097 123.097 121.926 1.171 25259 12402 1 16 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.122 0.098 25259 12403 1 16 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.842 -3.074 25259 12404 1 16 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.341 -1.767 25259 12405 1 16 . 1 1 103 103 PHE H H 103 7.514 7.514 7.475 0.039 25259 12406 1 16 . 1 1 104 104 LYS N N 104 130.652 130.652 125.221 5.431 25259 12407 1 16 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.449 -0.329 25259 12408 1 16 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.397 -1.418 25259 12409 1 16 . 1 1 104 104 LYS CB C 104 34.237 34.237 37.160 -2.923 25259 12410 1 16 . 1 1 104 104 LYS H H 104 7.473 7.473 8.219 -0.746 25259 12411 1 16 . 1 1 105 105 LEU N N 105 127.372 127.372 121.504 5.868 25259 12412 1 16 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.757 0.239 25259 12413 1 16 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.165 -2.429 25259 12414 1 16 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.304 -1.340 25259 12415 1 16 . 1 1 105 105 LEU H H 105 8.393 8.393 8.119 0.274 25259 12416 1 16 . 1 1 106 106 GLU N N 106 129.358 129.358 125.917 3.441 25259 12417 1 16 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.614 0.230 25259 12418 1 16 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.224 -2.434 25259 12419 1 16 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.050 -1.422 25259 12420 1 16 . 1 1 106 106 GLU H H 106 8.849 8.849 8.727 0.122 25259 12421 1 16 . 1 1 107 107 THR N N 107 131.118 131.118 118.488 12.630 25259 12422 1 16 . 1 1 107 107 THR HA H 107 5.110 5.110 4.512 0.598 25259 12423 1 16 . 1 1 107 107 THR CA C 107 59.832 59.832 61.610 -1.778 25259 12424 1 16 . 1 1 107 107 THR CB C 107 66.671 66.671 69.725 -3.054 25259 12425 1 16 . 1 1 107 107 THR H H 107 9.433 9.433 8.289 1.144 25259 12426 1 16 . 1 1 108 108 LYS N N 108 129.114 129.114 122.835 6.279 25259 12427 1 16 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.552 0.272 25259 12428 1 16 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.041 -2.847 25259 12429 1 16 . 1 1 108 108 LYS CB C 108 34.388 34.388 34.839 -0.451 25259 12430 1 16 . 1 1 108 108 LYS H H 108 9.410 9.410 8.863 0.547 25259 12431 1 16 . 1 1 109 109 LEU N N 109 129.323 129.323 127.233 2.090 25259 12432 1 16 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.274 0.430 25259 12433 1 16 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.590 -2.482 25259 12434 1 16 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.136 -2.481 25259 12435 1 16 . 1 1 109 109 LEU H H 109 8.862 8.862 8.569 0.293 25259 12436 1 16 . 1 1 110 110 LEU N N 110 129.123 129.123 124.794 4.329 25259 12437 1 16 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.660 -0.437 25259 12438 1 16 . 1 1 110 110 LEU CA C 110 53.782 53.782 55.370 -1.588 25259 12439 1 16 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.920 -2.259 25259 12440 1 16 . 1 1 110 110 LEU H H 110 8.373 8.373 8.544 -0.171 25259 12441 1 16 . 1 1 111 111 SER N N 111 114.587 114.587 111.943 2.644 25259 12442 1 16 . 1 1 111 111 SER HA H 111 4.557 4.557 4.541 0.016 25259 12443 1 16 . 1 1 111 111 SER CA C 111 53.889 53.889 58.111 -4.222 25259 12444 1 16 . 1 1 111 111 SER CB C 111 61.830 61.830 65.555 -3.725 25259 12445 1 16 . 1 1 111 111 SER H H 111 8.400 8.400 7.436 0.964 25259 12446 1 16 . 1 1 112 112 ALA N N 112 118.269 118.269 123.435 -5.166 25259 12447 1 16 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.412 -0.103 25259 12448 1 16 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.283 -3.069 25259 12449 1 16 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.596 -2.007 25259 12450 1 16 . 1 1 112 112 ALA H H 112 8.556 8.556 8.624 -0.068 25259 12451 1 16 . 1 1 113 113 THR N N 113 102.878 102.878 109.795 -6.917 25259 12452 1 16 . 1 1 113 113 THR HA H 113 4.662 4.662 4.489 0.173 25259 12453 1 16 . 1 1 113 113 THR CA C 113 58.689 58.689 62.175 -3.486 25259 12454 1 16 . 1 1 113 113 THR CB C 113 67.905 67.905 70.320 -2.415 25259 12455 1 16 . 1 1 113 113 THR H H 113 8.065 8.065 7.220 0.845 25259 12456 1 16 . 1 1 114 114 GLU N N 114 126.514 126.514 121.390 5.124 25259 12457 1 16 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.149 -0.135 25259 12458 1 16 . 1 1 114 114 GLU CA C 114 54.007 54.007 56.031 -2.024 25259 12459 1 16 . 1 1 114 114 GLU CB C 114 32.913 32.913 33.929 -1.016 25259 12460 1 16 . 1 1 114 114 GLU H H 114 7.357 7.357 7.745 -0.388 25259 12461 1 16 . 1 1 115 115 LEU N N 115 128.058 128.058 121.878 6.180 25259 12462 1 16 . 1 1 115 115 LEU HA H 115 4.922 4.922 4.924 -0.002 25259 12463 1 16 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.785 -1.462 25259 12464 1 16 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.587 -1.448 25259 12465 1 16 . 1 1 115 115 LEU H H 115 8.930 8.930 8.549 0.381 25259 12466 1 16 . 1 1 116 116 GLN N N 116 126.540 126.540 118.993 7.547 25259 12467 1 16 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.086 0.629 25259 12468 1 16 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.236 -2.536 25259 12469 1 16 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.455 -1.163 25259 12470 1 16 . 1 1 116 116 GLN H H 116 9.221 9.221 8.998 0.223 25259 12471 1 16 . 1 1 117 117 THR N N 117 125.213 125.213 119.895 5.318 25259 12472 1 16 . 1 1 117 117 THR HA H 117 5.353 5.353 5.092 0.261 25259 12473 1 16 . 1 1 117 117 THR CA C 117 58.926 58.926 60.778 -1.852 25259 12474 1 16 . 1 1 117 117 THR CB C 117 68.948 68.948 72.540 -3.592 25259 12475 1 16 . 1 1 117 117 THR H H 117 9.030 9.030 8.855 0.175 25259 12476 1 16 . 1 1 118 118 THR N N 118 127.799 127.799 116.801 10.998 25259 12477 1 16 . 1 1 118 118 THR HA H 118 5.527 5.527 4.985 0.542 25259 12478 1 16 . 1 1 118 118 THR CA C 118 59.201 59.201 61.643 -2.442 25259 12479 1 16 . 1 1 118 118 THR CB C 118 67.721 67.721 71.990 -4.269 25259 12480 1 16 . 1 1 118 118 THR H H 118 9.459 9.459 8.176 1.283 25259 12481 1 16 . 1 1 119 119 THR N N 119 129.258 129.258 120.500 8.758 25259 12482 1 16 . 1 1 119 119 THR HA H 119 4.885 4.885 4.659 0.226 25259 12483 1 16 . 1 1 119 119 THR CA C 119 58.463 58.463 61.567 -3.104 25259 12484 1 16 . 1 1 119 119 THR CB C 119 67.459 67.459 70.245 -2.786 25259 12485 1 16 . 1 1 119 119 THR H H 119 9.147 9.147 9.033 0.114 25259 12486 1 16 . 1 1 120 120 SER N N 120 123.389 123.389 120.634 2.755 25259 12487 1 16 . 1 1 120 120 SER HA H 120 5.328 5.328 5.024 0.304 25259 12488 1 16 . 1 1 120 120 SER CA C 120 54.386 54.386 56.663 -2.277 25259 12489 1 16 . 1 1 120 120 SER CB C 120 63.031 63.031 64.415 -1.384 25259 12490 1 16 . 1 1 120 120 SER H H 120 8.786 8.786 8.494 0.292 25259 12491 1 16 . 1 1 121 121 PHE N N 121 121.245 121.245 126.947 -5.702 25259 12492 1 16 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.793 0.319 25259 12493 1 16 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.452 -3.260 25259 12494 1 16 . 1 1 121 121 PHE CB C 121 40.265 40.265 41.374 -1.109 25259 12495 1 16 . 1 1 121 121 PHE H H 121 8.831 8.831 9.477 -0.646 25259 12496 1 16 . 1 1 122 122 ASP N N 122 124.765 124.765 126.060 -1.295 25259 12497 1 16 . 1 1 122 122 ASP HA H 122 4.840 4.840 5.068 -0.228 25259 12498 1 16 . 1 1 122 122 ASP CA C 122 49.837 49.837 52.827 -2.990 25259 12499 1 16 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.458 -1.973 25259 12500 1 16 . 1 1 122 122 ASP H H 122 8.819 8.819 8.811 0.008 25259 12501 1 16 . 1 1 123 123 PHE N N 123 124.303 124.303 122.746 1.557 25259 12502 1 16 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.277 0.397 25259 12503 1 16 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.706 -2.908 25259 12504 1 16 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.747 -3.207 25259 12505 1 16 . 1 1 123 123 PHE H H 123 8.262 8.262 8.175 0.087 25259 12506 1 16 . 1 1 124 124 GLN N N 124 120.792 120.792 116.737 4.055 25259 12507 1 16 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.203 0.231 25259 12508 1 16 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.139 -2.056 25259 12509 1 16 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.026 -1.897 25259 12510 1 16 . 1 1 124 124 GLN H H 124 8.954 8.954 8.276 0.678 25259 12511 1 16 . 1 1 125 125 VAL N N 125 114.091 114.091 109.929 4.162 25259 12512 1 16 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.357 0.052 25259 12513 1 16 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.728 -2.430 25259 12514 1 16 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.721 -1.149 25259 12515 1 16 . 1 1 125 125 VAL H H 125 7.026 7.026 7.730 -0.704 25259 12516 1 16 . 1 1 126 126 LEU N N 126 125.158 125.158 124.106 1.052 25259 12517 1 16 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.337 0.138 25259 12518 1 16 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.325 -2.150 25259 12519 1 16 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.756 -0.702 25259 12520 1 16 . 1 1 126 126 LEU H H 126 8.106 8.106 7.792 0.314 25259 12521 1 16 . 1 1 127 127 ASP N N 127 130.026 130.026 129.799 0.227 25259 12522 1 16 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.723 0.118 25259 12523 1 16 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.433 -3.235 25259 12524 1 16 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.672 -1.982 25259 12525 1 16 . 1 1 127 127 ASP H H 127 9.129 9.129 8.856 0.273 25259 12526 1 16 . 1 1 128 128 VAL N N 128 128.833 128.833 123.810 5.023 25259 12527 1 16 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.619 -0.095 25259 12528 1 16 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.464 -2.796 25259 12529 1 16 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.465 -1.970 25259 12530 1 16 . 1 1 128 128 VAL H H 128 8.288 8.288 8.037 0.251 25259 12531 1 16 . 1 1 129 129 LYS N N 129 123.914 123.914 119.721 4.193 25259 12532 1 16 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.977 0.066 25259 12533 1 16 . 1 1 129 129 LYS CA C 129 56.789 56.789 59.097 -2.308 25259 12534 1 16 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.790 -2.853 25259 12535 1 16 . 1 1 129 129 LYS H H 129 8.226 8.226 8.303 -0.077 25259 12536 1 16 . 1 1 130 130 LYS N N 130 121.888 121.888 117.345 4.543 25259 12537 1 16 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.202 -0.117 25259 12538 1 16 . 1 1 130 130 LYS CA C 130 56.146 56.146 58.192 -2.046 25259 12539 1 16 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.987 -2.647 25259 12540 1 16 . 1 1 130 130 LYS H H 130 7.590 7.590 7.804 -0.214 25259 12541 1 16 . 1 1 131 131 ALA N N 131 123.088 123.088 123.837 -0.749 25259 12542 1 16 . 1 1 131 131 ALA HA H 131 3.927 3.927 3.985 -0.058 25259 12543 1 16 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.191 -2.789 25259 12544 1 16 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.550 -2.103 25259 12545 1 16 . 1 1 131 131 ALA H H 131 8.506 8.506 8.457 0.049 25259 12546 1 16 . 1 1 132 132 SER N N 132 110.456 110.456 111.090 -0.634 25259 12547 1 16 . 1 1 132 132 SER HA H 132 4.117 4.117 4.165 -0.048 25259 12548 1 16 . 1 1 132 132 SER CA C 132 58.289 58.289 60.647 -2.358 25259 12549 1 16 . 1 1 132 132 SER CB C 132 61.034 61.034 63.276 -2.242 25259 12550 1 16 . 1 1 132 132 SER H H 132 7.986 7.986 8.218 -0.232 25259 12551 1 16 . 1 1 133 133 GLN N N 133 119.034 119.034 117.371 1.663 25259 12552 1 16 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.678 -0.276 25259 12553 1 16 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.916 -2.391 25259 12554 1 16 . 1 1 133 133 GLN CB C 133 27.234 27.234 28.859 -1.625 25259 12555 1 16 . 1 1 133 133 GLN H H 133 7.233 7.233 7.480 -0.247 25259 12556 1 16 . 1 1 134 134 LEU N N 134 123.291 123.291 121.286 2.005 25259 12557 1 16 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.532 -0.139 25259 12558 1 16 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.318 -2.002 25259 12559 1 16 . 1 1 134 134 LEU CB C 134 38.847 38.847 41.687 -2.840 25259 12560 1 16 . 1 1 134 134 LEU H H 134 7.411 7.411 7.974 -0.563 25259 12561 1 16 . 1 1 135 135 GLU N N 135 128.446 128.446 119.603 8.843 25259 12562 1 16 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.779 0.167 25259 12563 1 16 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.253 -1.869 25259 12564 1 16 . 1 1 135 135 GLU CB C 135 27.296 27.296 28.161 -0.865 25259 12565 1 16 . 1 1 135 135 GLU H H 135 8.986 8.986 8.681 0.305 25259 12566 1 16 . 1 1 136 136 HIS N N 136 117.593 117.593 120.216 -2.623 25259 12567 1 16 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.310 0.073 25259 12568 1 16 . 1 1 136 136 HIS CA C 136 56.685 56.685 59.300 -2.615 25259 12569 1 16 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.865 -1.452 25259 12570 1 16 . 1 1 136 136 HIS H H 136 9.226 9.226 8.335 0.891 25259 12571 1 16 . 1 1 137 137 LEU N N 137 115.463 115.463 115.384 0.079 25259 12572 1 16 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.425 0.082 25259 12573 1 16 . 1 1 137 137 LEU CA C 137 51.948 51.948 55.780 -3.832 25259 12574 1 16 . 1 1 137 137 LEU CB C 137 39.807 39.807 41.028 -1.221 25259 12575 1 16 . 1 1 137 137 LEU H H 137 7.090 7.090 8.427 -1.337 25259 12576 1 16 . 1 1 138 138 LYS N N 138 124.686 124.686 120.189 4.497 25259 12577 1 16 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.251 -0.082 25259 12578 1 16 . 1 1 138 138 LYS CA C 138 57.158 57.158 59.072 -1.914 25259 12579 1 16 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.547 -2.459 25259 12580 1 16 . 1 1 138 138 LYS H H 138 7.698 7.698 8.133 -0.435 25259 12581 1 16 . 1 1 139 139 ASN N N 139 118.077 118.077 113.471 4.606 25259 12582 1 16 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.604 0.069 25259 12583 1 16 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.310 -1.528 25259 12584 1 16 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.385 -2.568 25259 12585 1 16 . 1 1 139 139 ASN H H 139 8.485 8.485 8.223 0.262 25259 12586 1 16 . 1 1 140 140 ILE N N 140 120.880 120.880 120.708 0.172 25259 12587 1 16 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.129 -0.099 25259 12588 1 16 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.540 -1.974 25259 12589 1 16 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.345 -2.571 25259 12590 1 16 . 1 1 140 140 ILE H H 140 7.549 7.549 7.449 0.100 25259 12591 1 16 . 1 1 141 141 GLY N N 141 110.676 110.676 114.788 -4.112 25259 12592 1 16 . 1 1 141 141 GLY CA C 141 44.664 44.664 45.810 -1.146 25259 12593 1 16 . 1 1 141 141 GLY H H 141 7.663 7.663 8.785 -1.122 25259 12594 1 16 . 1 1 142 142 LEU N N 142 123.857 123.857 121.214 2.643 25259 12595 1 16 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.824 -0.131 25259 12596 1 16 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.008 -1.815 25259 12597 1 16 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.944 -1.335 25259 12598 1 16 . 1 1 142 142 LEU H H 142 8.496 8.496 7.531 0.965 25259 12599 1 16 . 1 1 143 143 GLU N N 143 118.407 118.407 118.720 -0.313 25259 12600 1 16 . 1 1 143 143 GLU HA H 143 3.786 3.786 4.032 -0.246 25259 12601 1 16 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.983 -1.761 25259 12602 1 16 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.153 -2.640 25259 12603 1 16 . 1 1 143 143 GLU H H 143 8.672 8.672 8.419 0.253 25259 12604 1 16 . 1 1 144 144 ASN N N 144 118.477 118.477 117.344 1.133 25259 12605 1 16 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.567 -0.125 25259 12606 1 16 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.950 -2.238 25259 12607 1 16 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.359 -2.404 25259 12608 1 16 . 1 1 144 144 ASN H H 144 7.656 7.656 7.718 -0.062 25259 12609 1 16 . 1 1 145 145 LEU N N 145 125.354 125.354 122.664 2.690 25259 12610 1 16 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.478 0.319 25259 12611 1 16 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.882 -1.559 25259 12612 1 16 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.974 -2.401 25259 12613 1 16 . 1 1 145 145 LEU H H 145 7.758 7.758 7.904 -0.146 25259 12614 1 16 . 1 1 146 146 LEU N N 146 116.372 116.372 116.433 -0.061 25259 12615 1 16 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.855 0.021 25259 12616 1 16 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.571 -2.328 25259 12617 1 16 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.798 -1.901 25259 12618 1 16 . 1 1 146 146 LEU H H 146 7.242 7.242 7.448 -0.206 25259 12619 1 16 . 1 1 147 147 LYS N N 147 120.054 120.054 118.084 1.970 25259 12620 1 16 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.475 -0.163 25259 12621 1 16 . 1 1 147 147 LYS CA C 147 54.623 54.623 54.973 -0.350 25259 12622 1 16 . 1 1 147 147 LYS CB C 147 30.260 30.260 31.991 -1.731 25259 12623 1 16 . 1 1 147 147 LYS H H 147 7.185 7.185 7.518 -0.333 25259 12624 1 16 . 1 1 148 148 ASN N N 148 119.498 119.498 116.779 2.719 25259 12625 1 16 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.830 0.132 25259 12626 1 16 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.304 -2.530 25259 12627 1 16 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.247 -0.761 25259 12628 1 16 . 1 1 148 148 ASN H H 148 7.698 7.698 7.465 0.233 25259 12629 1 16 . 1 1 149 149 GLU N N 149 122.834 122.834 118.238 4.596 25259 12630 1 16 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.473 0.128 25259 12631 1 16 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.939 -2.720 25259 12632 1 16 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.555 -2.745 25259 12633 1 16 . 1 1 149 149 GLU H H 149 8.767 8.767 8.649 0.118 25259 12634 1 16 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.827 0.781 25259 12635 1 16 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.128 -0.886 25259 12636 1 16 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.093 -2.998 25259 12637 1 16 . 1 1 151 151 SER N N 151 112.839 112.839 109.575 3.264 25259 12638 1 16 . 1 1 151 151 SER HA H 151 3.835 3.835 4.193 -0.358 25259 12639 1 16 . 1 1 151 151 SER CA C 151 59.270 59.270 59.250 0.020 25259 12640 1 16 . 1 1 151 151 SER CB C 151 59.451 59.451 63.564 -4.113 25259 12641 1 16 . 1 1 151 151 SER H H 151 8.519 8.519 7.896 0.623 25259 12642 1 16 . 1 1 152 152 LYS N N 152 126.710 126.710 123.204 3.506 25259 12643 1 16 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.148 0.100 25259 12644 1 16 . 1 1 152 152 LYS CA C 152 55.765 55.765 58.890 -3.125 25259 12645 1 16 . 1 1 152 152 LYS CB C 152 30.257 30.257 31.920 -1.663 25259 12646 1 16 . 1 1 152 152 LYS H H 152 7.006 7.006 8.278 -1.272 25259 12647 1 16 . 1 1 153 153 TYR N N 153 123.239 123.239 114.874 8.365 25259 12648 1 16 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.661 -0.403 25259 12649 1 16 . 1 1 153 153 TYR CA C 153 59.309 59.309 56.953 2.356 25259 12650 1 16 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.625 -1.291 25259 12651 1 16 . 1 1 153 153 TYR H H 153 8.058 8.058 8.164 -0.106 25259 12652 1 16 . 1 1 154 154 ILE N N 154 120.253 120.253 122.312 -2.059 25259 12653 1 16 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.076 0.297 25259 12654 1 16 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.430 -2.316 25259 12655 1 16 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.323 -1.375 25259 12656 1 16 . 1 1 154 154 ILE H H 154 8.193 8.193 7.259 0.934 25259 12657 1 16 . 1 1 155 155 SER N N 155 117.178 117.178 114.554 2.624 25259 12658 1 16 . 1 1 155 155 SER HA H 155 4.091 4.091 4.015 0.076 25259 12659 1 16 . 1 1 155 155 SER CA C 155 59.961 59.961 61.579 -1.618 25259 12660 1 16 . 1 1 155 155 SER CB C 155 60.148 60.148 62.741 -2.593 25259 12661 1 16 . 1 1 155 155 SER H H 155 8.020 8.020 7.891 0.129 25259 12662 1 16 . 1 1 156 156 ASP N N 156 125.479 125.479 120.455 5.024 25259 12663 1 16 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.531 -0.104 25259 12664 1 16 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.254 -1.494 25259 12665 1 16 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.901 -3.027 25259 12666 1 16 . 1 1 156 156 ASP H H 156 8.638 8.638 7.769 0.869 25259 12667 1 16 . 1 1 157 157 ARG N N 157 121.542 121.542 120.105 1.437 25259 12668 1 16 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.995 0.116 25259 12669 1 16 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.333 -2.405 25259 12670 1 16 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.613 -1.798 25259 12671 1 16 . 1 1 157 157 ARG H H 157 7.888 7.888 7.596 0.292 25259 12672 1 16 . 1 1 158 158 LEU N N 158 124.257 124.257 119.288 4.969 25259 12673 1 16 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.241 0.030 25259 12674 1 16 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.788 -2.575 25259 12675 1 16 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.643 -1.698 25259 12676 1 16 . 1 1 158 158 LEU H H 158 8.442 8.442 7.658 0.784 25259 12677 1 16 . 1 1 159 159 ALA N N 159 124.146 124.146 120.265 3.881 25259 12678 1 16 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.043 0.289 25259 12679 1 16 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.277 -2.845 25259 12680 1 16 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.576 -2.668 25259 12681 1 16 . 1 1 159 159 ALA H H 159 8.086 8.086 7.743 0.343 25259 12682 1 16 . 1 1 160 160 ASN N N 160 118.093 118.093 116.297 1.796 25259 12683 1 16 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.560 0.432 25259 12684 1 16 . 1 1 160 160 ASN CA C 160 50.577 50.577 54.107 -3.530 25259 12685 1 16 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.108 -1.375 25259 12686 1 16 . 1 1 160 160 ASN H H 160 7.445 7.445 7.896 -0.451 25259 12687 1 16 . 1 1 161 161 GLY N N 161 108.365 108.365 105.592 2.773 25259 12688 1 16 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.915 -1.269 25259 12689 1 16 . 1 1 161 161 GLY H H 161 7.743 7.743 7.838 -0.095 25259 12690 1 16 . 1 1 162 162 ALA N N 162 123.928 123.928 122.356 1.572 25259 12691 1 16 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.136 -0.263 25259 12692 1 16 . 1 1 162 162 ALA CA C 162 49.526 49.526 50.818 -1.292 25259 12693 1 16 . 1 1 162 162 ALA CB C 162 18.060 18.060 22.023 -3.963 25259 12694 1 16 . 1 1 162 162 ALA H H 162 8.035 8.035 7.748 0.287 25259 12695 1 16 . 1 1 163 163 THR N N 163 113.286 113.286 110.885 2.401 25259 12696 1 16 . 1 1 163 163 THR HA H 163 4.703 4.703 4.669 0.034 25259 12697 1 16 . 1 1 163 163 THR CA C 163 57.791 57.791 60.146 -2.355 25259 12698 1 16 . 1 1 163 163 THR CB C 163 68.974 68.974 71.371 -2.397 25259 12699 1 16 . 1 1 163 163 THR H H 163 8.451 8.451 8.407 0.044 25259 12700 1 16 . 1 1 164 164 GLU N N 164 125.905 125.905 119.625 6.280 25259 12701 1 16 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.894 0.166 25259 12702 1 16 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.382 -1.797 25259 12703 1 16 . 1 1 164 164 GLU CB C 164 29.211 29.211 31.265 -2.054 25259 12704 1 16 . 1 1 164 164 GLU H H 164 8.716 8.716 8.486 0.230 25259 12705 1 17 . 1 1 2 2 PRO HA H 2 4.675 4.675 4.622 0.053 25259 12706 1 17 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.954 -2.146 25259 12707 1 17 . 1 1 2 2 PRO CB C 2 30.070 30.070 32.680 -2.610 25259 12708 1 17 . 1 1 3 3 ALA N N 3 126.741 126.741 124.958 1.783 25259 12709 1 17 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.641 -0.147 25259 12710 1 17 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.828 -1.626 25259 12711 1 17 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.566 -3.748 25259 12712 1 17 . 1 1 3 3 ALA H H 3 8.440 8.440 8.400 0.040 25259 12713 1 17 . 1 1 4 4 THR N N 4 116.015 116.015 114.319 1.696 25259 12714 1 17 . 1 1 4 4 THR HA H 4 4.393 4.393 4.628 -0.235 25259 12715 1 17 . 1 1 4 4 THR CA C 4 59.148 59.148 61.938 -2.790 25259 12716 1 17 . 1 1 4 4 THR CB C 4 67.580 67.580 70.028 -2.448 25259 12717 1 17 . 1 1 4 4 THR H H 4 8.050 8.050 8.427 -0.377 25259 12718 1 17 . 1 1 5 5 LYS N N 5 126.350 126.350 122.193 4.157 25259 12719 1 17 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.684 -0.179 25259 12720 1 17 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.758 -1.841 25259 12721 1 17 . 1 1 5 5 LYS CB C 5 30.684 30.684 33.806 -3.122 25259 12722 1 17 . 1 1 5 5 LYS H H 5 8.332 8.332 8.304 0.028 25259 12723 1 17 . 1 1 6 6 THR N N 6 118.124 118.124 113.821 4.303 25259 12724 1 17 . 1 1 6 6 THR HA H 6 4.440 4.440 4.489 -0.049 25259 12725 1 17 . 1 1 6 6 THR CA C 6 59.282 59.282 61.672 -2.390 25259 12726 1 17 . 1 1 6 6 THR CB C 6 67.685 67.685 69.841 -2.156 25259 12727 1 17 . 1 1 6 6 THR H H 6 8.283 8.283 8.586 -0.303 25259 12728 1 17 . 1 1 7 7 GLU N N 7 125.934 125.934 125.087 0.847 25259 12729 1 17 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.826 -0.482 25259 12730 1 17 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.512 -1.331 25259 12731 1 17 . 1 1 7 7 GLU CB C 7 27.816 27.816 32.894 -5.078 25259 12732 1 17 . 1 1 7 7 GLU H H 7 8.487 8.487 8.814 -0.327 25259 12733 1 17 . 1 1 8 8 LYS N N 8 123.945 123.945 121.665 2.280 25259 12734 1 17 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.508 -1.573 25259 12735 1 17 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.834 -4.269 25259 12736 1 17 . 1 1 8 8 LYS H H 8 8.278 8.278 8.825 -0.547 25259 12737 1 17 . 1 1 9 9 ASP N N 9 123.624 123.624 120.640 2.984 25259 12738 1 17 . 1 1 9 9 ASP HA H 9 4.339 4.339 5.035 -0.696 25259 12739 1 17 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.985 -1.862 25259 12740 1 17 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.476 -3.543 25259 12741 1 17 . 1 1 9 9 ASP H H 9 8.277 8.277 8.559 -0.282 25259 12742 1 17 . 1 1 10 10 THR N N 10 116.812 116.812 113.631 3.181 25259 12743 1 17 . 1 1 10 10 THR HA H 10 4.349 4.349 4.624 -0.275 25259 12744 1 17 . 1 1 10 10 THR CA C 10 59.634 59.634 62.013 -2.379 25259 12745 1 17 . 1 1 10 10 THR CB C 10 67.254 67.254 70.644 -3.390 25259 12746 1 17 . 1 1 10 10 THR H H 10 8.049 8.049 8.392 -0.343 25259 12747 1 17 . 1 1 11 11 LEU N N 11 126.610 126.610 124.042 2.568 25259 12748 1 17 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.826 -0.434 25259 12749 1 17 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.667 -1.589 25259 12750 1 17 . 1 1 11 11 LEU CB C 11 39.633 39.633 44.566 -4.933 25259 12751 1 17 . 1 1 11 11 LEU H H 11 8.191 8.191 8.352 -0.161 25259 12752 1 17 . 1 1 12 12 GLN N N 12 123.274 123.274 122.550 0.724 25259 12753 1 17 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.955 -0.573 25259 12754 1 17 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.968 -1.394 25259 12755 1 17 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.994 -5.191 25259 12756 1 17 . 1 1 12 12 GLN H H 12 8.280 8.280 8.757 -0.477 25259 12757 1 17 . 1 1 13 13 SER N N 13 119.027 119.027 114.761 4.266 25259 12758 1 17 . 1 1 13 13 SER HA H 13 4.471 4.471 5.331 -0.860 25259 12759 1 17 . 1 1 13 13 SER CA C 13 55.869 55.869 57.735 -1.866 25259 12760 1 17 . 1 1 13 13 SER CB C 13 61.424 61.424 64.761 -3.337 25259 12761 1 17 . 1 1 13 13 SER H H 13 8.178 8.178 8.989 -0.811 25259 12762 1 17 . 1 1 14 14 ALA N N 14 128.314 128.314 123.262 5.052 25259 12763 1 17 . 1 1 14 14 ALA HA H 14 4.434 4.434 5.057 -0.623 25259 12764 1 17 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.667 -1.971 25259 12765 1 17 . 1 1 14 14 ALA CB C 14 17.081 17.081 20.230 -3.149 25259 12766 1 17 . 1 1 14 14 ALA H H 14 8.195 8.195 8.470 -0.275 25259 12767 1 17 . 1 1 15 15 LEU N N 15 125.175 125.175 121.433 3.742 25259 12768 1 17 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.769 -0.129 25259 12769 1 17 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.289 -2.685 25259 12770 1 17 . 1 1 15 15 LEU CB C 15 39.467 39.467 42.373 -2.906 25259 12771 1 17 . 1 1 15 15 LEU H H 15 8.050 8.050 8.352 -0.302 25259 12772 1 17 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.685 -0.181 25259 12773 1 17 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.890 -2.259 25259 12774 1 17 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.704 -3.046 25259 12775 1 17 . 1 1 17 17 VAL N N 17 123.223 123.223 120.170 3.053 25259 12776 1 17 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.480 -0.346 25259 12777 1 17 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.769 -1.942 25259 12778 1 17 . 1 1 17 17 VAL CB C 17 30.377 30.377 34.154 -3.777 25259 12779 1 17 . 1 1 17 17 VAL H H 17 8.134 8.134 8.486 -0.352 25259 12780 1 17 . 1 1 18 18 ILE N N 18 127.777 127.777 125.774 2.003 25259 12781 1 17 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.670 -0.427 25259 12782 1 17 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.786 -2.464 25259 12783 1 17 . 1 1 18 18 ILE CB C 18 36.254 36.254 41.447 -5.193 25259 12784 1 17 . 1 1 18 18 ILE H H 18 8.187 8.187 8.361 -0.174 25259 12785 1 17 . 1 1 19 19 GLU N N 19 128.148 128.148 124.703 3.445 25259 12786 1 17 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.630 -0.293 25259 12787 1 17 . 1 1 19 19 GLU CA C 19 54.091 54.091 56.159 -2.068 25259 12788 1 17 . 1 1 19 19 GLU CB C 19 28.176 28.176 30.452 -2.276 25259 12789 1 17 . 1 1 19 19 GLU H H 19 8.475 8.475 8.624 -0.149 25259 12790 1 17 . 1 1 20 20 ASN N N 20 122.788 122.788 122.252 0.536 25259 12791 1 17 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.955 -0.260 25259 12792 1 17 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.955 -2.133 25259 12793 1 17 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.585 -4.219 25259 12794 1 17 . 1 1 20 20 ASN H H 20 8.477 8.477 8.539 -0.062 25259 12795 1 17 . 1 1 21 21 ALA N N 21 127.253 127.253 123.249 4.004 25259 12796 1 17 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.598 -0.277 25259 12797 1 17 . 1 1 21 21 ALA CA C 21 50.688 50.688 52.106 -1.419 25259 12798 1 17 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.138 -3.225 25259 12799 1 17 . 1 1 21 21 ALA H H 21 8.325 8.325 8.337 -0.012 25259 12800 1 17 . 1 1 22 22 GLU N N 22 122.044 122.044 123.076 -1.032 25259 12801 1 17 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.385 -0.092 25259 12802 1 17 . 1 1 22 22 GLU CA C 22 54.583 54.583 55.808 -1.225 25259 12803 1 17 . 1 1 22 22 GLU CB C 22 27.285 27.285 28.986 -1.701 25259 12804 1 17 . 1 1 22 22 GLU H H 22 8.415 8.415 8.392 0.023 25259 12805 1 17 . 1 1 23 23 LYS N N 23 123.622 123.622 124.254 -0.632 25259 12806 1 17 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.382 -0.057 25259 12807 1 17 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.383 -1.887 25259 12808 1 17 . 1 1 23 23 LYS CB C 23 30.653 30.653 31.158 -0.505 25259 12809 1 17 . 1 1 23 23 LYS H H 23 8.127 8.127 8.409 -0.282 25259 12810 1 17 . 1 1 24 24 ASN N N 24 120.652 120.652 123.723 -3.071 25259 12811 1 17 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.815 0.026 25259 12812 1 17 . 1 1 24 24 ASN CA C 24 50.663 50.663 54.038 -3.375 25259 12813 1 17 . 1 1 24 24 ASN CB C 24 36.775 36.775 40.406 -3.631 25259 12814 1 17 . 1 1 24 24 ASN H H 24 8.424 8.424 8.451 -0.027 25259 12815 1 17 . 1 1 25 25 THR N N 25 117.102 117.102 117.911 -0.809 25259 12816 1 17 . 1 1 25 25 THR HA H 25 4.367 4.367 4.413 -0.046 25259 12817 1 17 . 1 1 25 25 THR CA C 25 59.500 59.500 61.787 -2.287 25259 12818 1 17 . 1 1 25 25 THR CB C 25 67.610 67.610 70.036 -2.426 25259 12819 1 17 . 1 1 25 25 THR H H 25 7.852 7.852 8.554 -0.702 25259 12820 1 17 . 1 1 26 26 VAL N N 26 126.491 126.491 123.530 2.961 25259 12821 1 17 . 1 1 26 26 VAL HA H 26 4.167 4.167 3.904 0.263 25259 12822 1 17 . 1 1 26 26 VAL CA C 26 60.193 60.193 62.801 -2.608 25259 12823 1 17 . 1 1 26 26 VAL CB C 26 29.605 29.605 31.247 -1.642 25259 12824 1 17 . 1 1 26 26 VAL H H 26 8.080 8.080 8.328 -0.248 25259 12825 1 17 . 1 1 27 27 VAL N N 27 132.992 132.992 129.896 3.096 25259 12826 1 17 . 1 1 27 27 VAL HA H 27 4.081 4.081 3.969 0.112 25259 12827 1 17 . 1 1 27 27 VAL CA C 27 58.984 58.984 61.770 -2.785 25259 12828 1 17 . 1 1 27 27 VAL CB C 27 31.540 31.540 32.134 -0.594 25259 12829 1 17 . 1 1 27 27 VAL H H 27 8.830 8.830 8.938 -0.108 25259 12830 1 17 . 1 1 28 28 THR N N 28 123.576 123.576 122.710 0.866 25259 12831 1 17 . 1 1 28 28 THR HA H 28 5.553 5.553 5.115 0.438 25259 12832 1 17 . 1 1 28 28 THR CA C 28 58.738 58.738 60.807 -2.069 25259 12833 1 17 . 1 1 28 28 THR CB C 28 68.443 68.443 70.918 -2.475 25259 12834 1 17 . 1 1 28 28 THR H H 28 8.165 8.165 8.366 -0.201 25259 12835 1 17 . 1 1 29 29 LYS N N 29 129.099 129.099 125.136 3.963 25259 12836 1 17 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.622 0.320 25259 12837 1 17 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.228 -3.450 25259 12838 1 17 . 1 1 29 29 LYS CB C 29 35.096 35.096 36.434 -1.338 25259 12839 1 17 . 1 1 29 29 LYS H H 29 9.273 9.273 9.218 0.055 25259 12840 1 17 . 1 1 30 30 THR N N 30 123.510 123.510 119.280 4.230 25259 12841 1 17 . 1 1 30 30 THR HA H 30 5.428 5.428 5.108 0.320 25259 12842 1 17 . 1 1 30 30 THR CA C 30 59.784 59.784 61.798 -2.014 25259 12843 1 17 . 1 1 30 30 THR CB C 30 67.818 67.818 72.041 -4.223 25259 12844 1 17 . 1 1 30 30 THR H H 30 8.993 8.993 8.339 0.654 25259 12845 1 17 . 1 1 31 31 LEU N N 31 128.293 128.293 122.616 5.677 25259 12846 1 17 . 1 1 31 31 LEU HA H 31 5.220 5.220 5.109 0.111 25259 12847 1 17 . 1 1 31 31 LEU CA C 31 50.055 50.055 52.456 -2.401 25259 12848 1 17 . 1 1 31 31 LEU CB C 31 43.399 43.399 44.526 -1.127 25259 12849 1 17 . 1 1 31 31 LEU H H 31 9.557 9.557 9.063 0.494 25259 12850 1 17 . 1 1 32 32 VAL N N 32 126.919 126.919 119.465 7.454 25259 12851 1 17 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.270 0.181 25259 12852 1 17 . 1 1 32 32 VAL CA C 32 59.664 59.664 60.870 -1.206 25259 12853 1 17 . 1 1 32 32 VAL CB C 32 29.449 29.449 32.714 -3.264 25259 12854 1 17 . 1 1 32 32 VAL H H 32 9.364 9.364 8.540 0.824 25259 12855 1 17 . 1 1 33 33 LEU N N 33 133.503 133.503 129.179 4.324 25259 12856 1 17 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.406 0.150 25259 12857 1 17 . 1 1 33 33 LEU CA C 33 52.004 52.004 53.498 -1.494 25259 12858 1 17 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.704 -3.857 25259 12859 1 17 . 1 1 33 33 LEU H H 33 8.587 8.587 8.585 0.002 25259 12860 1 17 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.513 -0.032 25259 12861 1 17 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.226 -1.781 25259 12862 1 17 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.462 -2.897 25259 12863 1 17 . 1 1 35 35 LYS N N 35 127.420 127.420 118.237 9.183 25259 12864 1 17 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.323 0.043 25259 12865 1 17 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.154 -2.035 25259 12866 1 17 . 1 1 35 35 LYS CB C 35 30.594 30.594 33.111 -2.517 25259 12867 1 17 . 1 1 35 35 LYS H H 35 8.666 8.666 8.233 0.433 25259 12868 1 17 . 1 1 36 36 SER N N 36 122.222 122.222 116.485 5.737 25259 12869 1 17 . 1 1 36 36 SER HA H 36 4.753 4.753 4.680 0.073 25259 12870 1 17 . 1 1 36 36 SER CA C 36 55.328 55.328 57.061 -1.733 25259 12871 1 17 . 1 1 36 36 SER CB C 36 61.728 61.728 62.399 -0.671 25259 12872 1 17 . 1 1 36 36 SER H H 36 8.771 8.771 8.254 0.517 25259 12873 1 17 . 1 1 37 37 ASP N N 37 126.346 126.346 126.200 0.146 25259 12874 1 17 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.281 0.173 25259 12875 1 17 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.348 -1.732 25259 12876 1 17 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.595 -2.610 25259 12877 1 17 . 1 1 37 37 ASP H H 37 8.859 8.859 8.693 0.166 25259 12878 1 17 . 1 1 38 38 ASP N N 38 119.171 119.171 119.417 -0.246 25259 12879 1 17 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.683 -0.068 25259 12880 1 17 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.398 -3.611 25259 12881 1 17 . 1 1 38 38 ASP CB C 38 37.635 37.635 42.414 -4.779 25259 12882 1 17 . 1 1 38 38 ASP H H 38 7.944 7.944 8.425 -0.481 25259 12883 1 17 . 1 1 39 39 GLY N N 39 110.352 110.352 113.609 -3.257 25259 12884 1 17 . 1 1 39 39 GLY CA C 39 42.761 42.761 44.919 -2.158 25259 12885 1 17 . 1 1 39 39 GLY H H 39 8.145 8.145 8.400 -0.255 25259 12886 1 17 . 1 1 40 40 SER N N 40 120.090 120.090 119.548 0.542 25259 12887 1 17 . 1 1 40 40 SER HA H 40 4.877 4.877 4.694 0.183 25259 12888 1 17 . 1 1 40 40 SER CA C 40 56.525 56.525 58.605 -2.080 25259 12889 1 17 . 1 1 40 40 SER CB C 40 62.245 62.245 63.898 -1.653 25259 12890 1 17 . 1 1 40 40 SER H H 40 8.344 8.344 7.936 0.408 25259 12891 1 17 . 1 1 41 41 GLN N N 41 122.551 122.551 124.792 -2.241 25259 12892 1 17 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.624 0.303 25259 12893 1 17 . 1 1 41 41 GLN CA C 41 53.414 53.414 55.561 -2.147 25259 12894 1 17 . 1 1 41 41 GLN CB C 41 30.314 30.314 31.496 -1.182 25259 12895 1 17 . 1 1 41 41 GLN H H 41 8.627 8.627 8.622 0.005 25259 12896 1 17 . 1 1 42 42 GLN N N 42 131.724 131.724 125.904 5.820 25259 12897 1 17 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.686 0.925 25259 12898 1 17 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.560 -2.488 25259 12899 1 17 . 1 1 42 42 GLN CB C 42 30.319 30.319 30.013 0.306 25259 12900 1 17 . 1 1 42 42 GLN H H 42 9.189 9.189 8.609 0.580 25259 12901 1 17 . 1 1 43 43 THR N N 43 122.202 122.202 114.705 7.497 25259 12902 1 17 . 1 1 43 43 THR HA H 43 5.380 5.380 4.759 0.621 25259 12903 1 17 . 1 1 43 43 THR CA C 43 58.863 58.863 61.512 -2.649 25259 12904 1 17 . 1 1 43 43 THR CB C 43 68.893 68.893 72.163 -3.270 25259 12905 1 17 . 1 1 43 43 THR H H 43 9.139 9.139 8.652 0.487 25259 12906 1 17 . 1 1 44 44 GLN N N 44 127.190 127.190 122.608 4.582 25259 12907 1 17 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.204 0.430 25259 12908 1 17 . 1 1 44 44 GLN CA C 44 51.668 51.668 55.180 -3.512 25259 12909 1 17 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.882 -3.972 25259 12910 1 17 . 1 1 44 44 GLN H H 44 9.760 9.760 8.922 0.838 25259 12911 1 17 . 1 1 45 45 THR N N 45 123.479 123.479 119.172 4.307 25259 12912 1 17 . 1 1 45 45 THR HA H 45 5.421 5.421 5.354 0.067 25259 12913 1 17 . 1 1 45 45 THR CA C 45 60.071 60.071 60.733 -0.662 25259 12914 1 17 . 1 1 45 45 THR CB C 45 67.541 67.541 70.720 -3.179 25259 12915 1 17 . 1 1 45 45 THR H H 45 9.518 9.518 9.333 0.185 25259 12916 1 17 . 1 1 46 46 ILE N N 46 133.908 133.908 125.545 8.363 25259 12917 1 17 . 1 1 46 46 ILE HA H 46 5.003 5.003 5.067 -0.064 25259 12918 1 17 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.460 -1.989 25259 12919 1 17 . 1 1 46 46 ILE CB C 46 39.945 39.945 41.780 -1.835 25259 12920 1 17 . 1 1 46 46 ILE H H 46 9.830 9.830 9.344 0.486 25259 12921 1 17 . 1 1 47 47 THR N N 47 124.701 124.701 123.013 1.688 25259 12922 1 17 . 1 1 47 47 THR HA H 47 6.048 6.048 5.486 0.562 25259 12923 1 17 . 1 1 47 47 THR CA C 47 58.551 58.551 61.159 -2.608 25259 12924 1 17 . 1 1 47 47 THR CB C 47 67.819 67.819 70.273 -2.454 25259 12925 1 17 . 1 1 47 47 THR H H 47 8.843 8.843 8.733 0.110 25259 12926 1 17 . 1 1 48 48 TYR N N 48 127.369 127.369 120.476 6.893 25259 12927 1 17 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.063 0.215 25259 12928 1 17 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.562 -2.833 25259 12929 1 17 . 1 1 48 48 TYR CB C 48 39.432 39.432 40.913 -1.481 25259 12930 1 17 . 1 1 48 48 TYR H H 48 9.638 9.638 8.870 0.768 25259 12931 1 17 . 1 1 49 49 LYS N N 49 122.138 122.138 117.259 4.879 25259 12932 1 17 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.575 0.081 25259 12933 1 17 . 1 1 49 49 LYS CA C 49 52.972 52.972 55.978 -3.006 25259 12934 1 17 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.941 -1.338 25259 12935 1 17 . 1 1 49 49 LYS H H 49 8.560 8.560 8.804 -0.244 25259 12936 1 17 . 1 1 50 50 ASP N N 50 130.208 130.208 121.379 8.829 25259 12937 1 17 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.797 -0.493 25259 12938 1 17 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.419 -0.659 25259 12939 1 17 . 1 1 50 50 ASP CB C 50 37.339 37.339 43.561 -6.222 25259 12940 1 17 . 1 1 50 50 ASP H H 50 9.597 9.597 8.688 0.909 25259 12941 1 17 . 1 1 51 51 LYS N N 51 124.586 124.586 117.702 6.884 25259 12942 1 17 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.458 0.073 25259 12943 1 17 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.302 -2.568 25259 12944 1 17 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.723 -4.328 25259 12945 1 17 . 1 1 51 51 LYS H H 51 8.450 8.450 8.202 0.248 25259 12946 1 17 . 1 1 52 52 THR N N 52 120.044 120.044 114.747 5.297 25259 12947 1 17 . 1 1 52 52 THR HA H 52 4.717 4.717 4.570 0.147 25259 12948 1 17 . 1 1 52 52 THR CA C 52 59.313 59.313 60.981 -1.668 25259 12949 1 17 . 1 1 52 52 THR CB C 52 68.815 68.815 71.142 -2.327 25259 12950 1 17 . 1 1 52 52 THR H H 52 8.658 8.658 7.771 0.887 25259 12951 1 17 . 1 1 53 53 PHE N N 53 128.987 128.987 124.507 4.480 25259 12952 1 17 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.418 -0.135 25259 12953 1 17 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.294 -1.305 25259 12954 1 17 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.718 0.593 25259 12955 1 17 . 1 1 53 53 PHE H H 53 9.218 9.218 8.775 0.443 25259 12956 1 17 . 1 1 54 54 LEU N N 54 124.874 124.874 125.210 -0.336 25259 12957 1 17 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.522 0.407 25259 12958 1 17 . 1 1 54 54 LEU CA C 54 54.241 54.241 55.961 -1.720 25259 12959 1 17 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.418 -1.901 25259 12960 1 17 . 1 1 54 54 LEU H H 54 9.391 9.391 8.632 0.759 25259 12961 1 17 . 1 1 55 55 SER N N 55 115.516 115.516 111.148 4.368 25259 12962 1 17 . 1 1 55 55 SER HA H 55 5.194 5.194 5.309 -0.115 25259 12963 1 17 . 1 1 55 55 SER CA C 55 55.818 55.818 57.706 -1.888 25259 12964 1 17 . 1 1 55 55 SER CB C 55 63.474 63.474 66.271 -2.797 25259 12965 1 17 . 1 1 55 55 SER H H 55 8.736 8.736 7.869 0.867 25259 12966 1 17 . 1 1 56 56 LEU N N 56 124.352 124.352 123.213 1.139 25259 12967 1 17 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.355 0.188 25259 12968 1 17 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.539 -2.902 25259 12969 1 17 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.110 -0.597 25259 12970 1 17 . 1 1 56 56 LEU H H 56 8.328 8.328 8.487 -0.159 25259 12971 1 17 . 1 1 57 57 ALA N N 57 131.450 131.450 130.626 0.824 25259 12972 1 17 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.344 0.161 25259 12973 1 17 . 1 1 57 57 ALA CA C 57 48.202 48.202 49.687 -1.485 25259 12974 1 17 . 1 1 57 57 ALA CB C 57 18.964 18.964 20.985 -2.021 25259 12975 1 17 . 1 1 57 57 ALA H H 57 9.208 9.208 9.255 -0.047 25259 12976 1 17 . 1 1 58 58 ILE N N 58 126.248 126.248 126.032 0.216 25259 12977 1 17 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.804 -0.020 25259 12978 1 17 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.453 -2.206 25259 12979 1 17 . 1 1 58 58 ILE CB C 58 38.045 38.045 39.060 -1.015 25259 12980 1 17 . 1 1 58 58 ILE H H 58 9.597 9.597 8.596 1.001 25259 12981 1 17 . 1 1 59 59 GLN N N 59 132.065 132.065 126.492 5.573 25259 12982 1 17 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.946 0.301 25259 12983 1 17 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.322 -3.158 25259 12984 1 17 . 1 1 59 59 GLN CB C 59 29.661 29.661 32.076 -2.415 25259 12985 1 17 . 1 1 59 59 GLN H H 59 9.389 9.389 8.590 0.799 25259 12986 1 17 . 1 1 60 60 GLN N N 60 130.314 130.314 120.483 9.831 25259 12987 1 17 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.720 0.489 25259 12988 1 17 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.610 -2.589 25259 12989 1 17 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.120 -3.644 25259 12990 1 17 . 1 1 60 60 GLN H H 60 9.471 9.471 9.197 0.274 25259 12991 1 17 . 1 1 61 61 LYS N N 61 131.044 131.044 125.666 5.378 25259 12992 1 17 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.167 0.248 25259 12993 1 17 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.069 -2.950 25259 12994 1 17 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.353 -2.936 25259 12995 1 17 . 1 1 61 61 LYS H H 61 8.893 8.893 8.224 0.669 25259 12996 1 17 . 1 1 62 62 ARG N N 62 125.397 125.397 123.273 2.124 25259 12997 1 17 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.028 -0.025 25259 12998 1 17 . 1 1 62 62 ARG CA C 62 51.091 51.091 52.775 -1.684 25259 12999 1 17 . 1 1 62 62 ARG CB C 62 29.878 29.878 32.986 -3.108 25259 13000 1 17 . 1 1 62 62 ARG H H 62 9.120 9.120 8.682 0.438 25259 13001 1 17 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.777 0.198 25259 13002 1 17 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.618 -3.121 25259 13003 1 17 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.207 -2.323 25259 13004 1 17 . 1 1 64 64 VAL N N 64 121.305 121.305 117.754 3.551 25259 13005 1 17 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.147 -0.123 25259 13006 1 17 . 1 1 64 64 VAL CA C 64 59.677 59.677 62.105 -2.428 25259 13007 1 17 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.233 -1.868 25259 13008 1 17 . 1 1 64 64 VAL H H 64 7.520 7.520 8.155 -0.635 25259 13009 1 17 . 1 1 65 65 SER N N 65 123.215 123.215 115.649 7.566 25259 13010 1 17 . 1 1 65 65 SER HA H 65 4.521 4.521 4.761 -0.240 25259 13011 1 17 . 1 1 65 65 SER CA C 65 54.897 54.897 57.229 -2.332 25259 13012 1 17 . 1 1 65 65 SER CB C 65 62.564 62.564 66.077 -3.513 25259 13013 1 17 . 1 1 65 65 SER H H 65 8.080 8.080 8.080 -0.000 25259 13014 1 17 . 1 1 66 66 ASP N N 66 123.802 123.802 122.633 1.169 25259 13015 1 17 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.448 -0.019 25259 13016 1 17 . 1 1 66 66 ASP CA C 66 55.378 55.378 57.678 -2.300 25259 13017 1 17 . 1 1 66 66 ASP CB C 66 38.038 38.038 41.011 -2.974 25259 13018 1 17 . 1 1 66 66 ASP H H 66 8.900 8.900 8.743 0.157 25259 13019 1 17 . 1 1 67 67 GLU N N 67 121.943 121.943 118.636 3.307 25259 13020 1 17 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.066 0.123 25259 13021 1 17 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.111 -1.671 25259 13022 1 17 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.549 -2.764 25259 13023 1 17 . 1 1 67 67 GLU H H 67 8.717 8.717 8.660 0.057 25259 13024 1 17 . 1 1 68 68 LEU N N 68 125.458 125.458 119.801 5.657 25259 13025 1 17 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.353 -0.010 25259 13026 1 17 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.017 -1.545 25259 13027 1 17 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.319 -1.915 25259 13028 1 17 . 1 1 68 68 LEU H H 68 7.820 7.820 7.717 0.103 25259 13029 1 17 . 1 1 69 69 LYS N N 69 123.868 123.868 121.455 2.413 25259 13030 1 17 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.015 -0.009 25259 13031 1 17 . 1 1 69 69 LYS CA C 69 57.617 57.617 60.100 -2.483 25259 13032 1 17 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.993 -1.956 25259 13033 1 17 . 1 1 69 69 LYS H H 69 8.690 8.690 8.658 0.032 25259 13034 1 17 . 1 1 70 70 THR N N 70 117.109 117.109 116.183 0.926 25259 13035 1 17 . 1 1 70 70 THR HA H 70 4.088 4.088 3.998 0.090 25259 13036 1 17 . 1 1 70 70 THR CA C 70 63.879 63.879 66.472 -2.594 25259 13037 1 17 . 1 1 70 70 THR CB C 70 66.383 66.383 68.911 -2.528 25259 13038 1 17 . 1 1 70 70 THR H H 70 7.935 7.935 7.579 0.356 25259 13039 1 17 . 1 1 71 71 TYR N N 71 127.006 127.006 123.176 3.830 25259 13040 1 17 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.204 0.001 25259 13041 1 17 . 1 1 71 71 TYR CA C 71 60.225 60.225 62.034 -1.809 25259 13042 1 17 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.415 -1.870 25259 13043 1 17 . 1 1 71 71 TYR H H 71 7.683 7.683 7.426 0.257 25259 13044 1 17 . 1 1 72 72 ILE N N 72 125.064 125.064 120.739 4.325 25259 13045 1 17 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.675 0.004 25259 13046 1 17 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.475 -2.580 25259 13047 1 17 . 1 1 72 72 ILE CB C 72 36.276 36.276 38.077 -1.800 25259 13048 1 17 . 1 1 72 72 ILE H H 72 9.083 9.083 8.822 0.261 25259 13049 1 17 . 1 1 73 73 ASP N N 73 124.900 124.900 119.141 5.759 25259 13050 1 17 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.413 -0.024 25259 13051 1 17 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.829 -1.791 25259 13052 1 17 . 1 1 73 73 ASP CB C 73 38.107 38.107 41.029 -2.922 25259 13053 1 17 . 1 1 73 73 ASP H H 73 8.751 8.751 8.072 0.679 25259 13054 1 17 . 1 1 74 74 GLN N N 74 117.025 117.025 116.974 0.051 25259 13055 1 17 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.144 -0.006 25259 13056 1 17 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.171 -3.361 25259 13057 1 17 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.744 -2.180 25259 13058 1 17 . 1 1 74 74 GLN H H 74 7.447 7.447 7.673 -0.226 25259 13059 1 17 . 1 1 75 75 HIS N N 75 116.494 116.494 115.697 0.797 25259 13060 1 17 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.666 0.050 25259 13061 1 17 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.566 -2.500 25259 13062 1 17 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.266 -3.964 25259 13063 1 17 . 1 1 75 75 HIS H H 75 8.402 8.402 8.187 0.215 25259 13064 1 17 . 1 1 76 76 GLY N N 76 112.564 112.564 104.982 7.582 25259 13065 1 17 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.627 -2.731 25259 13066 1 17 . 1 1 76 76 GLY H H 76 9.091 9.091 7.798 1.293 25259 13067 1 17 . 1 1 77 77 VAL N N 77 124.763 124.763 121.722 3.041 25259 13068 1 17 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.605 -0.040 25259 13069 1 17 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.655 -0.704 25259 13070 1 17 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.075 -2.237 25259 13071 1 17 . 1 1 77 77 VAL H H 77 8.927 8.927 8.692 0.235 25259 13072 1 17 . 1 1 78 78 GLU N N 78 124.388 124.388 118.113 6.275 25259 13073 1 17 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.030 0.118 25259 13074 1 17 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.788 -1.472 25259 13075 1 17 . 1 1 78 78 GLU CB C 78 26.459 26.459 29.216 -2.757 25259 13076 1 17 . 1 1 78 78 GLU H H 78 8.781 8.781 8.847 -0.066 25259 13077 1 17 . 1 1 79 79 GLU N N 79 121.887 121.887 117.733 4.154 25259 13078 1 17 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.343 -0.155 25259 13079 1 17 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.756 -2.211 25259 13080 1 17 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.988 -2.955 25259 13081 1 17 . 1 1 79 79 GLU H H 79 9.231 9.231 7.770 1.461 25259 13082 1 17 . 1 1 80 80 THR N N 80 120.781 120.781 117.208 3.573 25259 13083 1 17 . 1 1 80 80 THR HA H 80 4.059 4.059 3.991 0.068 25259 13084 1 17 . 1 1 80 80 THR CA C 80 65.487 65.487 66.304 -0.817 25259 13085 1 17 . 1 1 80 80 THR CB C 80 64.369 64.369 68.542 -4.173 25259 13086 1 17 . 1 1 80 80 THR H H 80 7.858 7.858 8.453 -0.595 25259 13087 1 17 . 1 1 81 81 GLN N N 81 125.303 125.303 121.353 3.950 25259 13088 1 17 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.939 0.105 25259 13089 1 17 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.349 -2.380 25259 13090 1 17 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.334 -2.257 25259 13091 1 17 . 1 1 81 81 GLN H H 81 8.765 8.765 8.350 0.415 25259 13092 1 17 . 1 1 82 82 LYS N N 82 120.458 120.458 118.744 1.714 25259 13093 1 17 . 1 1 82 82 LYS HA H 82 4.089 4.089 4.005 0.084 25259 13094 1 17 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.639 -1.327 25259 13095 1 17 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.948 -1.794 25259 13096 1 17 . 1 1 82 82 LYS H H 82 7.521 7.521 7.908 -0.387 25259 13097 1 17 . 1 1 83 83 ALA N N 83 125.234 125.234 120.998 4.236 25259 13098 1 17 . 1 1 83 83 ALA HA H 83 4.217 4.217 4.029 0.188 25259 13099 1 17 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.474 -2.032 25259 13100 1 17 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.835 -2.549 25259 13101 1 17 . 1 1 83 83 ALA H H 83 7.782 7.782 7.601 0.181 25259 13102 1 17 . 1 1 84 84 LEU N N 84 123.348 123.348 118.216 5.132 25259 13103 1 17 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.869 0.189 25259 13104 1 17 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.277 -1.778 25259 13105 1 17 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.488 -2.180 25259 13106 1 17 . 1 1 84 84 LEU H H 84 8.590 8.590 7.285 1.305 25259 13107 1 17 . 1 1 85 85 LEU N N 85 122.872 122.872 119.426 3.446 25259 13108 1 17 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.932 0.238 25259 13109 1 17 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.433 -2.037 25259 13110 1 17 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.490 -1.749 25259 13111 1 17 . 1 1 85 85 LEU H H 85 7.892 7.892 7.575 0.317 25259 13112 1 17 . 1 1 86 86 GLU N N 86 122.713 122.713 117.019 5.694 25259 13113 1 17 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.960 0.125 25259 13114 1 17 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.769 -2.024 25259 13115 1 17 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.722 -2.819 25259 13116 1 17 . 1 1 86 86 GLU H H 86 8.124 8.124 8.333 -0.209 25259 13117 1 17 . 1 1 87 87 ALA N N 87 123.163 123.163 121.042 2.121 25259 13118 1 17 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.240 -0.099 25259 13119 1 17 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.243 -1.975 25259 13120 1 17 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.797 -3.165 25259 13121 1 17 . 1 1 87 87 ALA H H 87 7.765 7.765 7.573 0.192 25259 13122 1 17 . 1 1 88 88 GLU N N 88 121.945 121.945 119.355 2.590 25259 13123 1 17 . 1 1 88 88 GLU HA H 88 4.084 4.084 3.997 0.087 25259 13124 1 17 . 1 1 88 88 GLU CA C 88 56.935 56.935 59.245 -2.310 25259 13125 1 17 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.049 -1.022 25259 13126 1 17 . 1 1 88 88 GLU H H 88 7.846 7.846 7.951 -0.105 25259 13127 1 17 . 1 1 89 89 GLU N N 89 117.978 117.978 115.667 2.311 25259 13128 1 17 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.197 -0.104 25259 13129 1 17 . 1 1 89 89 GLU CA C 89 55.214 55.214 57.638 -2.424 25259 13130 1 17 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.656 -2.249 25259 13131 1 17 . 1 1 89 89 GLU H H 89 7.634 7.634 7.659 -0.025 25259 13132 1 17 . 1 1 90 90 LYS N N 90 117.519 117.519 115.773 1.746 25259 13133 1 17 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.391 0.040 25259 13134 1 17 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.698 -2.680 25259 13135 1 17 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.840 -1.809 25259 13136 1 17 . 1 1 90 90 LYS H H 90 7.247 7.247 7.331 -0.084 25259 13137 1 17 . 1 1 91 91 ASP N N 91 124.888 124.888 123.227 1.661 25259 13138 1 17 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.602 0.081 25259 13139 1 17 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.518 -2.319 25259 13140 1 17 . 1 1 91 91 ASP CB C 91 39.581 39.581 41.714 -2.133 25259 13141 1 17 . 1 1 91 91 ASP H H 91 7.370 7.370 7.664 -0.294 25259 13142 1 17 . 1 1 92 92 LYS N N 92 129.311 129.311 128.544 0.767 25259 13143 1 17 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.888 0.125 25259 13144 1 17 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.604 -2.388 25259 13145 1 17 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.480 -2.465 25259 13146 1 17 . 1 1 92 92 LYS H H 92 8.795 8.795 8.664 0.131 25259 13147 1 17 . 1 1 93 93 SER N N 93 118.112 118.112 113.419 4.693 25259 13148 1 17 . 1 1 93 93 SER HA H 93 4.439 4.439 4.325 0.114 25259 13149 1 17 . 1 1 93 93 SER CA C 93 58.945 58.945 60.109 -1.165 25259 13150 1 17 . 1 1 93 93 SER CB C 93 60.278 60.278 63.039 -2.761 25259 13151 1 17 . 1 1 93 93 SER H H 93 8.488 8.488 8.485 0.003 25259 13152 1 17 . 1 1 94 94 ILE N N 94 128.950 128.950 121.187 7.763 25259 13153 1 17 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.896 -0.414 25259 13154 1 17 . 1 1 94 94 ILE CA C 94 62.349 62.349 63.526 -1.177 25259 13155 1 17 . 1 1 94 94 ILE CB C 94 34.753 34.753 38.930 -4.177 25259 13156 1 17 . 1 1 94 94 ILE H H 94 7.722 7.722 7.745 -0.023 25259 13157 1 17 . 1 1 95 95 ILE N N 95 123.598 123.598 121.561 2.037 25259 13158 1 17 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.512 0.083 25259 13159 1 17 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.893 -3.146 25259 13160 1 17 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.646 -1.674 25259 13161 1 17 . 1 1 95 95 ILE H H 95 8.378 8.378 8.397 -0.019 25259 13162 1 17 . 1 1 96 96 GLU N N 96 118.317 118.317 118.727 -0.410 25259 13163 1 17 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.923 0.061 25259 13164 1 17 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.163 -2.668 25259 13165 1 17 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.123 -1.950 25259 13166 1 17 . 1 1 96 96 GLU H H 96 7.680 7.680 8.231 -0.551 25259 13167 1 17 . 1 1 97 97 ALA N N 97 124.797 124.797 120.884 3.913 25259 13168 1 17 . 1 1 97 97 ALA HA H 97 3.825 3.825 4.150 -0.325 25259 13169 1 17 . 1 1 97 97 ALA CA C 97 52.297 52.297 52.901 -0.604 25259 13170 1 17 . 1 1 97 97 ALA CB C 97 14.989 14.989 18.375 -3.386 25259 13171 1 17 . 1 1 97 97 ALA H H 97 7.383 7.383 7.470 -0.087 25259 13172 1 17 . 1 1 98 98 ARG N N 98 115.469 115.469 118.584 -3.115 25259 13173 1 17 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.334 -0.028 25259 13174 1 17 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.321 -1.831 25259 13175 1 17 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.672 -1.434 25259 13176 1 17 . 1 1 98 98 ARG H H 98 8.229 8.229 8.145 0.084 25259 13177 1 17 . 1 1 99 99 LYS N N 99 120.219 120.219 118.414 1.805 25259 13178 1 17 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.098 0.160 25259 13179 1 17 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.938 -2.697 25259 13180 1 17 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.352 -1.856 25259 13181 1 17 . 1 1 99 99 LYS H H 99 7.270 7.270 7.559 -0.289 25259 13182 1 17 . 1 1 100 100 LEU N N 100 123.800 123.800 119.108 4.692 25259 13183 1 17 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.215 0.126 25259 13184 1 17 . 1 1 100 100 LEU CA C 100 52.079 52.079 55.209 -3.130 25259 13185 1 17 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.275 -3.144 25259 13186 1 17 . 1 1 100 100 LEU H H 100 7.837 7.837 7.653 0.184 25259 13187 1 17 . 1 1 101 101 ALA N N 101 130.512 130.512 123.513 6.999 25259 13188 1 17 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.535 -0.159 25259 13189 1 17 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.912 -2.508 25259 13190 1 17 . 1 1 101 101 ALA CB C 101 15.796 15.796 19.046 -3.250 25259 13191 1 17 . 1 1 101 101 ALA H H 101 8.213 8.213 8.971 -0.758 25259 13192 1 17 . 1 1 102 102 GLY N N 102 110.659 110.659 105.201 5.458 25259 13193 1 17 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.784 -0.891 25259 13194 1 17 . 1 1 102 102 GLY H H 102 8.738 8.738 8.231 0.507 25259 13195 1 17 . 1 1 103 103 PHE N N 103 123.097 123.097 123.177 -0.080 25259 13196 1 17 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.376 -0.156 25259 13197 1 17 . 1 1 103 103 PHE CA C 103 53.768 53.768 55.986 -2.218 25259 13198 1 17 . 1 1 103 103 PHE CB C 103 40.574 40.574 40.368 0.206 25259 13199 1 17 . 1 1 103 103 PHE H H 103 7.514 7.514 7.701 -0.187 25259 13200 1 17 . 1 1 104 104 LYS N N 104 130.652 130.652 127.254 3.398 25259 13201 1 17 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.236 -0.116 25259 13202 1 17 . 1 1 104 104 LYS CA C 104 52.979 52.979 55.324 -2.345 25259 13203 1 17 . 1 1 104 104 LYS CB C 104 34.237 34.237 35.063 -0.826 25259 13204 1 17 . 1 1 104 104 LYS H H 104 7.473 7.473 8.725 -1.252 25259 13205 1 17 . 1 1 105 105 LEU N N 105 127.372 127.372 122.888 4.484 25259 13206 1 17 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.897 0.099 25259 13207 1 17 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.117 -2.381 25259 13208 1 17 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.416 -1.452 25259 13209 1 17 . 1 1 105 105 LEU H H 105 8.393 8.393 8.045 0.348 25259 13210 1 17 . 1 1 106 106 GLU N N 106 129.358 129.358 124.698 4.660 25259 13211 1 17 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.575 0.269 25259 13212 1 17 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.208 -2.418 25259 13213 1 17 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.111 -1.484 25259 13214 1 17 . 1 1 106 106 GLU H H 106 8.849 8.849 8.954 -0.105 25259 13215 1 17 . 1 1 107 107 THR N N 107 131.118 131.118 117.884 13.234 25259 13216 1 17 . 1 1 107 107 THR HA H 107 5.110 5.110 4.500 0.610 25259 13217 1 17 . 1 1 107 107 THR CA C 107 59.832 59.832 62.291 -2.458 25259 13218 1 17 . 1 1 107 107 THR CB C 107 66.671 66.671 69.845 -3.174 25259 13219 1 17 . 1 1 107 107 THR H H 107 9.433 9.433 8.447 0.986 25259 13220 1 17 . 1 1 108 108 LYS N N 108 129.114 129.114 120.937 8.177 25259 13221 1 17 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.491 0.333 25259 13222 1 17 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.642 -3.448 25259 13223 1 17 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.124 -0.736 25259 13224 1 17 . 1 1 108 108 LYS H H 108 9.410 9.410 9.097 0.313 25259 13225 1 17 . 1 1 109 109 LEU N N 109 129.323 129.323 126.853 2.470 25259 13226 1 17 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.436 0.268 25259 13227 1 17 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.439 -2.331 25259 13228 1 17 . 1 1 109 109 LEU CB C 109 39.655 39.655 41.751 -2.096 25259 13229 1 17 . 1 1 109 109 LEU H H 109 8.862 8.862 9.285 -0.423 25259 13230 1 17 . 1 1 110 110 LEU N N 110 129.123 129.123 127.778 1.345 25259 13231 1 17 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.340 -0.117 25259 13232 1 17 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.492 -2.710 25259 13233 1 17 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.885 -2.224 25259 13234 1 17 . 1 1 110 110 LEU H H 110 8.373 8.373 8.679 -0.306 25259 13235 1 17 . 1 1 111 111 SER N N 111 114.587 114.587 110.959 3.628 25259 13236 1 17 . 1 1 111 111 SER HA H 111 4.557 4.557 4.513 0.043 25259 13237 1 17 . 1 1 111 111 SER CA C 111 53.889 53.889 58.124 -4.235 25259 13238 1 17 . 1 1 111 111 SER CB C 111 61.830 61.830 64.751 -2.921 25259 13239 1 17 . 1 1 111 111 SER H H 111 8.400 8.400 7.617 0.783 25259 13240 1 17 . 1 1 112 112 ALA N N 112 118.269 118.269 123.371 -5.102 25259 13241 1 17 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.311 -0.002 25259 13242 1 17 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.392 -3.178 25259 13243 1 17 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.473 -1.885 25259 13244 1 17 . 1 1 112 112 ALA H H 112 8.556 8.556 8.717 -0.161 25259 13245 1 17 . 1 1 113 113 THR N N 113 102.878 102.878 103.374 -0.496 25259 13246 1 17 . 1 1 113 113 THR HA H 113 4.662 4.662 4.489 0.173 25259 13247 1 17 . 1 1 113 113 THR CA C 113 58.689 58.689 61.945 -3.256 25259 13248 1 17 . 1 1 113 113 THR CB C 113 67.905 67.905 69.751 -1.846 25259 13249 1 17 . 1 1 113 113 THR H H 113 8.065 8.065 7.730 0.335 25259 13250 1 17 . 1 1 114 114 GLU N N 114 126.514 126.514 121.272 5.242 25259 13251 1 17 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.140 -0.126 25259 13252 1 17 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.958 -1.951 25259 13253 1 17 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.402 -1.489 25259 13254 1 17 . 1 1 114 114 GLU H H 114 7.357 7.357 7.725 -0.368 25259 13255 1 17 . 1 1 115 115 LEU N N 115 128.058 128.058 119.483 8.575 25259 13256 1 17 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.106 -0.184 25259 13257 1 17 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.860 -1.536 25259 13258 1 17 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.803 -1.663 25259 13259 1 17 . 1 1 115 115 LEU H H 115 8.930 8.930 8.775 0.155 25259 13260 1 17 . 1 1 116 116 GLN N N 116 126.540 126.540 119.671 6.869 25259 13261 1 17 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.227 0.488 25259 13262 1 17 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.147 -2.447 25259 13263 1 17 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.414 -1.122 25259 13264 1 17 . 1 1 116 116 GLN H H 116 9.221 9.221 9.027 0.194 25259 13265 1 17 . 1 1 117 117 THR N N 117 125.213 125.213 119.720 5.493 25259 13266 1 17 . 1 1 117 117 THR HA H 117 5.353 5.353 5.151 0.202 25259 13267 1 17 . 1 1 117 117 THR CA C 117 58.926 58.926 60.995 -2.069 25259 13268 1 17 . 1 1 117 117 THR CB C 117 68.948 68.948 71.950 -3.002 25259 13269 1 17 . 1 1 117 117 THR H H 117 9.030 9.030 8.920 0.110 25259 13270 1 17 . 1 1 118 118 THR N N 118 127.799 127.799 117.424 10.375 25259 13271 1 17 . 1 1 118 118 THR HA H 118 5.527 5.527 5.365 0.162 25259 13272 1 17 . 1 1 118 118 THR CA C 118 59.201 59.201 61.380 -2.179 25259 13273 1 17 . 1 1 118 118 THR CB C 118 67.721 67.721 72.487 -4.766 25259 13274 1 17 . 1 1 118 118 THR H H 118 9.459 9.459 8.450 1.009 25259 13275 1 17 . 1 1 119 119 THR N N 119 129.258 129.258 120.547 8.711 25259 13276 1 17 . 1 1 119 119 THR HA H 119 4.885 4.885 4.676 0.209 25259 13277 1 17 . 1 1 119 119 THR CA C 119 58.463 58.463 61.150 -2.687 25259 13278 1 17 . 1 1 119 119 THR CB C 119 67.459 67.459 70.921 -3.462 25259 13279 1 17 . 1 1 119 119 THR H H 119 9.147 9.147 8.892 0.255 25259 13280 1 17 . 1 1 120 120 SER N N 120 123.389 123.389 119.850 3.539 25259 13281 1 17 . 1 1 120 120 SER HA H 120 5.328 5.328 4.815 0.513 25259 13282 1 17 . 1 1 120 120 SER CA C 120 54.386 54.386 57.355 -2.969 25259 13283 1 17 . 1 1 120 120 SER CB C 120 63.031 63.031 64.321 -1.290 25259 13284 1 17 . 1 1 120 120 SER H H 120 8.786 8.786 8.706 0.080 25259 13285 1 17 . 1 1 121 121 PHE N N 121 121.245 121.245 124.597 -3.352 25259 13286 1 17 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.936 0.176 25259 13287 1 17 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.282 -3.090 25259 13288 1 17 . 1 1 121 121 PHE CB C 121 40.265 40.265 38.772 1.494 25259 13289 1 17 . 1 1 121 121 PHE H H 121 8.831 8.831 8.987 -0.156 25259 13290 1 17 . 1 1 122 122 ASP N N 122 124.765 124.765 125.261 -0.496 25259 13291 1 17 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.860 -0.020 25259 13292 1 17 . 1 1 122 122 ASP CA C 122 49.837 49.837 52.678 -2.841 25259 13293 1 17 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.935 -2.450 25259 13294 1 17 . 1 1 122 122 ASP H H 122 8.819 8.819 8.671 0.148 25259 13295 1 17 . 1 1 123 123 PHE N N 123 124.303 124.303 125.379 -1.076 25259 13296 1 17 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.205 0.469 25259 13297 1 17 . 1 1 123 123 PHE CA C 123 57.798 57.798 61.578 -3.780 25259 13298 1 17 . 1 1 123 123 PHE CB C 123 35.540 35.540 39.155 -3.615 25259 13299 1 17 . 1 1 123 123 PHE H H 123 8.262 8.262 8.366 -0.104 25259 13300 1 17 . 1 1 124 124 GLN N N 124 120.792 120.792 118.027 2.765 25259 13301 1 17 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.289 0.145 25259 13302 1 17 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.047 -1.964 25259 13303 1 17 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.439 -1.310 25259 13304 1 17 . 1 1 124 124 GLN H H 124 8.954 8.954 8.368 0.586 25259 13305 1 17 . 1 1 125 125 VAL N N 125 114.091 114.091 116.171 -2.080 25259 13306 1 17 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.319 0.090 25259 13307 1 17 . 1 1 125 125 VAL CA C 125 59.298 59.298 60.835 -1.537 25259 13308 1 17 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.212 -0.640 25259 13309 1 17 . 1 1 125 125 VAL H H 125 7.026 7.026 7.613 -0.587 25259 13310 1 17 . 1 1 126 126 LEU N N 126 125.158 125.158 122.776 2.382 25259 13311 1 17 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.654 -0.179 25259 13312 1 17 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.142 -0.967 25259 13313 1 17 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.252 -1.198 25259 13314 1 17 . 1 1 126 126 LEU H H 126 8.106 8.106 7.627 0.479 25259 13315 1 17 . 1 1 127 127 ASP N N 127 130.026 130.026 129.671 0.355 25259 13316 1 17 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.741 0.100 25259 13317 1 17 . 1 1 127 127 ASP CA C 127 50.198 50.198 54.319 -4.122 25259 13318 1 17 . 1 1 127 127 ASP CB C 127 37.689 37.689 39.849 -2.160 25259 13319 1 17 . 1 1 127 127 ASP H H 127 9.129 9.129 9.042 0.087 25259 13320 1 17 . 1 1 128 128 VAL N N 128 128.833 128.833 123.359 5.474 25259 13321 1 17 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.658 -0.134 25259 13322 1 17 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.030 -2.362 25259 13323 1 17 . 1 1 128 128 VAL CB C 128 29.495 29.495 32.000 -2.505 25259 13324 1 17 . 1 1 128 128 VAL H H 128 8.288 8.288 7.937 0.351 25259 13325 1 17 . 1 1 129 129 LYS N N 129 123.914 123.914 117.550 6.364 25259 13326 1 17 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.059 -0.016 25259 13327 1 17 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.492 -1.703 25259 13328 1 17 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.956 -3.019 25259 13329 1 17 . 1 1 129 129 LYS H H 129 8.226 8.226 8.371 -0.145 25259 13330 1 17 . 1 1 130 130 LYS N N 130 121.888 121.888 116.411 5.477 25259 13331 1 17 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.396 -0.311 25259 13332 1 17 . 1 1 130 130 LYS CA C 130 56.146 56.146 56.788 -0.641 25259 13333 1 17 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.965 -3.625 25259 13334 1 17 . 1 1 130 130 LYS H H 130 7.590 7.590 7.880 -0.290 25259 13335 1 17 . 1 1 131 131 ALA N N 131 123.088 123.088 123.684 -0.596 25259 13336 1 17 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.000 -0.073 25259 13337 1 17 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.412 -3.010 25259 13338 1 17 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.228 -1.781 25259 13339 1 17 . 1 1 131 131 ALA H H 131 8.506 8.506 8.194 0.312 25259 13340 1 17 . 1 1 132 132 SER N N 132 110.456 110.456 111.479 -1.023 25259 13341 1 17 . 1 1 132 132 SER HA H 132 4.117 4.117 4.104 0.013 25259 13342 1 17 . 1 1 132 132 SER CA C 132 58.289 58.289 60.086 -1.797 25259 13343 1 17 . 1 1 132 132 SER CB C 132 61.034 61.034 62.920 -1.886 25259 13344 1 17 . 1 1 132 132 SER H H 132 7.986 7.986 7.737 0.249 25259 13345 1 17 . 1 1 133 133 GLN N N 133 119.034 119.034 119.460 -0.426 25259 13346 1 17 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.179 0.223 25259 13347 1 17 . 1 1 133 133 GLN CA C 133 52.525 52.525 55.884 -3.359 25259 13348 1 17 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.104 -1.870 25259 13349 1 17 . 1 1 133 133 GLN H H 133 7.233 7.233 7.609 -0.376 25259 13350 1 17 . 1 1 134 134 LEU N N 134 123.291 123.291 120.688 2.603 25259 13351 1 17 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.294 0.099 25259 13352 1 17 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.358 -2.042 25259 13353 1 17 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.066 -3.219 25259 13354 1 17 . 1 1 134 134 LEU H H 134 7.411 7.411 7.431 -0.020 25259 13355 1 17 . 1 1 135 135 GLU N N 135 128.446 128.446 125.790 2.656 25259 13356 1 17 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.950 -0.004 25259 13357 1 17 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.284 -1.900 25259 13358 1 17 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.759 -2.463 25259 13359 1 17 . 1 1 135 135 GLU H H 135 8.986 8.986 8.889 0.097 25259 13360 1 17 . 1 1 136 136 HIS N N 136 117.593 117.593 117.248 0.345 25259 13361 1 17 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.422 -0.039 25259 13362 1 17 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.415 -1.730 25259 13363 1 17 . 1 1 136 136 HIS CB C 136 28.413 28.413 30.026 -1.613 25259 13364 1 17 . 1 1 136 136 HIS H H 136 9.226 9.226 8.729 0.497 25259 13365 1 17 . 1 1 137 137 LEU N N 137 115.463 115.463 115.826 -0.363 25259 13366 1 17 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.414 0.093 25259 13367 1 17 . 1 1 137 137 LEU CA C 137 51.948 51.948 53.868 -1.921 25259 13368 1 17 . 1 1 137 137 LEU CB C 137 39.807 39.807 43.399 -3.592 25259 13369 1 17 . 1 1 137 137 LEU H H 137 7.090 7.090 7.638 -0.548 25259 13370 1 17 . 1 1 138 138 LYS N N 138 124.686 124.686 119.468 5.218 25259 13371 1 17 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.146 0.023 25259 13372 1 17 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.713 -1.555 25259 13373 1 17 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.110 -2.022 25259 13374 1 17 . 1 1 138 138 LYS H H 138 7.698 7.698 7.779 -0.081 25259 13375 1 17 . 1 1 139 139 ASN N N 139 118.077 118.077 116.269 1.808 25259 13376 1 17 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.587 0.086 25259 13377 1 17 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.925 -2.143 25259 13378 1 17 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.778 -2.961 25259 13379 1 17 . 1 1 139 139 ASN H H 139 8.485 8.485 8.348 0.137 25259 13380 1 17 . 1 1 140 140 ILE N N 140 120.880 120.880 120.427 0.453 25259 13381 1 17 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.067 -0.037 25259 13382 1 17 . 1 1 140 140 ILE CA C 140 59.566 59.566 62.051 -2.486 25259 13383 1 17 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.041 -2.267 25259 13384 1 17 . 1 1 140 140 ILE H H 140 7.549 7.549 7.139 0.410 25259 13385 1 17 . 1 1 141 141 GLY N N 141 110.676 110.676 116.110 -5.434 25259 13386 1 17 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.795 -0.131 25259 13387 1 17 . 1 1 141 141 GLY H H 141 7.663 7.663 8.587 -0.924 25259 13388 1 17 . 1 1 142 142 LEU N N 142 123.857 123.857 123.267 0.590 25259 13389 1 17 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.939 -0.246 25259 13390 1 17 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.199 -2.006 25259 13391 1 17 . 1 1 142 142 LEU CB C 142 40.609 40.609 42.103 -1.494 25259 13392 1 17 . 1 1 142 142 LEU H H 142 8.496 8.496 7.415 1.081 25259 13393 1 17 . 1 1 143 143 GLU N N 143 118.407 118.407 119.904 -1.497 25259 13394 1 17 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.969 -0.183 25259 13395 1 17 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.208 -1.986 25259 13396 1 17 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.049 -2.536 25259 13397 1 17 . 1 1 143 143 GLU H H 143 8.672 8.672 8.604 0.068 25259 13398 1 17 . 1 1 144 144 ASN N N 144 118.477 118.477 116.080 2.397 25259 13399 1 17 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.501 -0.059 25259 13400 1 17 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.801 -2.089 25259 13401 1 17 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.197 -2.241 25259 13402 1 17 . 1 1 144 144 ASN H H 144 7.656 7.656 8.155 -0.499 25259 13403 1 17 . 1 1 145 145 LEU N N 145 125.354 125.354 121.501 3.853 25259 13404 1 17 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.777 0.020 25259 13405 1 17 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.173 -0.850 25259 13406 1 17 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.784 -2.211 25259 13407 1 17 . 1 1 145 145 LEU H H 145 7.758 7.758 7.108 0.650 25259 13408 1 17 . 1 1 146 146 LEU N N 146 116.372 116.372 116.742 -0.370 25259 13409 1 17 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.827 0.049 25259 13410 1 17 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.497 -2.254 25259 13411 1 17 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.295 -2.398 25259 13412 1 17 . 1 1 146 146 LEU H H 146 7.242 7.242 7.755 -0.513 25259 13413 1 17 . 1 1 147 147 LYS N N 147 120.054 120.054 117.753 2.301 25259 13414 1 17 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.421 -0.109 25259 13415 1 17 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.909 -1.286 25259 13416 1 17 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.620 -2.360 25259 13417 1 17 . 1 1 147 147 LYS H H 147 7.185 7.185 7.467 -0.282 25259 13418 1 17 . 1 1 148 148 ASN N N 148 119.498 119.498 117.427 2.071 25259 13419 1 17 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.867 0.095 25259 13420 1 17 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.009 -2.235 25259 13421 1 17 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.725 -1.239 25259 13422 1 17 . 1 1 148 148 ASN H H 148 7.698 7.698 7.534 0.164 25259 13423 1 17 . 1 1 149 149 GLU N N 149 122.834 122.834 118.271 4.563 25259 13424 1 17 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.530 0.071 25259 13425 1 17 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.465 -2.246 25259 13426 1 17 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.414 -2.604 25259 13427 1 17 . 1 1 149 149 GLU H H 149 8.767 8.767 8.666 0.101 25259 13428 1 17 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.500 1.108 25259 13429 1 17 . 1 1 150 150 PRO CA C 150 63.242 63.242 63.726 -0.484 25259 13430 1 17 . 1 1 150 150 PRO CB C 150 28.095 28.095 30.883 -2.788 25259 13431 1 17 . 1 1 151 151 SER N N 151 112.839 112.839 109.626 3.213 25259 13432 1 17 . 1 1 151 151 SER HA H 151 3.835 3.835 4.417 -0.582 25259 13433 1 17 . 1 1 151 151 SER CA C 151 59.270 59.270 56.672 2.598 25259 13434 1 17 . 1 1 151 151 SER CB C 151 59.451 59.451 62.313 -2.862 25259 13435 1 17 . 1 1 151 151 SER H H 151 8.519 8.519 7.945 0.574 25259 13436 1 17 . 1 1 152 152 LYS N N 152 126.710 126.710 121.979 4.731 25259 13437 1 17 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.315 -0.067 25259 13438 1 17 . 1 1 152 152 LYS CA C 152 55.765 55.765 58.113 -2.348 25259 13439 1 17 . 1 1 152 152 LYS CB C 152 30.257 30.257 33.108 -2.850 25259 13440 1 17 . 1 1 152 152 LYS H H 152 7.006 7.006 7.808 -0.802 25259 13441 1 17 . 1 1 153 153 TYR N N 153 123.239 123.239 117.733 5.506 25259 13442 1 17 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.440 -0.182 25259 13443 1 17 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.749 0.560 25259 13444 1 17 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.455 -1.121 25259 13445 1 17 . 1 1 153 153 TYR H H 153 8.058 8.058 8.228 -0.170 25259 13446 1 17 . 1 1 154 154 ILE N N 154 120.253 120.253 120.570 -0.317 25259 13447 1 17 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.184 0.189 25259 13448 1 17 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.063 -1.949 25259 13449 1 17 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.416 -1.468 25259 13450 1 17 . 1 1 154 154 ILE H H 154 8.193 8.193 7.907 0.286 25259 13451 1 17 . 1 1 155 155 SER N N 155 117.178 117.178 113.348 3.830 25259 13452 1 17 . 1 1 155 155 SER HA H 155 4.091 4.091 4.180 -0.089 25259 13453 1 17 . 1 1 155 155 SER CA C 155 59.961 59.961 60.209 -0.248 25259 13454 1 17 . 1 1 155 155 SER CB C 155 60.148 60.148 62.638 -2.490 25259 13455 1 17 . 1 1 155 155 SER H H 155 8.020 8.020 8.110 -0.090 25259 13456 1 17 . 1 1 156 156 ASP N N 156 125.479 125.479 122.944 2.535 25259 13457 1 17 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.527 -0.100 25259 13458 1 17 . 1 1 156 156 ASP CA C 156 54.760 54.760 57.150 -2.390 25259 13459 1 17 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.912 -3.039 25259 13460 1 17 . 1 1 156 156 ASP H H 156 8.638 8.638 7.821 0.817 25259 13461 1 17 . 1 1 157 157 ARG N N 157 121.542 121.542 120.427 1.115 25259 13462 1 17 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.971 0.140 25259 13463 1 17 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.934 -3.006 25259 13464 1 17 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.595 -1.779 25259 13465 1 17 . 1 1 157 157 ARG H H 157 7.888 7.888 8.034 -0.146 25259 13466 1 17 . 1 1 158 158 LEU N N 158 124.257 124.257 119.734 4.523 25259 13467 1 17 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.338 -0.067 25259 13468 1 17 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.266 -3.053 25259 13469 1 17 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.533 -1.588 25259 13470 1 17 . 1 1 158 158 LEU H H 158 8.442 8.442 7.579 0.863 25259 13471 1 17 . 1 1 159 159 ALA N N 159 124.146 124.146 120.525 3.621 25259 13472 1 17 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.078 0.254 25259 13473 1 17 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.242 -2.810 25259 13474 1 17 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.521 -2.614 25259 13475 1 17 . 1 1 159 159 ALA H H 159 8.086 8.086 7.747 0.339 25259 13476 1 17 . 1 1 160 160 ASN N N 160 118.093 118.093 115.528 2.565 25259 13477 1 17 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.549 0.443 25259 13478 1 17 . 1 1 160 160 ASN CA C 160 50.577 50.577 54.028 -3.451 25259 13479 1 17 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.097 -1.364 25259 13480 1 17 . 1 1 160 160 ASN H H 160 7.445 7.445 8.357 -0.912 25259 13481 1 17 . 1 1 161 161 GLY N N 161 108.365 108.365 104.809 3.556 25259 13482 1 17 . 1 1 161 161 GLY CA C 161 43.646 43.646 44.656 -1.010 25259 13483 1 17 . 1 1 161 161 GLY H H 161 7.743 7.743 7.622 0.121 25259 13484 1 17 . 1 1 162 162 ALA N N 162 123.928 123.928 123.529 0.399 25259 13485 1 17 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.012 -0.139 25259 13486 1 17 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.378 -1.852 25259 13487 1 17 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.014 -2.954 25259 13488 1 17 . 1 1 162 162 ALA H H 162 8.035 8.035 8.112 -0.077 25259 13489 1 17 . 1 1 163 163 THR N N 163 113.286 113.286 112.870 0.416 25259 13490 1 17 . 1 1 163 163 THR HA H 163 4.703 4.703 4.629 0.074 25259 13491 1 17 . 1 1 163 163 THR CA C 163 57.791 57.791 60.652 -2.861 25259 13492 1 17 . 1 1 163 163 THR CB C 163 68.974 68.974 70.982 -2.008 25259 13493 1 17 . 1 1 163 163 THR H H 163 8.451 8.451 8.394 0.057 25259 13494 1 17 . 1 1 164 164 GLU N N 164 125.905 125.905 120.363 5.542 25259 13495 1 17 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.749 0.311 25259 13496 1 17 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.078 -1.493 25259 13497 1 17 . 1 1 164 164 GLU CB C 164 29.211 29.211 31.696 -2.485 25259 13498 1 17 . 1 1 164 164 GLU H H 164 8.716 8.716 8.481 0.235 25259 13499 1 18 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.194 -0.519 25259 13500 1 18 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.809 -2.001 25259 13501 1 18 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.704 -3.634 25259 13502 1 18 . 1 1 3 3 ALA N N 3 126.741 126.741 123.371 3.370 25259 13503 1 18 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.567 -0.073 25259 13504 1 18 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.603 -1.401 25259 13505 1 18 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.022 -3.204 25259 13506 1 18 . 1 1 3 3 ALA H H 3 8.440 8.440 8.248 0.192 25259 13507 1 18 . 1 1 4 4 THR N N 4 116.015 116.015 113.781 2.234 25259 13508 1 18 . 1 1 4 4 THR HA H 4 4.393 4.393 4.337 0.056 25259 13509 1 18 . 1 1 4 4 THR CA C 4 59.148 59.148 61.735 -2.587 25259 13510 1 18 . 1 1 4 4 THR CB C 4 67.580 67.580 69.359 -1.779 25259 13511 1 18 . 1 1 4 4 THR H H 4 8.050 8.050 7.905 0.145 25259 13512 1 18 . 1 1 5 5 LYS N N 5 126.350 126.350 121.596 4.754 25259 13513 1 18 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.369 0.136 25259 13514 1 18 . 1 1 5 5 LYS CA C 5 53.917 53.917 56.776 -2.858 25259 13515 1 18 . 1 1 5 5 LYS CB C 5 30.684 30.684 32.880 -2.196 25259 13516 1 18 . 1 1 5 5 LYS H H 5 8.332 8.332 8.567 -0.235 25259 13517 1 18 . 1 1 6 6 THR N N 6 118.124 118.124 114.085 4.039 25259 13518 1 18 . 1 1 6 6 THR HA H 6 4.440 4.440 4.566 -0.126 25259 13519 1 18 . 1 1 6 6 THR CA C 6 59.282 59.282 61.532 -2.250 25259 13520 1 18 . 1 1 6 6 THR CB C 6 67.685 67.685 70.036 -2.351 25259 13521 1 18 . 1 1 6 6 THR H H 6 8.283 8.283 8.141 0.142 25259 13522 1 18 . 1 1 7 7 GLU N N 7 125.934 125.934 123.327 2.607 25259 13523 1 18 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.852 -0.508 25259 13524 1 18 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.564 -1.383 25259 13525 1 18 . 1 1 7 7 GLU CB C 7 27.816 27.816 32.962 -5.146 25259 13526 1 18 . 1 1 7 7 GLU H H 7 8.487 8.487 8.609 -0.122 25259 13527 1 18 . 1 1 8 8 LYS N N 8 123.945 123.945 120.422 3.523 25259 13528 1 18 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.836 -1.901 25259 13529 1 18 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.996 -3.431 25259 13530 1 18 . 1 1 8 8 LYS H H 8 8.278 8.278 8.234 0.044 25259 13531 1 18 . 1 1 9 9 ASP N N 9 123.624 123.624 120.697 2.927 25259 13532 1 18 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.887 -0.548 25259 13533 1 18 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.817 -1.694 25259 13534 1 18 . 1 1 9 9 ASP CB C 9 38.933 38.933 41.780 -2.847 25259 13535 1 18 . 1 1 9 9 ASP H H 9 8.277 8.277 8.480 -0.203 25259 13536 1 18 . 1 1 10 10 THR N N 10 116.812 116.812 117.545 -0.733 25259 13537 1 18 . 1 1 10 10 THR HA H 10 4.349 4.349 4.596 -0.247 25259 13538 1 18 . 1 1 10 10 THR CA C 10 59.634 59.634 62.537 -2.903 25259 13539 1 18 . 1 1 10 10 THR CB C 10 67.254 67.254 69.608 -2.354 25259 13540 1 18 . 1 1 10 10 THR H H 10 8.049 8.049 8.477 -0.428 25259 13541 1 18 . 1 1 11 11 LEU N N 11 126.610 126.610 124.904 1.706 25259 13542 1 18 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.850 -0.458 25259 13543 1 18 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.396 -1.318 25259 13544 1 18 . 1 1 11 11 LEU CB C 11 39.633 39.633 44.316 -4.684 25259 13545 1 18 . 1 1 11 11 LEU H H 11 8.191 8.191 8.338 -0.147 25259 13546 1 18 . 1 1 12 12 GLN N N 12 123.274 123.274 120.596 2.678 25259 13547 1 18 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.934 -0.552 25259 13548 1 18 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.891 -1.317 25259 13549 1 18 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.368 -4.565 25259 13550 1 18 . 1 1 12 12 GLN H H 12 8.280 8.280 8.580 -0.300 25259 13551 1 18 . 1 1 13 13 SER N N 13 119.027 119.027 114.819 4.208 25259 13552 1 18 . 1 1 13 13 SER HA H 13 4.471 4.471 5.320 -0.849 25259 13553 1 18 . 1 1 13 13 SER CA C 13 55.869 55.869 57.790 -1.921 25259 13554 1 18 . 1 1 13 13 SER CB C 13 61.424 61.424 65.535 -4.111 25259 13555 1 18 . 1 1 13 13 SER H H 13 8.178 8.178 8.698 -0.520 25259 13556 1 18 . 1 1 14 14 ALA N N 14 128.314 128.314 123.424 4.890 25259 13557 1 18 . 1 1 14 14 ALA HA H 14 4.434 4.434 5.049 -0.615 25259 13558 1 18 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.635 -1.939 25259 13559 1 18 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.888 -2.807 25259 13560 1 18 . 1 1 14 14 ALA H H 14 8.195 8.195 8.518 -0.323 25259 13561 1 18 . 1 1 15 15 LEU N N 15 125.175 125.175 122.398 2.777 25259 13562 1 18 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.789 -0.149 25259 13563 1 18 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.967 -3.362 25259 13564 1 18 . 1 1 15 15 LEU CB C 15 39.467 39.467 41.760 -2.293 25259 13565 1 18 . 1 1 15 15 LEU H H 15 8.050 8.050 8.797 -0.747 25259 13566 1 18 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.653 -0.149 25259 13567 1 18 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.667 -2.036 25259 13568 1 18 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.560 -2.902 25259 13569 1 18 . 1 1 17 17 VAL N N 17 123.223 123.223 117.027 6.196 25259 13570 1 18 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.685 -0.551 25259 13571 1 18 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.093 -1.266 25259 13572 1 18 . 1 1 17 17 VAL CB C 17 30.377 30.377 33.864 -3.487 25259 13573 1 18 . 1 1 17 17 VAL H H 17 8.134 8.134 8.358 -0.224 25259 13574 1 18 . 1 1 18 18 ILE N N 18 127.777 127.777 120.028 7.749 25259 13575 1 18 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.582 -0.339 25259 13576 1 18 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.551 -2.229 25259 13577 1 18 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.832 -4.578 25259 13578 1 18 . 1 1 18 18 ILE H H 18 8.187 8.187 8.856 -0.669 25259 13579 1 18 . 1 1 19 19 GLU N N 19 128.148 128.148 123.240 4.908 25259 13580 1 18 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.887 -0.550 25259 13581 1 18 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.599 -1.508 25259 13582 1 18 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.056 -3.881 25259 13583 1 18 . 1 1 19 19 GLU H H 19 8.475 8.475 8.706 -0.231 25259 13584 1 18 . 1 1 20 20 ASN N N 20 122.788 122.788 117.137 5.651 25259 13585 1 18 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.857 -0.162 25259 13586 1 18 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.876 -2.054 25259 13587 1 18 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.605 -4.239 25259 13588 1 18 . 1 1 20 20 ASN H H 20 8.477 8.477 8.420 0.057 25259 13589 1 18 . 1 1 21 21 ALA N N 21 127.253 127.253 123.451 3.802 25259 13590 1 18 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.381 -0.060 25259 13591 1 18 . 1 1 21 21 ALA CA C 21 50.688 50.688 53.136 -2.448 25259 13592 1 18 . 1 1 21 21 ALA CB C 21 16.913 16.913 18.940 -2.027 25259 13593 1 18 . 1 1 21 21 ALA H H 21 8.325 8.325 8.654 -0.329 25259 13594 1 18 . 1 1 22 22 GLU N N 22 122.044 122.044 118.011 4.033 25259 13595 1 18 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.238 0.055 25259 13596 1 18 . 1 1 22 22 GLU CA C 22 54.583 54.583 57.305 -2.722 25259 13597 1 18 . 1 1 22 22 GLU CB C 22 27.285 27.285 29.573 -2.288 25259 13598 1 18 . 1 1 22 22 GLU H H 22 8.415 8.415 8.449 -0.034 25259 13599 1 18 . 1 1 23 23 LYS N N 23 123.622 123.622 118.634 4.988 25259 13600 1 18 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.478 -0.153 25259 13601 1 18 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.493 -0.997 25259 13602 1 18 . 1 1 23 23 LYS CB C 23 30.653 30.653 34.207 -3.554 25259 13603 1 18 . 1 1 23 23 LYS H H 23 8.127 8.127 7.669 0.458 25259 13604 1 18 . 1 1 24 24 ASN N N 24 120.652 120.652 118.869 1.783 25259 13605 1 18 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.717 0.124 25259 13606 1 18 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.921 -2.258 25259 13607 1 18 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.511 -2.736 25259 13608 1 18 . 1 1 24 24 ASN H H 24 8.424 8.424 8.543 -0.119 25259 13609 1 18 . 1 1 25 25 THR N N 25 117.102 117.102 115.545 1.557 25259 13610 1 18 . 1 1 25 25 THR HA H 25 4.367 4.367 4.144 0.223 25259 13611 1 18 . 1 1 25 25 THR CA C 25 59.500 59.500 62.144 -2.644 25259 13612 1 18 . 1 1 25 25 THR CB C 25 67.610 67.610 69.044 -1.435 25259 13613 1 18 . 1 1 25 25 THR H H 25 7.852 7.852 8.427 -0.575 25259 13614 1 18 . 1 1 26 26 VAL N N 26 126.491 126.491 127.056 -0.565 25259 13615 1 18 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.027 0.140 25259 13616 1 18 . 1 1 26 26 VAL CA C 26 60.193 60.193 62.482 -2.289 25259 13617 1 18 . 1 1 26 26 VAL CB C 26 29.605 29.605 30.453 -0.848 25259 13618 1 18 . 1 1 26 26 VAL H H 26 8.080 8.080 8.369 -0.289 25259 13619 1 18 . 1 1 27 27 VAL N N 27 132.992 132.992 131.008 1.984 25259 13620 1 18 . 1 1 27 27 VAL HA H 27 4.081 4.081 3.923 0.158 25259 13621 1 18 . 1 1 27 27 VAL CA C 27 58.984 58.984 62.944 -3.960 25259 13622 1 18 . 1 1 27 27 VAL CB C 27 31.540 31.540 31.862 -0.322 25259 13623 1 18 . 1 1 27 27 VAL H H 27 8.830 8.830 8.775 0.055 25259 13624 1 18 . 1 1 28 28 THR N N 28 123.576 123.576 123.136 0.440 25259 13625 1 18 . 1 1 28 28 THR HA H 28 5.553 5.553 4.795 0.758 25259 13626 1 18 . 1 1 28 28 THR CA C 28 58.738 58.738 61.427 -2.689 25259 13627 1 18 . 1 1 28 28 THR CB C 28 68.443 68.443 69.454 -1.011 25259 13628 1 18 . 1 1 28 28 THR H H 28 8.165 8.165 8.393 -0.228 25259 13629 1 18 . 1 1 29 29 LYS N N 29 129.099 129.099 127.534 1.565 25259 13630 1 18 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.579 0.363 25259 13631 1 18 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.583 -3.804 25259 13632 1 18 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.167 0.929 25259 13633 1 18 . 1 1 29 29 LYS H H 29 9.273 9.273 8.926 0.347 25259 13634 1 18 . 1 1 30 30 THR N N 30 123.510 123.510 115.990 7.520 25259 13635 1 18 . 1 1 30 30 THR HA H 30 5.428 5.428 4.989 0.439 25259 13636 1 18 . 1 1 30 30 THR CA C 30 59.784 59.784 61.681 -1.897 25259 13637 1 18 . 1 1 30 30 THR CB C 30 67.818 67.818 71.764 -3.946 25259 13638 1 18 . 1 1 30 30 THR H H 30 8.993 8.993 8.238 0.755 25259 13639 1 18 . 1 1 31 31 LEU N N 31 128.293 128.293 125.138 3.155 25259 13640 1 18 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.952 0.268 25259 13641 1 18 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.396 -3.341 25259 13642 1 18 . 1 1 31 31 LEU CB C 31 43.399 43.399 45.159 -1.760 25259 13643 1 18 . 1 1 31 31 LEU H H 31 9.557 9.557 8.941 0.616 25259 13644 1 18 . 1 1 32 32 VAL N N 32 126.919 126.919 125.631 1.288 25259 13645 1 18 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.135 0.316 25259 13646 1 18 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.598 -1.934 25259 13647 1 18 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.392 -0.943 25259 13648 1 18 . 1 1 32 32 VAL H H 32 9.364 9.364 8.482 0.882 25259 13649 1 18 . 1 1 33 33 LEU N N 33 133.503 133.503 129.971 3.532 25259 13650 1 18 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.574 -0.018 25259 13651 1 18 . 1 1 33 33 LEU CA C 33 52.004 52.004 52.259 -0.255 25259 13652 1 18 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.168 -4.321 25259 13653 1 18 . 1 1 33 33 LEU H H 33 8.587 8.587 8.117 0.470 25259 13654 1 18 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.448 0.033 25259 13655 1 18 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.627 -2.182 25259 13656 1 18 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.220 -2.655 25259 13657 1 18 . 1 1 35 35 LYS N N 35 127.420 127.420 117.192 10.228 25259 13658 1 18 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.767 -0.401 25259 13659 1 18 . 1 1 35 35 LYS CA C 35 55.119 55.119 54.236 0.883 25259 13660 1 18 . 1 1 35 35 LYS CB C 35 30.594 30.594 34.927 -4.333 25259 13661 1 18 . 1 1 35 35 LYS H H 35 8.666 8.666 8.227 0.439 25259 13662 1 18 . 1 1 36 36 SER N N 36 122.222 122.222 118.274 3.948 25259 13663 1 18 . 1 1 36 36 SER HA H 36 4.753 4.753 4.481 0.272 25259 13664 1 18 . 1 1 36 36 SER CA C 36 55.328 55.328 59.396 -4.068 25259 13665 1 18 . 1 1 36 36 SER CB C 36 61.728 61.728 61.318 0.410 25259 13666 1 18 . 1 1 36 36 SER H H 36 8.771 8.771 8.703 0.068 25259 13667 1 18 . 1 1 37 37 ASP N N 37 126.346 126.346 124.361 1.985 25259 13668 1 18 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.302 0.152 25259 13669 1 18 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.882 -3.266 25259 13670 1 18 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.412 -2.427 25259 13671 1 18 . 1 1 37 37 ASP H H 37 8.859 8.859 8.566 0.293 25259 13672 1 18 . 1 1 38 38 ASP N N 38 119.171 119.171 119.639 -0.468 25259 13673 1 18 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.794 -0.179 25259 13674 1 18 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.099 -3.311 25259 13675 1 18 . 1 1 38 38 ASP CB C 38 37.635 37.635 42.536 -4.901 25259 13676 1 18 . 1 1 38 38 ASP H H 38 7.944 7.944 8.377 -0.433 25259 13677 1 18 . 1 1 39 39 GLY N N 39 110.352 110.352 112.302 -1.950 25259 13678 1 18 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.329 -2.568 25259 13679 1 18 . 1 1 39 39 GLY H H 39 8.145 8.145 8.301 -0.156 25259 13680 1 18 . 1 1 40 40 SER N N 40 120.090 120.090 121.142 -1.052 25259 13681 1 18 . 1 1 40 40 SER HA H 40 4.877 4.877 4.741 0.136 25259 13682 1 18 . 1 1 40 40 SER CA C 40 56.525 56.525 58.564 -2.039 25259 13683 1 18 . 1 1 40 40 SER CB C 40 62.245 62.245 63.177 -0.932 25259 13684 1 18 . 1 1 40 40 SER H H 40 8.344 8.344 8.126 0.218 25259 13685 1 18 . 1 1 41 41 GLN N N 41 122.551 122.551 126.083 -3.532 25259 13686 1 18 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.793 0.134 25259 13687 1 18 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.512 -1.098 25259 13688 1 18 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.608 -3.295 25259 13689 1 18 . 1 1 41 41 GLN H H 41 8.627 8.627 9.179 -0.552 25259 13690 1 18 . 1 1 42 42 GLN N N 42 131.724 131.724 118.829 12.895 25259 13691 1 18 . 1 1 42 42 GLN HA H 42 5.611 5.611 5.214 0.397 25259 13692 1 18 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.485 -2.413 25259 13693 1 18 . 1 1 42 42 GLN CB C 42 30.319 30.319 33.437 -3.118 25259 13694 1 18 . 1 1 42 42 GLN H H 42 9.189 9.189 8.781 0.408 25259 13695 1 18 . 1 1 43 43 THR N N 43 122.202 122.202 115.579 6.623 25259 13696 1 18 . 1 1 43 43 THR HA H 43 5.380 5.380 4.973 0.407 25259 13697 1 18 . 1 1 43 43 THR CA C 43 58.863 58.863 61.157 -2.294 25259 13698 1 18 . 1 1 43 43 THR CB C 43 68.893 68.893 72.536 -3.643 25259 13699 1 18 . 1 1 43 43 THR H H 43 9.139 9.139 8.394 0.745 25259 13700 1 18 . 1 1 44 44 GLN N N 44 127.190 127.190 122.183 5.007 25259 13701 1 18 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.065 0.569 25259 13702 1 18 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.705 -3.037 25259 13703 1 18 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.849 -3.939 25259 13704 1 18 . 1 1 44 44 GLN H H 44 9.760 9.760 8.852 0.908 25259 13705 1 18 . 1 1 45 45 THR N N 45 123.479 123.479 120.245 3.234 25259 13706 1 18 . 1 1 45 45 THR HA H 45 5.421 5.421 4.941 0.480 25259 13707 1 18 . 1 1 45 45 THR CA C 45 60.071 60.071 62.337 -2.266 25259 13708 1 18 . 1 1 45 45 THR CB C 45 67.541 67.541 70.031 -2.490 25259 13709 1 18 . 1 1 45 45 THR H H 45 9.518 9.518 9.003 0.515 25259 13710 1 18 . 1 1 46 46 ILE N N 46 133.908 133.908 125.609 8.299 25259 13711 1 18 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.857 0.146 25259 13712 1 18 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.690 -2.219 25259 13713 1 18 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.356 0.589 25259 13714 1 18 . 1 1 46 46 ILE H H 46 9.830 9.830 9.265 0.565 25259 13715 1 18 . 1 1 47 47 THR N N 47 124.701 124.701 124.218 0.483 25259 13716 1 18 . 1 1 47 47 THR HA H 47 6.048 6.048 5.200 0.848 25259 13717 1 18 . 1 1 47 47 THR CA C 47 58.551 58.551 62.138 -3.587 25259 13718 1 18 . 1 1 47 47 THR CB C 47 67.819 67.819 69.477 -1.658 25259 13719 1 18 . 1 1 47 47 THR H H 47 8.843 8.843 8.727 0.116 25259 13720 1 18 . 1 1 48 48 TYR N N 48 127.369 127.369 122.245 5.124 25259 13721 1 18 . 1 1 48 48 TYR HA H 48 5.278 5.278 4.977 0.301 25259 13722 1 18 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.558 -2.829 25259 13723 1 18 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.517 -2.086 25259 13724 1 18 . 1 1 48 48 TYR H H 48 9.638 9.638 8.874 0.764 25259 13725 1 18 . 1 1 49 49 LYS N N 49 122.138 122.138 117.887 4.251 25259 13726 1 18 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.708 -0.052 25259 13727 1 18 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.104 -3.132 25259 13728 1 18 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.791 -1.188 25259 13729 1 18 . 1 1 49 49 LYS H H 49 8.560 8.560 8.901 -0.341 25259 13730 1 18 . 1 1 50 50 ASP N N 50 130.208 130.208 120.343 9.865 25259 13731 1 18 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.771 -0.467 25259 13732 1 18 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.071 -0.311 25259 13733 1 18 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.834 -5.495 25259 13734 1 18 . 1 1 50 50 ASP H H 50 9.597 9.597 8.414 1.183 25259 13735 1 18 . 1 1 51 51 LYS N N 51 124.586 124.586 119.014 5.572 25259 13736 1 18 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.441 0.090 25259 13737 1 18 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.787 -3.053 25259 13738 1 18 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.270 -3.875 25259 13739 1 18 . 1 1 51 51 LYS H H 51 8.450 8.450 8.198 0.252 25259 13740 1 18 . 1 1 52 52 THR N N 52 120.044 120.044 112.444 7.600 25259 13741 1 18 . 1 1 52 52 THR HA H 52 4.717 4.717 4.483 0.234 25259 13742 1 18 . 1 1 52 52 THR CA C 52 59.313 59.313 59.667 -0.354 25259 13743 1 18 . 1 1 52 52 THR CB C 52 68.815 68.815 70.171 -1.356 25259 13744 1 18 . 1 1 52 52 THR H H 52 8.658 8.658 7.525 1.133 25259 13745 1 18 . 1 1 53 53 PHE N N 53 128.987 128.987 121.900 7.087 25259 13746 1 18 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.508 -0.225 25259 13747 1 18 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.062 -1.073 25259 13748 1 18 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.946 0.365 25259 13749 1 18 . 1 1 53 53 PHE H H 53 9.218 9.218 8.794 0.424 25259 13750 1 18 . 1 1 54 54 LEU N N 54 124.874 124.874 125.321 -0.447 25259 13751 1 18 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.292 0.637 25259 13752 1 18 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.070 -1.829 25259 13753 1 18 . 1 1 54 54 LEU CB C 54 40.517 40.517 41.770 -1.254 25259 13754 1 18 . 1 1 54 54 LEU H H 54 9.391 9.391 8.432 0.959 25259 13755 1 18 . 1 1 55 55 SER N N 55 115.516 115.516 107.825 7.691 25259 13756 1 18 . 1 1 55 55 SER HA H 55 5.194 5.194 5.190 0.004 25259 13757 1 18 . 1 1 55 55 SER CA C 55 55.818 55.818 57.781 -1.963 25259 13758 1 18 . 1 1 55 55 SER CB C 55 63.474 63.474 66.830 -3.356 25259 13759 1 18 . 1 1 55 55 SER H H 55 8.736 8.736 7.762 0.974 25259 13760 1 18 . 1 1 56 56 LEU N N 56 124.352 124.352 122.945 1.407 25259 13761 1 18 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.359 0.184 25259 13762 1 18 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.326 -2.689 25259 13763 1 18 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.243 -0.730 25259 13764 1 18 . 1 1 56 56 LEU H H 56 8.328 8.328 8.407 -0.079 25259 13765 1 18 . 1 1 57 57 ALA N N 57 131.450 131.450 130.885 0.565 25259 13766 1 18 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.271 0.234 25259 13767 1 18 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.029 -1.827 25259 13768 1 18 . 1 1 57 57 ALA CB C 57 18.964 18.964 20.556 -1.592 25259 13769 1 18 . 1 1 57 57 ALA H H 57 9.208 9.208 8.282 0.926 25259 13770 1 18 . 1 1 58 58 ILE N N 58 126.248 126.248 126.891 -0.643 25259 13771 1 18 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.453 0.331 25259 13772 1 18 . 1 1 58 58 ILE CA C 58 58.247 58.247 61.779 -3.531 25259 13773 1 18 . 1 1 58 58 ILE CB C 58 38.045 38.045 37.647 0.398 25259 13774 1 18 . 1 1 58 58 ILE H H 58 9.597 9.597 8.582 1.015 25259 13775 1 18 . 1 1 59 59 GLN N N 59 132.065 132.065 127.345 4.720 25259 13776 1 18 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.857 0.390 25259 13777 1 18 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.470 -3.306 25259 13778 1 18 . 1 1 59 59 GLN CB C 59 29.661 29.661 31.664 -2.003 25259 13779 1 18 . 1 1 59 59 GLN H H 59 9.389 9.389 8.946 0.443 25259 13780 1 18 . 1 1 60 60 GLN N N 60 130.314 130.314 119.783 10.531 25259 13781 1 18 . 1 1 60 60 GLN HA H 60 5.209 5.209 5.047 0.162 25259 13782 1 18 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.261 -3.240 25259 13783 1 18 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.270 -3.793 25259 13784 1 18 . 1 1 60 60 GLN H H 60 9.471 9.471 8.878 0.593 25259 13785 1 18 . 1 1 61 61 LYS N N 61 131.044 131.044 126.001 5.043 25259 13786 1 18 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.102 0.313 25259 13787 1 18 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.388 -3.268 25259 13788 1 18 . 1 1 61 61 LYS CB C 61 32.417 32.417 36.335 -3.918 25259 13789 1 18 . 1 1 61 61 LYS H H 61 8.893 8.893 9.180 -0.287 25259 13790 1 18 . 1 1 62 62 ARG N N 62 125.397 125.397 122.047 3.350 25259 13791 1 18 . 1 1 62 62 ARG HA H 62 5.003 5.003 4.931 0.072 25259 13792 1 18 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.041 -1.950 25259 13793 1 18 . 1 1 62 62 ARG CB C 62 29.878 29.878 32.515 -2.637 25259 13794 1 18 . 1 1 62 62 ARG H H 62 9.120 9.120 8.594 0.526 25259 13795 1 18 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.796 0.179 25259 13796 1 18 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.919 -3.421 25259 13797 1 18 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.392 -2.508 25259 13798 1 18 . 1 1 64 64 VAL N N 64 121.305 121.305 115.828 5.477 25259 13799 1 18 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.270 -0.246 25259 13800 1 18 . 1 1 64 64 VAL CA C 64 59.677 59.677 61.135 -1.458 25259 13801 1 18 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.981 -2.616 25259 13802 1 18 . 1 1 64 64 VAL H H 64 7.520 7.520 7.951 -0.431 25259 13803 1 18 . 1 1 65 65 SER N N 65 123.215 123.215 114.145 9.070 25259 13804 1 18 . 1 1 65 65 SER HA H 65 4.521 4.521 4.724 -0.203 25259 13805 1 18 . 1 1 65 65 SER CA C 65 54.897 54.897 57.109 -2.212 25259 13806 1 18 . 1 1 65 65 SER CB C 65 62.564 62.564 65.655 -3.091 25259 13807 1 18 . 1 1 65 65 SER H H 65 8.080 8.080 8.114 -0.034 25259 13808 1 18 . 1 1 66 66 ASP N N 66 123.802 123.802 122.995 0.807 25259 13809 1 18 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.519 -0.089 25259 13810 1 18 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.935 -1.557 25259 13811 1 18 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.810 -2.772 25259 13812 1 18 . 1 1 66 66 ASP H H 66 8.900 8.900 8.794 0.106 25259 13813 1 18 . 1 1 67 67 GLU N N 67 121.943 121.943 120.401 1.542 25259 13814 1 18 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.044 0.145 25259 13815 1 18 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.630 -2.190 25259 13816 1 18 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.418 -2.633 25259 13817 1 18 . 1 1 67 67 GLU H H 67 8.717 8.717 8.618 0.099 25259 13818 1 18 . 1 1 68 68 LEU N N 68 125.458 125.458 119.540 5.918 25259 13819 1 18 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.162 0.181 25259 13820 1 18 . 1 1 68 68 LEU CA C 68 54.472 54.472 57.705 -3.233 25259 13821 1 18 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.093 -1.690 25259 13822 1 18 . 1 1 68 68 LEU H H 68 7.820 7.820 7.996 -0.176 25259 13823 1 18 . 1 1 69 69 LYS N N 69 123.868 123.868 119.252 4.616 25259 13824 1 18 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.105 -0.099 25259 13825 1 18 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.302 -1.685 25259 13826 1 18 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.093 -2.056 25259 13827 1 18 . 1 1 69 69 LYS H H 69 8.690 8.690 7.974 0.716 25259 13828 1 18 . 1 1 70 70 THR N N 70 117.109 117.109 117.142 -0.033 25259 13829 1 18 . 1 1 70 70 THR HA H 70 4.088 4.088 4.027 0.061 25259 13830 1 18 . 1 1 70 70 THR CA C 70 63.879 63.879 67.021 -3.142 25259 13831 1 18 . 1 1 70 70 THR CB C 70 66.383 66.383 68.915 -2.531 25259 13832 1 18 . 1 1 70 70 THR H H 70 7.935 7.935 7.699 0.236 25259 13833 1 18 . 1 1 71 71 TYR N N 71 127.006 127.006 123.705 3.301 25259 13834 1 18 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.233 -0.028 25259 13835 1 18 . 1 1 71 71 TYR CA C 71 60.225 60.225 62.135 -1.910 25259 13836 1 18 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.420 -1.875 25259 13837 1 18 . 1 1 71 71 TYR H H 71 7.683 7.683 8.209 -0.526 25259 13838 1 18 . 1 1 72 72 ILE N N 72 125.064 125.064 118.540 6.524 25259 13839 1 18 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.816 -0.137 25259 13840 1 18 . 1 1 72 72 ILE CA C 72 62.895 62.895 64.870 -1.975 25259 13841 1 18 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.849 -1.573 25259 13842 1 18 . 1 1 72 72 ILE H H 72 9.083 9.083 8.893 0.191 25259 13843 1 18 . 1 1 73 73 ASP N N 73 124.900 124.900 119.940 4.960 25259 13844 1 18 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.507 -0.118 25259 13845 1 18 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.598 -1.560 25259 13846 1 18 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.979 -2.872 25259 13847 1 18 . 1 1 73 73 ASP H H 73 8.751 8.751 7.613 1.138 25259 13848 1 18 . 1 1 74 74 GLN N N 74 117.025 117.025 117.403 -0.378 25259 13849 1 18 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.028 0.110 25259 13850 1 18 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.533 -3.723 25259 13851 1 18 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.538 -1.974 25259 13852 1 18 . 1 1 74 74 GLN H H 74 7.447 7.447 8.084 -0.637 25259 13853 1 18 . 1 1 75 75 HIS N N 75 116.494 116.494 114.775 1.719 25259 13854 1 18 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.513 0.203 25259 13855 1 18 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.683 -2.617 25259 13856 1 18 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.742 -4.441 25259 13857 1 18 . 1 1 75 75 HIS H H 75 8.402 8.402 8.240 0.162 25259 13858 1 18 . 1 1 76 76 GLY N N 76 112.564 112.564 105.791 6.773 25259 13859 1 18 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.462 -2.566 25259 13860 1 18 . 1 1 76 76 GLY H H 76 9.091 9.091 7.553 1.538 25259 13861 1 18 . 1 1 77 77 VAL N N 77 124.763 124.763 122.403 2.360 25259 13862 1 18 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.726 -0.161 25259 13863 1 18 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.690 -0.739 25259 13864 1 18 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.053 -2.215 25259 13865 1 18 . 1 1 77 77 VAL H H 77 8.927 8.927 8.873 0.054 25259 13866 1 18 . 1 1 78 78 GLU N N 78 124.388 124.388 119.061 5.327 25259 13867 1 18 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.037 0.111 25259 13868 1 18 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.961 -1.645 25259 13869 1 18 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.541 -2.082 25259 13870 1 18 . 1 1 78 78 GLU H H 78 8.781 8.781 8.561 0.220 25259 13871 1 18 . 1 1 79 79 GLU N N 79 121.887 121.887 118.468 3.419 25259 13872 1 18 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.191 -0.003 25259 13873 1 18 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.669 -3.124 25259 13874 1 18 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.301 -2.268 25259 13875 1 18 . 1 1 79 79 GLU H H 79 9.231 9.231 8.095 1.136 25259 13876 1 18 . 1 1 80 80 THR N N 80 120.781 120.781 116.632 4.149 25259 13877 1 18 . 1 1 80 80 THR HA H 80 4.059 4.059 4.108 -0.049 25259 13878 1 18 . 1 1 80 80 THR CA C 80 65.487 65.487 66.799 -1.312 25259 13879 1 18 . 1 1 80 80 THR CB C 80 64.369 64.369 68.647 -4.279 25259 13880 1 18 . 1 1 80 80 THR H H 80 7.858 7.858 8.444 -0.586 25259 13881 1 18 . 1 1 81 81 GLN N N 81 125.303 125.303 121.316 3.987 25259 13882 1 18 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.977 0.067 25259 13883 1 18 . 1 1 81 81 GLN CA C 81 56.969 56.969 58.741 -1.772 25259 13884 1 18 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.311 -2.234 25259 13885 1 18 . 1 1 81 81 GLN H H 81 8.765 8.765 8.332 0.433 25259 13886 1 18 . 1 1 82 82 LYS N N 82 120.458 120.458 119.444 1.014 25259 13887 1 18 . 1 1 82 82 LYS HA H 82 4.089 4.089 4.040 0.049 25259 13888 1 18 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.936 -1.624 25259 13889 1 18 . 1 1 82 82 LYS CB C 82 30.154 30.154 32.078 -1.925 25259 13890 1 18 . 1 1 82 82 LYS H H 82 7.521 7.521 7.539 -0.018 25259 13891 1 18 . 1 1 83 83 ALA N N 83 125.234 125.234 121.608 3.626 25259 13892 1 18 . 1 1 83 83 ALA HA H 83 4.217 4.217 4.101 0.116 25259 13893 1 18 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.500 -2.058 25259 13894 1 18 . 1 1 83 83 ALA CB C 83 15.287 15.287 18.135 -2.848 25259 13895 1 18 . 1 1 83 83 ALA H H 83 7.782 7.782 8.055 -0.273 25259 13896 1 18 . 1 1 84 84 LEU N N 84 123.348 123.348 118.929 4.419 25259 13897 1 18 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.890 0.168 25259 13898 1 18 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.678 -2.179 25259 13899 1 18 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.152 -1.844 25259 13900 1 18 . 1 1 84 84 LEU H H 84 8.590 8.590 7.268 1.322 25259 13901 1 18 . 1 1 85 85 LEU N N 85 122.872 122.872 118.216 4.656 25259 13902 1 18 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.939 0.231 25259 13903 1 18 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.063 -1.667 25259 13904 1 18 . 1 1 85 85 LEU CB C 85 38.741 38.741 39.986 -1.245 25259 13905 1 18 . 1 1 85 85 LEU H H 85 7.892 7.892 7.631 0.261 25259 13906 1 18 . 1 1 86 86 GLU N N 86 122.713 122.713 118.799 3.914 25259 13907 1 18 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.992 0.093 25259 13908 1 18 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.941 -2.196 25259 13909 1 18 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.648 -2.745 25259 13910 1 18 . 1 1 86 86 GLU H H 86 8.124 8.124 7.812 0.312 25259 13911 1 18 . 1 1 87 87 ALA N N 87 123.163 123.163 121.932 1.231 25259 13912 1 18 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.151 -0.010 25259 13913 1 18 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.463 -2.195 25259 13914 1 18 . 1 1 87 87 ALA CB C 87 15.632 15.632 19.270 -3.638 25259 13915 1 18 . 1 1 87 87 ALA H H 87 7.765 7.765 7.468 0.297 25259 13916 1 18 . 1 1 88 88 GLU N N 88 121.945 121.945 119.117 2.828 25259 13917 1 18 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.058 0.026 25259 13918 1 18 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.887 -1.952 25259 13919 1 18 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.369 -1.342 25259 13920 1 18 . 1 1 88 88 GLU H H 88 7.846 7.846 8.118 -0.272 25259 13921 1 18 . 1 1 89 89 GLU N N 89 117.978 117.978 118.296 -0.318 25259 13922 1 18 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.194 -0.101 25259 13923 1 18 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.520 -3.306 25259 13924 1 18 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.292 -1.885 25259 13925 1 18 . 1 1 89 89 GLU H H 89 7.634 7.634 8.282 -0.648 25259 13926 1 18 . 1 1 90 90 LYS N N 90 117.519 117.519 117.673 -0.154 25259 13927 1 18 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.335 0.096 25259 13928 1 18 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.876 -2.858 25259 13929 1 18 . 1 1 90 90 LYS CB C 90 31.031 31.031 33.469 -2.438 25259 13930 1 18 . 1 1 90 90 LYS H H 90 7.247 7.247 7.628 -0.381 25259 13931 1 18 . 1 1 91 91 ASP N N 91 124.888 124.888 122.671 2.217 25259 13932 1 18 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.560 0.123 25259 13933 1 18 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.070 -2.871 25259 13934 1 18 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.515 -2.934 25259 13935 1 18 . 1 1 91 91 ASP H H 91 7.370 7.370 7.654 -0.284 25259 13936 1 18 . 1 1 92 92 LYS N N 92 129.311 129.311 126.781 2.530 25259 13937 1 18 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.945 0.068 25259 13938 1 18 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.735 -2.519 25259 13939 1 18 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.498 -2.483 25259 13940 1 18 . 1 1 92 92 LYS H H 92 8.795 8.795 8.853 -0.058 25259 13941 1 18 . 1 1 93 93 SER N N 93 118.112 118.112 114.401 3.711 25259 13942 1 18 . 1 1 93 93 SER HA H 93 4.439 4.439 4.226 0.213 25259 13943 1 18 . 1 1 93 93 SER CA C 93 58.945 58.945 61.704 -2.759 25259 13944 1 18 . 1 1 93 93 SER CB C 93 60.278 60.278 62.900 -2.622 25259 13945 1 18 . 1 1 93 93 SER H H 93 8.488 8.488 8.154 0.334 25259 13946 1 18 . 1 1 94 94 ILE N N 94 128.950 128.950 123.151 5.799 25259 13947 1 18 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.399 0.083 25259 13948 1 18 . 1 1 94 94 ILE CA C 94 62.349 62.349 65.032 -2.683 25259 13949 1 18 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.801 -3.048 25259 13950 1 18 . 1 1 94 94 ILE H H 94 7.722 7.722 7.350 0.372 25259 13951 1 18 . 1 1 95 95 ILE N N 95 123.598 123.598 119.892 3.706 25259 13952 1 18 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.513 0.082 25259 13953 1 18 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.478 -2.731 25259 13954 1 18 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.540 -1.568 25259 13955 1 18 . 1 1 95 95 ILE H H 95 8.378 8.378 8.125 0.253 25259 13956 1 18 . 1 1 96 96 GLU N N 96 118.317 118.317 118.657 -0.340 25259 13957 1 18 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.926 0.058 25259 13958 1 18 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.419 -2.924 25259 13959 1 18 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.191 -2.018 25259 13960 1 18 . 1 1 96 96 GLU H H 96 7.680 7.680 7.914 -0.234 25259 13961 1 18 . 1 1 97 97 ALA N N 97 124.797 124.797 121.484 3.313 25259 13962 1 18 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.852 -0.027 25259 13963 1 18 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.359 -2.062 25259 13964 1 18 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.473 -2.484 25259 13965 1 18 . 1 1 97 97 ALA H H 97 7.383 7.383 7.412 -0.029 25259 13966 1 18 . 1 1 98 98 ARG N N 98 115.469 115.469 116.093 -0.624 25259 13967 1 18 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.355 -0.049 25259 13968 1 18 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.649 -1.159 25259 13969 1 18 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.754 -1.516 25259 13970 1 18 . 1 1 98 98 ARG H H 98 8.229 8.229 8.187 0.042 25259 13971 1 18 . 1 1 99 99 LYS N N 99 120.219 120.219 118.428 1.791 25259 13972 1 18 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.103 0.155 25259 13973 1 18 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.799 -2.558 25259 13974 1 18 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.482 -1.986 25259 13975 1 18 . 1 1 99 99 LYS H H 99 7.270 7.270 7.429 -0.159 25259 13976 1 18 . 1 1 100 100 LEU N N 100 123.800 123.800 118.757 5.043 25259 13977 1 18 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.290 0.051 25259 13978 1 18 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.902 -2.823 25259 13979 1 18 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.358 -3.227 25259 13980 1 18 . 1 1 100 100 LEU H H 100 7.837 7.837 7.519 0.318 25259 13981 1 18 . 1 1 101 101 ALA N N 101 130.512 130.512 123.285 7.227 25259 13982 1 18 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.508 -0.132 25259 13983 1 18 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.895 -2.491 25259 13984 1 18 . 1 1 101 101 ALA CB C 101 15.796 15.796 19.023 -3.227 25259 13985 1 18 . 1 1 101 101 ALA H H 101 8.213 8.213 8.923 -0.710 25259 13986 1 18 . 1 1 102 102 GLY N N 102 110.659 110.659 105.182 5.477 25259 13987 1 18 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.709 -0.816 25259 13988 1 18 . 1 1 102 102 GLY H H 102 8.738 8.738 8.115 0.623 25259 13989 1 18 . 1 1 103 103 PHE N N 103 123.097 123.097 122.548 0.549 25259 13990 1 18 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.506 -0.286 25259 13991 1 18 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.077 -2.309 25259 13992 1 18 . 1 1 103 103 PHE CB C 103 40.574 40.574 41.571 -0.997 25259 13993 1 18 . 1 1 103 103 PHE H H 103 7.514 7.514 7.611 -0.097 25259 13994 1 18 . 1 1 104 104 LYS N N 104 130.652 130.652 126.801 3.851 25259 13995 1 18 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.235 -0.115 25259 13996 1 18 . 1 1 104 104 LYS CA C 104 52.979 52.979 53.917 -0.938 25259 13997 1 18 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.259 -2.022 25259 13998 1 18 . 1 1 104 104 LYS H H 104 7.473 7.473 8.629 -1.156 25259 13999 1 18 . 1 1 105 105 LEU N N 105 127.372 127.372 122.367 5.005 25259 14000 1 18 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.063 -0.067 25259 14001 1 18 . 1 1 105 105 LEU CA C 105 51.736 51.736 54.000 -2.264 25259 14002 1 18 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.220 -1.256 25259 14003 1 18 . 1 1 105 105 LEU H H 105 8.393 8.393 8.029 0.364 25259 14004 1 18 . 1 1 106 106 GLU N N 106 129.358 129.358 124.072 5.286 25259 14005 1 18 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.789 0.055 25259 14006 1 18 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.628 -1.838 25259 14007 1 18 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.788 -2.160 25259 14008 1 18 . 1 1 106 106 GLU H H 106 8.849 8.849 9.308 -0.459 25259 14009 1 18 . 1 1 107 107 THR N N 107 131.118 131.118 113.394 17.724 25259 14010 1 18 . 1 1 107 107 THR HA H 107 5.110 5.110 4.997 0.113 25259 14011 1 18 . 1 1 107 107 THR CA C 107 59.832 59.832 61.083 -1.251 25259 14012 1 18 . 1 1 107 107 THR CB C 107 66.671 66.671 71.782 -5.111 25259 14013 1 18 . 1 1 107 107 THR H H 107 9.433 9.433 8.358 1.075 25259 14014 1 18 . 1 1 108 108 LYS N N 108 129.114 129.114 123.551 5.563 25259 14015 1 18 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.812 0.012 25259 14016 1 18 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.139 -2.945 25259 14017 1 18 . 1 1 108 108 LYS CB C 108 34.388 34.388 36.234 -1.846 25259 14018 1 18 . 1 1 108 108 LYS H H 108 9.410 9.410 9.100 0.310 25259 14019 1 18 . 1 1 109 109 LEU N N 109 129.323 129.323 127.180 2.143 25259 14020 1 18 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.533 0.171 25259 14021 1 18 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.037 -1.929 25259 14022 1 18 . 1 1 109 109 LEU CB C 109 39.655 39.655 41.463 -1.808 25259 14023 1 18 . 1 1 109 109 LEU H H 109 8.862 8.862 9.451 -0.589 25259 14024 1 18 . 1 1 110 110 LEU N N 110 129.123 129.123 127.008 2.115 25259 14025 1 18 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.296 -0.073 25259 14026 1 18 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.889 -3.107 25259 14027 1 18 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.676 -2.015 25259 14028 1 18 . 1 1 110 110 LEU H H 110 8.373 8.373 8.396 -0.023 25259 14029 1 18 . 1 1 111 111 SER N N 111 114.587 114.587 110.130 4.457 25259 14030 1 18 . 1 1 111 111 SER HA H 111 4.557 4.557 4.614 -0.057 25259 14031 1 18 . 1 1 111 111 SER CA C 111 53.889 53.889 57.926 -4.037 25259 14032 1 18 . 1 1 111 111 SER CB C 111 61.830 61.830 65.180 -3.350 25259 14033 1 18 . 1 1 111 111 SER H H 111 8.400 8.400 7.480 0.920 25259 14034 1 18 . 1 1 112 112 ALA N N 112 118.269 118.269 123.364 -5.095 25259 14035 1 18 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.330 -0.021 25259 14036 1 18 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.468 -3.254 25259 14037 1 18 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.636 -2.048 25259 14038 1 18 . 1 1 112 112 ALA H H 112 8.556 8.556 8.579 -0.023 25259 14039 1 18 . 1 1 113 113 THR N N 113 102.878 102.878 102.303 0.575 25259 14040 1 18 . 1 1 113 113 THR HA H 113 4.662 4.662 4.433 0.229 25259 14041 1 18 . 1 1 113 113 THR CA C 113 58.689 58.689 61.178 -2.489 25259 14042 1 18 . 1 1 113 113 THR CB C 113 67.905 67.905 69.796 -1.891 25259 14043 1 18 . 1 1 113 113 THR H H 113 8.065 8.065 7.730 0.335 25259 14044 1 18 . 1 1 114 114 GLU N N 114 126.514 126.514 121.049 5.465 25259 14045 1 18 . 1 1 114 114 GLU HA H 114 5.014 5.014 5.149 -0.136 25259 14046 1 18 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.927 -1.920 25259 14047 1 18 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.586 -1.673 25259 14048 1 18 . 1 1 114 114 GLU H H 114 7.357 7.357 7.751 -0.394 25259 14049 1 18 . 1 1 115 115 LEU N N 115 128.058 128.058 118.433 9.625 25259 14050 1 18 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.229 -0.307 25259 14051 1 18 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.789 -1.465 25259 14052 1 18 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.395 -2.256 25259 14053 1 18 . 1 1 115 115 LEU H H 115 8.930 8.930 8.811 0.119 25259 14054 1 18 . 1 1 116 116 GLN N N 116 126.540 126.540 116.906 9.634 25259 14055 1 18 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.123 0.592 25259 14056 1 18 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.015 -2.315 25259 14057 1 18 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.072 -0.779 25259 14058 1 18 . 1 1 116 116 GLN H H 116 9.221 9.221 8.952 0.269 25259 14059 1 18 . 1 1 117 117 THR N N 117 125.213 125.213 117.610 7.603 25259 14060 1 18 . 1 1 117 117 THR HA H 117 5.353 5.353 5.122 0.231 25259 14061 1 18 . 1 1 117 117 THR CA C 117 58.926 58.926 61.056 -2.130 25259 14062 1 18 . 1 1 117 117 THR CB C 117 68.948 68.948 72.052 -3.104 25259 14063 1 18 . 1 1 117 117 THR H H 117 9.030 9.030 8.516 0.514 25259 14064 1 18 . 1 1 118 118 THR N N 118 127.799 127.799 118.726 9.073 25259 14065 1 18 . 1 1 118 118 THR HA H 118 5.527 5.527 5.090 0.437 25259 14066 1 18 . 1 1 118 118 THR CA C 118 59.201 59.201 61.508 -2.307 25259 14067 1 18 . 1 1 118 118 THR CB C 118 67.721 67.721 71.696 -3.975 25259 14068 1 18 . 1 1 118 118 THR H H 118 9.459 9.459 8.999 0.460 25259 14069 1 18 . 1 1 119 119 THR N N 119 129.258 129.258 121.970 7.288 25259 14070 1 18 . 1 1 119 119 THR HA H 119 4.885 4.885 4.676 0.209 25259 14071 1 18 . 1 1 119 119 THR CA C 119 58.463 58.463 61.233 -2.770 25259 14072 1 18 . 1 1 119 119 THR CB C 119 67.459 67.459 70.090 -2.631 25259 14073 1 18 . 1 1 119 119 THR H H 119 9.147 9.147 8.992 0.155 25259 14074 1 18 . 1 1 120 120 SER N N 120 123.389 123.389 120.550 2.839 25259 14075 1 18 . 1 1 120 120 SER HA H 120 5.328 5.328 4.788 0.540 25259 14076 1 18 . 1 1 120 120 SER CA C 120 54.386 54.386 56.305 -1.919 25259 14077 1 18 . 1 1 120 120 SER CB C 120 63.031 63.031 64.099 -1.068 25259 14078 1 18 . 1 1 120 120 SER H H 120 8.786 8.786 8.544 0.242 25259 14079 1 18 . 1 1 121 121 PHE N N 121 121.245 121.245 126.432 -5.187 25259 14080 1 18 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.948 0.164 25259 14081 1 18 . 1 1 121 121 PHE CA C 121 53.192 53.192 55.962 -2.770 25259 14082 1 18 . 1 1 121 121 PHE CB C 121 40.265 40.265 39.512 0.753 25259 14083 1 18 . 1 1 121 121 PHE H H 121 8.831 8.831 9.077 -0.246 25259 14084 1 18 . 1 1 122 122 ASP N N 122 124.765 124.765 127.137 -2.372 25259 14085 1 18 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.735 0.105 25259 14086 1 18 . 1 1 122 122 ASP CA C 122 49.837 49.837 54.180 -4.343 25259 14087 1 18 . 1 1 122 122 ASP CB C 122 38.485 38.485 39.747 -1.262 25259 14088 1 18 . 1 1 122 122 ASP H H 122 8.819 8.819 8.662 0.157 25259 14089 1 18 . 1 1 123 123 PHE N N 123 124.303 124.303 122.235 2.068 25259 14090 1 18 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.216 0.458 25259 14091 1 18 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.366 -2.568 25259 14092 1 18 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.496 -2.956 25259 14093 1 18 . 1 1 123 123 PHE H H 123 8.262 8.262 8.016 0.246 25259 14094 1 18 . 1 1 124 124 GLN N N 124 120.792 120.792 117.187 3.605 25259 14095 1 18 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.232 0.202 25259 14096 1 18 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.156 -2.073 25259 14097 1 18 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.941 -1.812 25259 14098 1 18 . 1 1 124 124 GLN H H 124 8.954 8.954 8.447 0.507 25259 14099 1 18 . 1 1 125 125 VAL N N 125 114.091 114.091 116.480 -2.389 25259 14100 1 18 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.296 0.113 25259 14101 1 18 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.535 -2.237 25259 14102 1 18 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.931 -1.359 25259 14103 1 18 . 1 1 125 125 VAL H H 125 7.026 7.026 7.836 -0.810 25259 14104 1 18 . 1 1 126 126 LEU N N 126 125.158 125.158 123.552 1.606 25259 14105 1 18 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.323 0.152 25259 14106 1 18 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.199 -2.024 25259 14107 1 18 . 1 1 126 126 LEU CB C 126 42.054 42.054 42.727 -0.673 25259 14108 1 18 . 1 1 126 126 LEU H H 126 8.106 8.106 7.963 0.143 25259 14109 1 18 . 1 1 127 127 ASP N N 127 130.026 130.026 128.821 1.205 25259 14110 1 18 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.654 0.187 25259 14111 1 18 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.825 -3.627 25259 14112 1 18 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.367 -2.678 25259 14113 1 18 . 1 1 127 127 ASP H H 127 9.129 9.129 8.911 0.218 25259 14114 1 18 . 1 1 128 128 VAL N N 128 128.833 128.833 124.517 4.316 25259 14115 1 18 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.598 -0.074 25259 14116 1 18 . 1 1 128 128 VAL CA C 128 63.668 63.668 65.921 -2.253 25259 14117 1 18 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.883 -2.388 25259 14118 1 18 . 1 1 128 128 VAL H H 128 8.288 8.288 8.257 0.031 25259 14119 1 18 . 1 1 129 129 LYS N N 129 123.914 123.914 117.895 6.019 25259 14120 1 18 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.091 -0.048 25259 14121 1 18 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.404 -1.615 25259 14122 1 18 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.919 -2.982 25259 14123 1 18 . 1 1 129 129 LYS H H 129 8.226 8.226 8.183 0.043 25259 14124 1 18 . 1 1 130 130 LYS N N 130 121.888 121.888 117.850 4.038 25259 14125 1 18 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.298 -0.213 25259 14126 1 18 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.514 -1.368 25259 14127 1 18 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.504 -3.164 25259 14128 1 18 . 1 1 130 130 LYS H H 130 7.590 7.590 7.817 -0.227 25259 14129 1 18 . 1 1 131 131 ALA N N 131 123.088 123.088 123.619 -0.531 25259 14130 1 18 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.035 -0.108 25259 14131 1 18 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.356 -2.954 25259 14132 1 18 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.348 -1.901 25259 14133 1 18 . 1 1 131 131 ALA H H 131 8.506 8.506 8.483 0.023 25259 14134 1 18 . 1 1 132 132 SER N N 132 110.456 110.456 111.045 -0.589 25259 14135 1 18 . 1 1 132 132 SER HA H 132 4.117 4.117 4.187 -0.070 25259 14136 1 18 . 1 1 132 132 SER CA C 132 58.289 58.289 59.848 -1.559 25259 14137 1 18 . 1 1 132 132 SER CB C 132 61.034 61.034 63.032 -1.998 25259 14138 1 18 . 1 1 132 132 SER H H 132 7.986 7.986 7.806 0.180 25259 14139 1 18 . 1 1 133 133 GLN N N 133 119.034 119.034 118.083 0.951 25259 14140 1 18 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.498 -0.096 25259 14141 1 18 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.745 -2.220 25259 14142 1 18 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.751 -2.517 25259 14143 1 18 . 1 1 133 133 GLN H H 133 7.233 7.233 7.492 -0.259 25259 14144 1 18 . 1 1 134 134 LEU N N 134 123.291 123.291 122.666 0.625 25259 14145 1 18 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.351 0.043 25259 14146 1 18 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.631 -2.315 25259 14147 1 18 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.089 -3.242 25259 14148 1 18 . 1 1 134 134 LEU H H 134 7.411 7.411 7.871 -0.460 25259 14149 1 18 . 1 1 135 135 GLU N N 135 128.446 128.446 125.054 3.392 25259 14150 1 18 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.991 -0.045 25259 14151 1 18 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.421 -2.037 25259 14152 1 18 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.230 -1.934 25259 14153 1 18 . 1 1 135 135 GLU H H 135 8.986 8.986 9.133 -0.147 25259 14154 1 18 . 1 1 136 136 HIS N N 136 117.593 117.593 116.445 1.148 25259 14155 1 18 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.452 -0.069 25259 14156 1 18 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.225 -1.540 25259 14157 1 18 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.757 -1.344 25259 14158 1 18 . 1 1 136 136 HIS H H 136 9.226 9.226 8.466 0.760 25259 14159 1 18 . 1 1 137 137 LEU N N 137 115.463 115.463 114.927 0.536 25259 14160 1 18 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.546 -0.039 25259 14161 1 18 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.612 -2.664 25259 14162 1 18 . 1 1 137 137 LEU CB C 137 39.807 39.807 43.106 -3.299 25259 14163 1 18 . 1 1 137 137 LEU H H 137 7.090 7.090 7.974 -0.884 25259 14164 1 18 . 1 1 138 138 LYS N N 138 124.686 124.686 120.722 3.964 25259 14165 1 18 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.050 0.119 25259 14166 1 18 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.922 -1.764 25259 14167 1 18 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.180 -2.092 25259 14168 1 18 . 1 1 138 138 LYS H H 138 7.698 7.698 8.231 -0.533 25259 14169 1 18 . 1 1 139 139 ASN N N 139 118.077 118.077 113.204 4.873 25259 14170 1 18 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.648 0.025 25259 14171 1 18 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.605 -1.823 25259 14172 1 18 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.694 -2.877 25259 14173 1 18 . 1 1 139 139 ASN H H 139 8.485 8.485 8.192 0.293 25259 14174 1 18 . 1 1 140 140 ILE N N 140 120.880 120.880 120.447 0.433 25259 14175 1 18 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.140 -0.110 25259 14176 1 18 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.448 -1.882 25259 14177 1 18 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.409 -2.635 25259 14178 1 18 . 1 1 140 140 ILE H H 140 7.549 7.549 7.522 0.027 25259 14179 1 18 . 1 1 141 141 GLY N N 141 110.676 110.676 111.671 -0.995 25259 14180 1 18 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.766 -0.102 25259 14181 1 18 . 1 1 141 141 GLY H H 141 7.663 7.663 8.481 -0.818 25259 14182 1 18 . 1 1 142 142 LEU N N 142 123.857 123.857 121.179 2.678 25259 14183 1 18 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.871 -0.178 25259 14184 1 18 . 1 1 142 142 LEU CA C 142 55.193 55.193 56.769 -1.576 25259 14185 1 18 . 1 1 142 142 LEU CB C 142 40.609 40.609 42.050 -1.441 25259 14186 1 18 . 1 1 142 142 LEU H H 142 8.496 8.496 7.363 1.133 25259 14187 1 18 . 1 1 143 143 GLU N N 143 118.407 118.407 116.463 1.944 25259 14188 1 18 . 1 1 143 143 GLU HA H 143 3.786 3.786 4.039 -0.253 25259 14189 1 18 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.303 -1.081 25259 14190 1 18 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.195 -2.682 25259 14191 1 18 . 1 1 143 143 GLU H H 143 8.672 8.672 8.445 0.227 25259 14192 1 18 . 1 1 144 144 ASN N N 144 118.477 118.477 116.562 1.915 25259 14193 1 18 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.703 -0.261 25259 14194 1 18 . 1 1 144 144 ASN CA C 144 52.712 52.712 53.730 -1.018 25259 14195 1 18 . 1 1 144 144 ASN CB C 144 35.955 35.955 39.904 -3.949 25259 14196 1 18 . 1 1 144 144 ASN H H 144 7.656 7.656 7.782 -0.126 25259 14197 1 18 . 1 1 145 145 LEU N N 145 125.354 125.354 122.479 2.875 25259 14198 1 18 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.682 0.115 25259 14199 1 18 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.674 -1.351 25259 14200 1 18 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.279 -2.706 25259 14201 1 18 . 1 1 145 145 LEU H H 145 7.758 7.758 7.700 0.058 25259 14202 1 18 . 1 1 146 146 LEU N N 146 116.372 116.372 116.832 -0.460 25259 14203 1 18 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.910 -0.034 25259 14204 1 18 . 1 1 146 146 LEU CA C 146 53.243 53.243 54.442 -1.199 25259 14205 1 18 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.314 -1.417 25259 14206 1 18 . 1 1 146 146 LEU H H 146 7.242 7.242 7.893 -0.651 25259 14207 1 18 . 1 1 147 147 LYS N N 147 120.054 120.054 119.346 0.708 25259 14208 1 18 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.416 -0.104 25259 14209 1 18 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.772 -1.149 25259 14210 1 18 . 1 1 147 147 LYS CB C 147 30.260 30.260 33.966 -3.706 25259 14211 1 18 . 1 1 147 147 LYS H H 147 7.185 7.185 8.158 -0.973 25259 14212 1 18 . 1 1 148 148 ASN N N 148 119.498 119.498 118.295 1.203 25259 14213 1 18 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.896 0.066 25259 14214 1 18 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.075 -2.300 25259 14215 1 18 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.881 -1.395 25259 14216 1 18 . 1 1 148 148 ASN H H 148 7.698 7.698 7.656 0.042 25259 14217 1 18 . 1 1 149 149 GLU N N 149 122.834 122.834 117.512 5.322 25259 14218 1 18 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.747 -0.146 25259 14219 1 18 . 1 1 149 149 GLU CA C 149 52.219 52.219 53.699 -1.480 25259 14220 1 18 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.282 -2.472 25259 14221 1 18 . 1 1 149 149 GLU H H 149 8.767 8.767 8.620 0.147 25259 14222 1 18 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.800 0.808 25259 14223 1 18 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.229 -0.987 25259 14224 1 18 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.036 -2.941 25259 14225 1 18 . 1 1 151 151 SER N N 151 112.839 112.839 110.865 1.974 25259 14226 1 18 . 1 1 151 151 SER HA H 151 3.835 3.835 4.430 -0.595 25259 14227 1 18 . 1 1 151 151 SER CA C 151 59.270 59.270 58.107 1.163 25259 14228 1 18 . 1 1 151 151 SER CB C 151 59.451 59.451 63.072 -3.621 25259 14229 1 18 . 1 1 151 151 SER H H 151 8.519 8.519 7.937 0.582 25259 14230 1 18 . 1 1 152 152 LYS N N 152 126.710 126.710 123.533 3.177 25259 14231 1 18 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.087 0.161 25259 14232 1 18 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.189 -3.424 25259 14233 1 18 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.468 -2.211 25259 14234 1 18 . 1 1 152 152 LYS H H 152 7.006 7.006 7.492 -0.486 25259 14235 1 18 . 1 1 153 153 TYR N N 153 123.239 123.239 117.188 6.051 25259 14236 1 18 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.434 -0.176 25259 14237 1 18 . 1 1 153 153 TYR CA C 153 59.309 59.309 57.810 1.498 25259 14238 1 18 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.349 -1.015 25259 14239 1 18 . 1 1 153 153 TYR H H 153 8.058 8.058 7.940 0.118 25259 14240 1 18 . 1 1 154 154 ILE N N 154 120.253 120.253 120.676 -0.423 25259 14241 1 18 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.206 0.167 25259 14242 1 18 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.153 -2.039 25259 14243 1 18 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.176 -1.228 25259 14244 1 18 . 1 1 154 154 ILE H H 154 8.193 8.193 8.058 0.135 25259 14245 1 18 . 1 1 155 155 SER N N 155 117.178 117.178 114.704 2.474 25259 14246 1 18 . 1 1 155 155 SER HA H 155 4.091 4.091 4.057 0.034 25259 14247 1 18 . 1 1 155 155 SER CA C 155 59.961 59.961 62.010 -2.049 25259 14248 1 18 . 1 1 155 155 SER CB C 155 60.148 60.148 62.822 -2.675 25259 14249 1 18 . 1 1 155 155 SER H H 155 8.020 8.020 8.238 -0.218 25259 14250 1 18 . 1 1 156 156 ASP N N 156 125.479 125.479 121.380 4.099 25259 14251 1 18 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.590 -0.163 25259 14252 1 18 . 1 1 156 156 ASP CA C 156 54.760 54.760 55.604 -0.844 25259 14253 1 18 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.080 -3.207 25259 14254 1 18 . 1 1 156 156 ASP H H 156 8.638 8.638 7.792 0.846 25259 14255 1 18 . 1 1 157 157 ARG N N 157 121.542 121.542 118.946 2.596 25259 14256 1 18 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.956 0.155 25259 14257 1 18 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.217 -2.289 25259 14258 1 18 . 1 1 157 157 ARG CB C 157 27.816 27.816 30.066 -2.250 25259 14259 1 18 . 1 1 157 157 ARG H H 157 7.888 7.888 7.971 -0.083 25259 14260 1 18 . 1 1 158 158 LEU N N 158 124.257 124.257 120.441 3.816 25259 14261 1 18 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.282 -0.011 25259 14262 1 18 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.112 -2.899 25259 14263 1 18 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.993 -2.048 25259 14264 1 18 . 1 1 158 158 LEU H H 158 8.442 8.442 8.378 0.064 25259 14265 1 18 . 1 1 159 159 ALA N N 159 124.146 124.146 118.207 5.939 25259 14266 1 18 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.190 0.142 25259 14267 1 18 . 1 1 159 159 ALA CA C 159 51.432 51.432 52.930 -1.498 25259 14268 1 18 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.459 -2.552 25259 14269 1 18 . 1 1 159 159 ALA H H 159 8.086 8.086 7.596 0.490 25259 14270 1 18 . 1 1 160 160 ASN N N 160 118.093 118.093 117.570 0.523 25259 14271 1 18 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.834 0.158 25259 14272 1 18 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.583 -2.006 25259 14273 1 18 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.029 -1.296 25259 14274 1 18 . 1 1 160 160 ASN H H 160 7.445 7.445 7.630 -0.185 25259 14275 1 18 . 1 1 161 161 GLY N N 161 108.365 108.365 107.551 0.814 25259 14276 1 18 . 1 1 161 161 GLY CA C 161 43.646 43.646 46.077 -2.431 25259 14277 1 18 . 1 1 161 161 GLY H H 161 7.743 7.743 8.189 -0.446 25259 14278 1 18 . 1 1 162 162 ALA N N 162 123.928 123.928 120.967 2.961 25259 14279 1 18 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.017 -0.144 25259 14280 1 18 . 1 1 162 162 ALA CA C 162 49.526 49.526 50.958 -1.432 25259 14281 1 18 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.910 -3.850 25259 14282 1 18 . 1 1 162 162 ALA H H 162 8.035 8.035 7.554 0.481 25259 14283 1 18 . 1 1 163 163 THR N N 163 113.286 113.286 112.184 1.102 25259 14284 1 18 . 1 1 163 163 THR HA H 163 4.703 4.703 4.673 0.030 25259 14285 1 18 . 1 1 163 163 THR CA C 163 57.791 57.791 60.769 -2.978 25259 14286 1 18 . 1 1 163 163 THR CB C 163 68.974 68.974 71.566 -2.592 25259 14287 1 18 . 1 1 163 163 THR H H 163 8.451 8.451 8.692 -0.241 25259 14288 1 18 . 1 1 164 164 GLU N N 164 125.905 125.905 119.909 5.996 25259 14289 1 18 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.958 0.102 25259 14290 1 18 . 1 1 164 164 GLU CA C 164 53.585 53.585 54.243 -0.658 25259 14291 1 18 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.655 -3.444 25259 14292 1 18 . 1 1 164 164 GLU H H 164 8.716 8.716 8.454 0.262 25259 14293 1 19 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.102 -0.427 25259 14294 1 19 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.706 -2.898 25259 14295 1 19 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.246 -3.176 25259 14296 1 19 . 1 1 3 3 ALA N N 3 126.741 126.741 122.454 4.287 25259 14297 1 19 . 1 1 3 3 ALA HA H 3 4.494 4.494 5.013 -0.519 25259 14298 1 19 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.695 -1.493 25259 14299 1 19 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.401 -4.583 25259 14300 1 19 . 1 1 3 3 ALA H H 3 8.440 8.440 8.872 -0.432 25259 14301 1 19 . 1 1 4 4 THR N N 4 116.015 116.015 112.922 3.093 25259 14302 1 19 . 1 1 4 4 THR HA H 4 4.393 4.393 4.721 -0.328 25259 14303 1 19 . 1 1 4 4 THR CA C 4 59.148 59.148 61.588 -2.440 25259 14304 1 19 . 1 1 4 4 THR CB C 4 67.580 67.580 70.197 -2.617 25259 14305 1 19 . 1 1 4 4 THR H H 4 8.050 8.050 8.384 -0.334 25259 14306 1 19 . 1 1 5 5 LYS N N 5 126.350 126.350 120.592 5.758 25259 14307 1 19 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.605 -0.100 25259 14308 1 19 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.624 -1.707 25259 14309 1 19 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.016 -3.332 25259 14310 1 19 . 1 1 5 5 LYS H H 5 8.332 8.332 8.401 -0.069 25259 14311 1 19 . 1 1 6 6 THR N N 6 118.124 118.124 113.955 4.169 25259 14312 1 19 . 1 1 6 6 THR HA H 6 4.440 4.440 4.565 -0.125 25259 14313 1 19 . 1 1 6 6 THR CA C 6 59.282 59.282 61.967 -2.685 25259 14314 1 19 . 1 1 6 6 THR CB C 6 67.685 67.685 69.545 -1.860 25259 14315 1 19 . 1 1 6 6 THR H H 6 8.283 8.283 8.277 0.006 25259 14316 1 19 . 1 1 7 7 GLU N N 7 125.934 125.934 123.608 2.326 25259 14317 1 19 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.350 -0.006 25259 14318 1 19 . 1 1 7 7 GLU CA C 7 54.181 54.181 56.363 -2.182 25259 14319 1 19 . 1 1 7 7 GLU CB C 7 27.816 27.816 30.313 -2.497 25259 14320 1 19 . 1 1 7 7 GLU H H 7 8.487 8.487 8.393 0.094 25259 14321 1 19 . 1 1 8 8 LYS N N 8 123.945 123.945 119.221 4.724 25259 14322 1 19 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.353 -1.418 25259 14323 1 19 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.495 -3.930 25259 14324 1 19 . 1 1 8 8 LYS H H 8 8.278 8.278 8.495 -0.217 25259 14325 1 19 . 1 1 9 9 ASP N N 9 123.624 123.624 120.815 2.809 25259 14326 1 19 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.797 -0.458 25259 14327 1 19 . 1 1 9 9 ASP CA C 9 52.123 52.123 54.776 -2.653 25259 14328 1 19 . 1 1 9 9 ASP CB C 9 38.933 38.933 41.613 -2.680 25259 14329 1 19 . 1 1 9 9 ASP H H 9 8.277 8.277 8.628 -0.351 25259 14330 1 19 . 1 1 10 10 THR N N 10 116.812 116.812 116.916 -0.104 25259 14331 1 19 . 1 1 10 10 THR HA H 10 4.349 4.349 4.445 -0.096 25259 14332 1 19 . 1 1 10 10 THR CA C 10 59.634 59.634 61.830 -2.196 25259 14333 1 19 . 1 1 10 10 THR CB C 10 67.254 67.254 69.732 -2.478 25259 14334 1 19 . 1 1 10 10 THR H H 10 8.049 8.049 8.400 -0.351 25259 14335 1 19 . 1 1 11 11 LEU N N 11 126.610 126.610 125.582 1.028 25259 14336 1 19 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.203 0.189 25259 14337 1 19 . 1 1 11 11 LEU CA C 11 53.078 53.078 56.559 -3.481 25259 14338 1 19 . 1 1 11 11 LEU CB C 11 39.633 39.633 42.604 -2.971 25259 14339 1 19 . 1 1 11 11 LEU H H 11 8.191 8.191 8.963 -0.772 25259 14340 1 19 . 1 1 12 12 GLN N N 12 123.274 123.274 120.007 3.267 25259 14341 1 19 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.849 -0.467 25259 14342 1 19 . 1 1 12 12 GLN CA C 12 53.574 53.574 54.932 -1.358 25259 14343 1 19 . 1 1 12 12 GLN CB C 12 26.803 26.803 31.080 -4.277 25259 14344 1 19 . 1 1 12 12 GLN H H 12 8.280 8.280 8.578 -0.298 25259 14345 1 19 . 1 1 13 13 SER N N 13 119.027 119.027 115.043 3.984 25259 14346 1 19 . 1 1 13 13 SER HA H 13 4.471 4.471 4.988 -0.517 25259 14347 1 19 . 1 1 13 13 SER CA C 13 55.869 55.869 57.735 -1.866 25259 14348 1 19 . 1 1 13 13 SER CB C 13 61.424 61.424 64.935 -3.511 25259 14349 1 19 . 1 1 13 13 SER H H 13 8.178 8.178 8.690 -0.512 25259 14350 1 19 . 1 1 14 14 ALA N N 14 128.314 128.314 124.385 3.929 25259 14351 1 19 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.794 -0.360 25259 14352 1 19 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.605 -1.909 25259 14353 1 19 . 1 1 14 14 ALA CB C 14 17.081 17.081 18.972 -1.891 25259 14354 1 19 . 1 1 14 14 ALA H H 14 8.195 8.195 8.721 -0.526 25259 14355 1 19 . 1 1 15 15 LEU N N 15 125.175 125.175 121.126 4.049 25259 14356 1 19 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.813 -0.173 25259 14357 1 19 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.345 -2.741 25259 14358 1 19 . 1 1 15 15 LEU CB C 15 39.467 39.467 41.331 -1.863 25259 14359 1 19 . 1 1 15 15 LEU H H 15 8.050 8.050 8.600 -0.550 25259 14360 1 19 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.739 -0.235 25259 14361 1 19 . 1 1 16 16 PRO CA C 16 60.631 60.631 63.034 -2.403 25259 14362 1 19 . 1 1 16 16 PRO CB C 16 29.658 29.658 33.212 -3.554 25259 14363 1 19 . 1 1 17 17 VAL N N 17 123.223 123.223 120.989 2.234 25259 14364 1 19 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.533 -0.399 25259 14365 1 19 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.801 -1.974 25259 14366 1 19 . 1 1 17 17 VAL CB C 17 30.377 30.377 33.791 -3.413 25259 14367 1 19 . 1 1 17 17 VAL H H 17 8.134 8.134 8.419 -0.285 25259 14368 1 19 . 1 1 18 18 ILE N N 18 127.777 127.777 122.492 5.285 25259 14369 1 19 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.711 -0.468 25259 14370 1 19 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.929 -2.607 25259 14371 1 19 . 1 1 18 18 ILE CB C 18 36.254 36.254 40.329 -4.075 25259 14372 1 19 . 1 1 18 18 ILE H H 18 8.187 8.187 8.685 -0.498 25259 14373 1 19 . 1 1 19 19 GLU N N 19 128.148 128.148 123.233 4.915 25259 14374 1 19 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.940 -0.603 25259 14375 1 19 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.327 -1.236 25259 14376 1 19 . 1 1 19 19 GLU CB C 19 28.176 28.176 32.794 -4.618 25259 14377 1 19 . 1 1 19 19 GLU H H 19 8.475 8.475 8.728 -0.253 25259 14378 1 19 . 1 1 20 20 ASN N N 20 122.788 122.788 117.903 4.885 25259 14379 1 19 . 1 1 20 20 ASN HA H 20 4.695 4.695 5.382 -0.687 25259 14380 1 19 . 1 1 20 20 ASN CA C 20 50.822 50.822 52.757 -1.935 25259 14381 1 19 . 1 1 20 20 ASN CB C 20 36.366 36.366 41.014 -4.649 25259 14382 1 19 . 1 1 20 20 ASN H H 20 8.477 8.477 8.967 -0.490 25259 14383 1 19 . 1 1 21 21 ALA N N 21 127.253 127.253 123.760 3.493 25259 14384 1 19 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.512 -0.191 25259 14385 1 19 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.671 -0.983 25259 14386 1 19 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.700 -3.787 25259 14387 1 19 . 1 1 21 21 ALA H H 21 8.325 8.325 8.419 -0.094 25259 14388 1 19 . 1 1 22 22 GLU N N 22 122.044 122.044 120.323 1.721 25259 14389 1 19 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.184 0.109 25259 14390 1 19 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.957 -2.374 25259 14391 1 19 . 1 1 22 22 GLU CB C 22 27.285 27.285 29.471 -2.186 25259 14392 1 19 . 1 1 22 22 GLU H H 22 8.415 8.415 8.417 -0.002 25259 14393 1 19 . 1 1 23 23 LYS N N 23 123.622 123.622 124.167 -0.545 25259 14394 1 19 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.528 -0.203 25259 14395 1 19 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.693 -1.197 25259 14396 1 19 . 1 1 23 23 LYS CB C 23 30.653 30.653 34.649 -3.996 25259 14397 1 19 . 1 1 23 23 LYS H H 23 8.127 8.127 7.851 0.276 25259 14398 1 19 . 1 1 24 24 ASN N N 24 120.652 120.652 123.583 -2.931 25259 14399 1 19 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.658 0.183 25259 14400 1 19 . 1 1 24 24 ASN CA C 24 50.663 50.663 54.037 -3.374 25259 14401 1 19 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.148 -2.373 25259 14402 1 19 . 1 1 24 24 ASN H H 24 8.424 8.424 8.608 -0.184 25259 14403 1 19 . 1 1 25 25 THR N N 25 117.102 117.102 116.291 0.811 25259 14404 1 19 . 1 1 25 25 THR HA H 25 4.367 4.367 4.368 -0.001 25259 14405 1 19 . 1 1 25 25 THR CA C 25 59.500 59.500 60.837 -1.337 25259 14406 1 19 . 1 1 25 25 THR CB C 25 67.610 67.610 70.352 -2.742 25259 14407 1 19 . 1 1 25 25 THR H H 25 7.852 7.852 7.904 -0.052 25259 14408 1 19 . 1 1 26 26 VAL N N 26 126.491 126.491 124.726 1.765 25259 14409 1 19 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.295 -0.128 25259 14410 1 19 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.923 -1.730 25259 14411 1 19 . 1 1 26 26 VAL CB C 26 29.605 29.605 32.539 -2.934 25259 14412 1 19 . 1 1 26 26 VAL H H 26 8.080 8.080 8.274 -0.194 25259 14413 1 19 . 1 1 27 27 VAL N N 27 132.992 132.992 125.117 7.875 25259 14414 1 19 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.569 -0.488 25259 14415 1 19 . 1 1 27 27 VAL CA C 27 58.984 58.984 59.910 -0.926 25259 14416 1 19 . 1 1 27 27 VAL CB C 27 31.540 31.540 33.870 -2.330 25259 14417 1 19 . 1 1 27 27 VAL H H 27 8.830 8.830 8.810 0.020 25259 14418 1 19 . 1 1 28 28 THR N N 28 123.576 123.576 115.745 7.831 25259 14419 1 19 . 1 1 28 28 THR HA H 28 5.553 5.553 4.808 0.745 25259 14420 1 19 . 1 1 28 28 THR CA C 28 58.738 58.738 61.885 -3.147 25259 14421 1 19 . 1 1 28 28 THR CB C 28 68.443 68.443 69.784 -1.341 25259 14422 1 19 . 1 1 28 28 THR H H 28 8.165 8.165 8.109 0.056 25259 14423 1 19 . 1 1 29 29 LYS N N 29 129.099 129.099 127.776 1.323 25259 14424 1 19 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.447 0.495 25259 14425 1 19 . 1 1 29 29 LYS CA C 29 51.779 51.779 56.223 -4.444 25259 14426 1 19 . 1 1 29 29 LYS CB C 29 35.096 35.096 34.522 0.574 25259 14427 1 19 . 1 1 29 29 LYS H H 29 9.273 9.273 8.889 0.384 25259 14428 1 19 . 1 1 30 30 THR N N 30 123.510 123.510 119.692 3.818 25259 14429 1 19 . 1 1 30 30 THR HA H 30 5.428 5.428 5.141 0.287 25259 14430 1 19 . 1 1 30 30 THR CA C 30 59.784 59.784 62.002 -2.217 25259 14431 1 19 . 1 1 30 30 THR CB C 30 67.818 67.818 70.316 -2.498 25259 14432 1 19 . 1 1 30 30 THR H H 30 8.993 8.993 8.391 0.602 25259 14433 1 19 . 1 1 31 31 LEU N N 31 128.293 128.293 126.786 1.507 25259 14434 1 19 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.956 0.264 25259 14435 1 19 . 1 1 31 31 LEU CA C 31 50.055 50.055 52.706 -2.651 25259 14436 1 19 . 1 1 31 31 LEU CB C 31 43.399 43.399 42.638 0.761 25259 14437 1 19 . 1 1 31 31 LEU H H 31 9.557 9.557 9.013 0.544 25259 14438 1 19 . 1 1 32 32 VAL N N 32 126.919 126.919 125.914 1.005 25259 14439 1 19 . 1 1 32 32 VAL HA H 32 4.451 4.451 3.924 0.527 25259 14440 1 19 . 1 1 32 32 VAL CA C 32 59.664 59.664 62.742 -3.078 25259 14441 1 19 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.956 -1.507 25259 14442 1 19 . 1 1 32 32 VAL H H 32 9.364 9.364 8.832 0.532 25259 14443 1 19 . 1 1 33 33 LEU N N 33 133.503 133.503 129.804 3.699 25259 14444 1 19 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.626 -0.070 25259 14445 1 19 . 1 1 33 33 LEU CA C 33 52.004 52.004 51.944 0.060 25259 14446 1 19 . 1 1 33 33 LEU CB C 33 36.847 36.847 40.835 -3.988 25259 14447 1 19 . 1 1 33 33 LEU H H 33 8.587 8.587 7.956 0.631 25259 14448 1 19 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.471 0.010 25259 14449 1 19 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.238 -1.793 25259 14450 1 19 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.196 -2.631 25259 14451 1 19 . 1 1 35 35 LYS N N 35 127.420 127.420 116.860 10.560 25259 14452 1 19 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.311 0.055 25259 14453 1 19 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.055 -1.936 25259 14454 1 19 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.681 -2.087 25259 14455 1 19 . 1 1 35 35 LYS H H 35 8.666 8.666 8.193 0.473 25259 14456 1 19 . 1 1 36 36 SER N N 36 122.222 122.222 117.101 5.121 25259 14457 1 19 . 1 1 36 36 SER HA H 36 4.753 4.753 4.575 0.178 25259 14458 1 19 . 1 1 36 36 SER CA C 36 55.328 55.328 57.470 -2.142 25259 14459 1 19 . 1 1 36 36 SER CB C 36 61.728 61.728 61.825 -0.097 25259 14460 1 19 . 1 1 36 36 SER H H 36 8.771 8.771 8.690 0.081 25259 14461 1 19 . 1 1 37 37 ASP N N 37 126.346 126.346 122.355 3.991 25259 14462 1 19 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.325 0.129 25259 14463 1 19 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.191 -2.575 25259 14464 1 19 . 1 1 37 37 ASP CB C 37 37.985 37.985 39.830 -1.845 25259 14465 1 19 . 1 1 37 37 ASP H H 37 8.859 8.859 8.114 0.745 25259 14466 1 19 . 1 1 38 38 ASP N N 38 119.171 119.171 121.691 -2.520 25259 14467 1 19 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.532 0.083 25259 14468 1 19 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.981 -4.193 25259 14469 1 19 . 1 1 38 38 ASP CB C 38 37.635 37.635 40.568 -2.933 25259 14470 1 19 . 1 1 38 38 ASP H H 38 7.944 7.944 8.349 -0.405 25259 14471 1 19 . 1 1 39 39 GLY N N 39 110.352 110.352 106.449 3.903 25259 14472 1 19 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.620 -2.859 25259 14473 1 19 . 1 1 39 39 GLY H H 39 8.145 8.145 7.735 0.410 25259 14474 1 19 . 1 1 40 40 SER N N 40 120.090 120.090 115.400 4.690 25259 14475 1 19 . 1 1 40 40 SER HA H 40 4.877 4.877 4.817 0.060 25259 14476 1 19 . 1 1 40 40 SER CA C 40 56.525 56.525 58.427 -1.902 25259 14477 1 19 . 1 1 40 40 SER CB C 40 62.245 62.245 64.099 -1.854 25259 14478 1 19 . 1 1 40 40 SER H H 40 8.344 8.344 7.737 0.607 25259 14479 1 19 . 1 1 41 41 GLN N N 41 122.551 122.551 121.970 0.581 25259 14480 1 19 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.721 0.206 25259 14481 1 19 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.738 -1.324 25259 14482 1 19 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.355 -3.042 25259 14483 1 19 . 1 1 41 41 GLN H H 41 8.627 8.627 9.058 -0.431 25259 14484 1 19 . 1 1 42 42 GLN N N 42 131.724 131.724 121.270 10.454 25259 14485 1 19 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.991 0.620 25259 14486 1 19 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.031 -1.959 25259 14487 1 19 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.945 -2.626 25259 14488 1 19 . 1 1 42 42 GLN H H 42 9.189 9.189 8.606 0.583 25259 14489 1 19 . 1 1 43 43 THR N N 43 122.202 122.202 115.936 6.266 25259 14490 1 19 . 1 1 43 43 THR HA H 43 5.380 5.380 5.302 0.078 25259 14491 1 19 . 1 1 43 43 THR CA C 43 58.863 58.863 60.731 -1.868 25259 14492 1 19 . 1 1 43 43 THR CB C 43 68.893 68.893 72.414 -3.521 25259 14493 1 19 . 1 1 43 43 THR H H 43 9.139 9.139 8.571 0.568 25259 14494 1 19 . 1 1 44 44 GLN N N 44 127.190 127.190 121.433 5.757 25259 14495 1 19 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.144 0.490 25259 14496 1 19 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.755 -3.087 25259 14497 1 19 . 1 1 44 44 GLN CB C 44 28.910 28.910 33.283 -4.373 25259 14498 1 19 . 1 1 44 44 GLN H H 44 9.760 9.760 8.599 1.161 25259 14499 1 19 . 1 1 45 45 THR N N 45 123.479 123.479 121.349 2.130 25259 14500 1 19 . 1 1 45 45 THR HA H 45 5.421 5.421 5.093 0.328 25259 14501 1 19 . 1 1 45 45 THR CA C 45 60.071 60.071 62.428 -2.357 25259 14502 1 19 . 1 1 45 45 THR CB C 45 67.541 67.541 69.719 -2.178 25259 14503 1 19 . 1 1 45 45 THR H H 45 9.518 9.518 8.727 0.791 25259 14504 1 19 . 1 1 46 46 ILE N N 46 133.908 133.908 128.762 5.146 25259 14505 1 19 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.879 0.124 25259 14506 1 19 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.781 -2.310 25259 14507 1 19 . 1 1 46 46 ILE CB C 46 39.945 39.945 39.542 0.403 25259 14508 1 19 . 1 1 46 46 ILE H H 46 9.830 9.830 9.445 0.385 25259 14509 1 19 . 1 1 47 47 THR N N 47 124.701 124.701 125.351 -0.650 25259 14510 1 19 . 1 1 47 47 THR HA H 47 6.048 6.048 4.982 1.066 25259 14511 1 19 . 1 1 47 47 THR CA C 47 58.551 58.551 62.918 -4.367 25259 14512 1 19 . 1 1 47 47 THR CB C 47 67.819 67.819 69.197 -1.377 25259 14513 1 19 . 1 1 47 47 THR H H 47 8.843 8.843 8.924 -0.081 25259 14514 1 19 . 1 1 48 48 TYR N N 48 127.369 127.369 122.602 4.767 25259 14515 1 19 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.171 0.107 25259 14516 1 19 . 1 1 48 48 TYR CA C 48 53.729 53.729 55.761 -2.033 25259 14517 1 19 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.432 -2.000 25259 14518 1 19 . 1 1 48 48 TYR H H 48 9.638 9.638 8.063 1.575 25259 14519 1 19 . 1 1 49 49 LYS N N 49 122.138 122.138 118.688 3.450 25259 14520 1 19 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.571 0.085 25259 14521 1 19 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.270 -3.297 25259 14522 1 19 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.609 -1.006 25259 14523 1 19 . 1 1 49 49 LYS H H 49 8.560 8.560 8.759 -0.199 25259 14524 1 19 . 1 1 50 50 ASP N N 50 130.208 130.208 121.776 8.432 25259 14525 1 19 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.804 -0.500 25259 14526 1 19 . 1 1 50 50 ASP CA C 50 54.760 54.760 54.730 0.030 25259 14527 1 19 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.556 -5.218 25259 14528 1 19 . 1 1 50 50 ASP H H 50 9.597 9.597 8.451 1.146 25259 14529 1 19 . 1 1 51 51 LYS N N 51 124.586 124.586 118.393 6.193 25259 14530 1 19 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.525 0.006 25259 14531 1 19 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.698 -2.964 25259 14532 1 19 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.669 -4.274 25259 14533 1 19 . 1 1 51 51 LYS H H 51 8.450 8.450 8.195 0.255 25259 14534 1 19 . 1 1 52 52 THR N N 52 120.044 120.044 114.440 5.604 25259 14535 1 19 . 1 1 52 52 THR HA H 52 4.717 4.717 4.444 0.273 25259 14536 1 19 . 1 1 52 52 THR CA C 52 59.313 59.313 60.211 -0.898 25259 14537 1 19 . 1 1 52 52 THR CB C 52 68.815 68.815 71.356 -2.541 25259 14538 1 19 . 1 1 52 52 THR H H 52 8.658 8.658 7.557 1.101 25259 14539 1 19 . 1 1 53 53 PHE N N 53 128.987 128.987 122.227 6.760 25259 14540 1 19 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.397 -0.114 25259 14541 1 19 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.325 -1.335 25259 14542 1 19 . 1 1 53 53 PHE CB C 53 38.311 38.311 38.019 0.292 25259 14543 1 19 . 1 1 53 53 PHE H H 53 9.218 9.218 8.521 0.697 25259 14544 1 19 . 1 1 54 54 LEU N N 54 124.874 124.874 124.514 0.360 25259 14545 1 19 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.599 0.330 25259 14546 1 19 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.247 -2.006 25259 14547 1 19 . 1 1 54 54 LEU CB C 54 40.517 40.517 43.358 -2.841 25259 14548 1 19 . 1 1 54 54 LEU H H 54 9.391 9.391 9.072 0.319 25259 14549 1 19 . 1 1 55 55 SER N N 55 115.516 115.516 110.928 4.588 25259 14550 1 19 . 1 1 55 55 SER HA H 55 5.194 5.194 5.278 -0.084 25259 14551 1 19 . 1 1 55 55 SER CA C 55 55.818 55.818 57.866 -2.048 25259 14552 1 19 . 1 1 55 55 SER CB C 55 63.474 63.474 67.072 -3.598 25259 14553 1 19 . 1 1 55 55 SER H H 55 8.736 8.736 8.037 0.699 25259 14554 1 19 . 1 1 56 56 LEU N N 56 124.352 124.352 122.822 1.530 25259 14555 1 19 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.731 -0.188 25259 14556 1 19 . 1 1 56 56 LEU CA C 56 51.637 51.637 52.801 -1.164 25259 14557 1 19 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.854 -1.341 25259 14558 1 19 . 1 1 56 56 LEU H H 56 8.328 8.328 8.726 -0.398 25259 14559 1 19 . 1 1 57 57 ALA N N 57 131.450 131.450 125.039 6.411 25259 14560 1 19 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.369 0.136 25259 14561 1 19 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.483 -2.281 25259 14562 1 19 . 1 1 57 57 ALA CB C 57 18.964 18.964 22.654 -3.690 25259 14563 1 19 . 1 1 57 57 ALA H H 57 9.208 9.208 8.374 0.834 25259 14564 1 19 . 1 1 58 58 ILE N N 58 126.248 126.248 121.007 5.241 25259 14565 1 19 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.745 0.039 25259 14566 1 19 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.293 -2.046 25259 14567 1 19 . 1 1 58 58 ILE CB C 58 38.045 38.045 39.913 -1.867 25259 14568 1 19 . 1 1 58 58 ILE H H 58 9.597 9.597 8.875 0.722 25259 14569 1 19 . 1 1 59 59 GLN N N 59 132.065 132.065 127.169 4.896 25259 14570 1 19 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.549 0.698 25259 14571 1 19 . 1 1 59 59 GLN CA C 59 52.164 52.164 56.118 -3.954 25259 14572 1 19 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.814 -1.153 25259 14573 1 19 . 1 1 59 59 GLN H H 59 9.389 9.389 8.713 0.676 25259 14574 1 19 . 1 1 60 60 GLN N N 60 130.314 130.314 121.859 8.455 25259 14575 1 19 . 1 1 60 60 GLN HA H 60 5.209 5.209 5.058 0.151 25259 14576 1 19 . 1 1 60 60 GLN CA C 60 52.021 52.021 54.581 -2.560 25259 14577 1 19 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.721 -4.245 25259 14578 1 19 . 1 1 60 60 GLN H H 60 9.471 9.471 9.147 0.324 25259 14579 1 19 . 1 1 61 61 LYS N N 61 131.044 131.044 124.980 6.064 25259 14580 1 19 . 1 1 61 61 LYS HA H 61 5.415 5.415 4.974 0.441 25259 14581 1 19 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.116 -2.996 25259 14582 1 19 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.736 -3.319 25259 14583 1 19 . 1 1 61 61 LYS H H 61 8.893 8.893 8.911 -0.018 25259 14584 1 19 . 1 1 62 62 ARG N N 62 125.397 125.397 122.792 2.605 25259 14585 1 19 . 1 1 62 62 ARG HA H 62 5.003 5.003 4.935 0.068 25259 14586 1 19 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.933 -2.842 25259 14587 1 19 . 1 1 62 62 ARG CB C 62 29.878 29.878 31.976 -2.098 25259 14588 1 19 . 1 1 62 62 ARG H H 62 9.120 9.120 8.212 0.908 25259 14589 1 19 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.749 0.226 25259 14590 1 19 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.380 -2.883 25259 14591 1 19 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.231 -2.347 25259 14592 1 19 . 1 1 64 64 VAL N N 64 121.305 121.305 119.620 1.685 25259 14593 1 19 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.324 -0.300 25259 14594 1 19 . 1 1 64 64 VAL CA C 64 59.677 59.677 62.092 -2.415 25259 14595 1 19 . 1 1 64 64 VAL CB C 64 30.365 30.365 32.252 -1.887 25259 14596 1 19 . 1 1 64 64 VAL H H 64 7.520 7.520 8.118 -0.598 25259 14597 1 19 . 1 1 65 65 SER N N 65 123.215 123.215 119.339 3.876 25259 14598 1 19 . 1 1 65 65 SER HA H 65 4.521 4.521 4.726 -0.205 25259 14599 1 19 . 1 1 65 65 SER CA C 65 54.897 54.897 58.021 -3.124 25259 14600 1 19 . 1 1 65 65 SER CB C 65 62.564 62.564 64.652 -2.088 25259 14601 1 19 . 1 1 65 65 SER H H 65 8.080 8.080 8.433 -0.353 25259 14602 1 19 . 1 1 66 66 ASP N N 66 123.802 123.802 122.436 1.366 25259 14603 1 19 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.375 0.054 25259 14604 1 19 . 1 1 66 66 ASP CA C 66 55.378 55.378 57.184 -1.806 25259 14605 1 19 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.471 -2.433 25259 14606 1 19 . 1 1 66 66 ASP H H 66 8.900 8.900 8.866 0.034 25259 14607 1 19 . 1 1 67 67 GLU N N 67 121.943 121.943 120.203 1.740 25259 14608 1 19 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.067 0.122 25259 14609 1 19 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.315 -1.875 25259 14610 1 19 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.563 -2.778 25259 14611 1 19 . 1 1 67 67 GLU H H 67 8.717 8.717 8.488 0.230 25259 14612 1 19 . 1 1 68 68 LEU N N 68 125.458 125.458 120.943 4.515 25259 14613 1 19 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.209 0.134 25259 14614 1 19 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.765 -2.293 25259 14615 1 19 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.128 -1.724 25259 14616 1 19 . 1 1 68 68 LEU H H 68 7.820 7.820 7.861 -0.041 25259 14617 1 19 . 1 1 69 69 LYS N N 69 123.868 123.868 119.342 4.526 25259 14618 1 19 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.010 -0.004 25259 14619 1 19 . 1 1 69 69 LYS CA C 69 57.617 57.617 60.196 -2.579 25259 14620 1 19 . 1 1 69 69 LYS CB C 69 30.037 30.037 32.139 -2.102 25259 14621 1 19 . 1 1 69 69 LYS H H 69 8.690 8.690 8.380 0.310 25259 14622 1 19 . 1 1 70 70 THR N N 70 117.109 117.109 116.350 0.759 25259 14623 1 19 . 1 1 70 70 THR HA H 70 4.088 4.088 4.002 0.086 25259 14624 1 19 . 1 1 70 70 THR CA C 70 63.879 63.879 66.658 -2.779 25259 14625 1 19 . 1 1 70 70 THR CB C 70 66.383 66.383 68.505 -2.122 25259 14626 1 19 . 1 1 70 70 THR H H 70 7.935 7.935 7.622 0.313 25259 14627 1 19 . 1 1 71 71 TYR N N 71 127.006 127.006 123.275 3.731 25259 14628 1 19 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.338 -0.133 25259 14629 1 19 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.721 -1.496 25259 14630 1 19 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.173 -1.628 25259 14631 1 19 . 1 1 71 71 TYR H H 71 7.683 7.683 7.584 0.099 25259 14632 1 19 . 1 1 72 72 ILE N N 72 125.064 125.064 119.562 5.502 25259 14633 1 19 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.845 -0.166 25259 14634 1 19 . 1 1 72 72 ILE CA C 72 62.895 62.895 64.998 -2.103 25259 14635 1 19 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.933 -1.657 25259 14636 1 19 . 1 1 72 72 ILE H H 72 9.083 9.083 8.298 0.785 25259 14637 1 19 . 1 1 73 73 ASP N N 73 124.900 124.900 119.951 4.949 25259 14638 1 19 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.383 0.006 25259 14639 1 19 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.968 -1.930 25259 14640 1 19 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.985 -2.878 25259 14641 1 19 . 1 1 73 73 ASP H H 73 8.751 8.751 7.809 0.942 25259 14642 1 19 . 1 1 74 74 GLN N N 74 117.025 117.025 117.334 -0.309 25259 14643 1 19 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.056 0.082 25259 14644 1 19 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.921 -3.111 25259 14645 1 19 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.258 -1.694 25259 14646 1 19 . 1 1 74 74 GLN H H 74 7.447 7.447 8.254 -0.807 25259 14647 1 19 . 1 1 75 75 HIS N N 75 116.494 116.494 115.445 1.049 25259 14648 1 19 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.579 0.137 25259 14649 1 19 . 1 1 75 75 HIS CA C 75 54.066 54.066 57.298 -3.232 25259 14650 1 19 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.558 -4.256 25259 14651 1 19 . 1 1 75 75 HIS H H 75 8.402 8.402 8.137 0.265 25259 14652 1 19 . 1 1 76 76 GLY N N 76 112.564 112.564 105.439 7.125 25259 14653 1 19 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.676 -2.780 25259 14654 1 19 . 1 1 76 76 GLY H H 76 9.091 9.091 7.650 1.441 25259 14655 1 19 . 1 1 77 77 VAL N N 77 124.763 124.763 122.196 2.567 25259 14656 1 19 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.718 -0.153 25259 14657 1 19 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.442 -0.491 25259 14658 1 19 . 1 1 77 77 VAL CB C 77 29.838 29.838 31.952 -2.114 25259 14659 1 19 . 1 1 77 77 VAL H H 77 8.927 8.927 8.943 -0.016 25259 14660 1 19 . 1 1 78 78 GLU N N 78 124.388 124.388 118.296 6.092 25259 14661 1 19 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.006 0.142 25259 14662 1 19 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.652 -1.336 25259 14663 1 19 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.936 -2.477 25259 14664 1 19 . 1 1 78 78 GLU H H 78 8.781 8.781 8.678 0.103 25259 14665 1 19 . 1 1 79 79 GLU N N 79 121.887 121.887 118.724 3.163 25259 14666 1 19 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.277 -0.089 25259 14667 1 19 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.828 -2.283 25259 14668 1 19 . 1 1 79 79 GLU CB C 79 27.033 27.033 30.125 -3.092 25259 14669 1 19 . 1 1 79 79 GLU H H 79 9.231 9.231 7.798 1.433 25259 14670 1 19 . 1 1 80 80 THR N N 80 120.781 120.781 117.833 2.948 25259 14671 1 19 . 1 1 80 80 THR HA H 80 4.059 4.059 3.809 0.250 25259 14672 1 19 . 1 1 80 80 THR CA C 80 65.487 65.487 66.596 -1.109 25259 14673 1 19 . 1 1 80 80 THR CB C 80 64.369 64.369 68.750 -4.381 25259 14674 1 19 . 1 1 80 80 THR H H 80 7.858 7.858 8.429 -0.571 25259 14675 1 19 . 1 1 81 81 GLN N N 81 125.303 125.303 120.401 4.902 25259 14676 1 19 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.959 0.085 25259 14677 1 19 . 1 1 81 81 GLN CA C 81 56.969 56.969 58.915 -1.946 25259 14678 1 19 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.294 -2.217 25259 14679 1 19 . 1 1 81 81 GLN H H 81 8.765 8.765 8.370 0.395 25259 14680 1 19 . 1 1 82 82 LYS N N 82 120.458 120.458 118.970 1.488 25259 14681 1 19 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.981 0.108 25259 14682 1 19 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.581 -1.269 25259 14683 1 19 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.743 -1.589 25259 14684 1 19 . 1 1 82 82 LYS H H 82 7.521 7.521 7.799 -0.278 25259 14685 1 19 . 1 1 83 83 ALA N N 83 125.234 125.234 122.113 3.121 25259 14686 1 19 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.916 0.301 25259 14687 1 19 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.729 -2.287 25259 14688 1 19 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.914 -2.627 25259 14689 1 19 . 1 1 83 83 ALA H H 83 7.782 7.782 7.708 0.074 25259 14690 1 19 . 1 1 84 84 LEU N N 84 123.348 123.348 119.017 4.331 25259 14691 1 19 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.877 0.181 25259 14692 1 19 . 1 1 84 84 LEU CA C 84 55.499 55.499 58.457 -2.958 25259 14693 1 19 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.077 -1.769 25259 14694 1 19 . 1 1 84 84 LEU H H 84 8.590 8.590 7.465 1.125 25259 14695 1 19 . 1 1 85 85 LEU N N 85 122.872 122.872 118.664 4.208 25259 14696 1 19 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.893 0.277 25259 14697 1 19 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.739 -2.343 25259 14698 1 19 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.355 -2.614 25259 14699 1 19 . 1 1 85 85 LEU H H 85 7.892 7.892 7.693 0.199 25259 14700 1 19 . 1 1 86 86 GLU N N 86 122.713 122.713 118.786 3.927 25259 14701 1 19 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.174 -0.089 25259 14702 1 19 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.780 -2.035 25259 14703 1 19 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.859 -2.956 25259 14704 1 19 . 1 1 86 86 GLU H H 86 8.124 8.124 8.342 -0.218 25259 14705 1 19 . 1 1 87 87 ALA N N 87 123.163 123.163 121.927 1.236 25259 14706 1 19 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.272 -0.131 25259 14707 1 19 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.413 -2.145 25259 14708 1 19 . 1 1 87 87 ALA CB C 87 15.632 15.632 19.630 -3.998 25259 14709 1 19 . 1 1 87 87 ALA H H 87 7.765 7.765 7.662 0.103 25259 14710 1 19 . 1 1 88 88 GLU N N 88 121.945 121.945 118.294 3.651 25259 14711 1 19 . 1 1 88 88 GLU HA H 88 4.084 4.084 3.946 0.138 25259 14712 1 19 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.966 -2.031 25259 14713 1 19 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.424 -1.397 25259 14714 1 19 . 1 1 88 88 GLU H H 88 7.846 7.846 8.423 -0.577 25259 14715 1 19 . 1 1 89 89 GLU N N 89 117.978 117.978 116.156 1.822 25259 14716 1 19 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.091 0.002 25259 14717 1 19 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.419 -3.205 25259 14718 1 19 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.701 -2.294 25259 14719 1 19 . 1 1 89 89 GLU H H 89 7.634 7.634 8.015 -0.381 25259 14720 1 19 . 1 1 90 90 LYS N N 90 117.519 117.519 115.435 2.084 25259 14721 1 19 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.433 -0.002 25259 14722 1 19 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.413 -2.395 25259 14723 1 19 . 1 1 90 90 LYS CB C 90 31.031 31.031 33.118 -2.087 25259 14724 1 19 . 1 1 90 90 LYS H H 90 7.247 7.247 7.522 -0.275 25259 14725 1 19 . 1 1 91 91 ASP N N 91 124.888 124.888 123.747 1.141 25259 14726 1 19 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.487 0.196 25259 14727 1 19 . 1 1 91 91 ASP CA C 91 51.199 51.199 54.820 -3.621 25259 14728 1 19 . 1 1 91 91 ASP CB C 91 39.581 39.581 42.121 -2.541 25259 14729 1 19 . 1 1 91 91 ASP H H 91 7.370 7.370 7.898 -0.528 25259 14730 1 19 . 1 1 92 92 LYS N N 92 129.311 129.311 128.063 1.248 25259 14731 1 19 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.864 0.149 25259 14732 1 19 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.410 -2.194 25259 14733 1 19 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.502 -2.487 25259 14734 1 19 . 1 1 92 92 LYS H H 92 8.795 8.795 8.723 0.072 25259 14735 1 19 . 1 1 93 93 SER N N 93 118.112 118.112 113.200 4.912 25259 14736 1 19 . 1 1 93 93 SER HA H 93 4.439 4.439 4.230 0.209 25259 14737 1 19 . 1 1 93 93 SER CA C 93 58.945 58.945 60.816 -1.871 25259 14738 1 19 . 1 1 93 93 SER CB C 93 60.278 60.278 63.349 -3.071 25259 14739 1 19 . 1 1 93 93 SER H H 93 8.488 8.488 8.302 0.186 25259 14740 1 19 . 1 1 94 94 ILE N N 94 128.950 128.950 121.641 7.309 25259 14741 1 19 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.740 -0.258 25259 14742 1 19 . 1 1 94 94 ILE CA C 94 62.349 62.349 63.619 -1.270 25259 14743 1 19 . 1 1 94 94 ILE CB C 94 34.753 34.753 38.284 -3.531 25259 14744 1 19 . 1 1 94 94 ILE H H 94 7.722 7.722 7.553 0.169 25259 14745 1 19 . 1 1 95 95 ILE N N 95 123.598 123.598 121.976 1.622 25259 14746 1 19 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.501 0.094 25259 14747 1 19 . 1 1 95 95 ILE CA C 95 62.747 62.747 66.006 -3.259 25259 14748 1 19 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.748 -1.776 25259 14749 1 19 . 1 1 95 95 ILE H H 95 8.378 8.378 8.281 0.097 25259 14750 1 19 . 1 1 96 96 GLU N N 96 118.317 118.317 117.435 0.882 25259 14751 1 19 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.954 0.030 25259 14752 1 19 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.263 -2.768 25259 14753 1 19 . 1 1 96 96 GLU CB C 96 27.173 27.173 28.807 -1.634 25259 14754 1 19 . 1 1 96 96 GLU H H 96 7.680 7.680 7.750 -0.070 25259 14755 1 19 . 1 1 97 97 ALA N N 97 124.797 124.797 122.531 2.266 25259 14756 1 19 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.738 0.087 25259 14757 1 19 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.319 -2.022 25259 14758 1 19 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.547 -2.558 25259 14759 1 19 . 1 1 97 97 ALA H H 97 7.383 7.383 7.559 -0.176 25259 14760 1 19 . 1 1 98 98 ARG N N 98 115.469 115.469 115.640 -0.171 25259 14761 1 19 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.354 -0.048 25259 14762 1 19 . 1 1 98 98 ARG CA C 98 56.490 56.490 58.161 -1.671 25259 14763 1 19 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.931 -1.694 25259 14764 1 19 . 1 1 98 98 ARG H H 98 8.229 8.229 7.794 0.435 25259 14765 1 19 . 1 1 99 99 LYS N N 99 120.219 120.219 117.498 2.721 25259 14766 1 19 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.151 0.107 25259 14767 1 19 . 1 1 99 99 LYS CA C 99 55.241 55.241 56.803 -1.562 25259 14768 1 19 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.603 -2.107 25259 14769 1 19 . 1 1 99 99 LYS H H 99 7.270 7.270 7.366 -0.096 25259 14770 1 19 . 1 1 100 100 LEU N N 100 123.800 123.800 120.441 3.359 25259 14771 1 19 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.382 -0.041 25259 14772 1 19 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.101 -2.022 25259 14773 1 19 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.065 -2.934 25259 14774 1 19 . 1 1 100 100 LEU H H 100 7.837 7.837 7.782 0.055 25259 14775 1 19 . 1 1 101 101 ALA N N 101 130.512 130.512 125.167 5.345 25259 14776 1 19 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.415 -0.039 25259 14777 1 19 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.163 -2.759 25259 14778 1 19 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.495 -2.700 25259 14779 1 19 . 1 1 101 101 ALA H H 101 8.213 8.213 8.863 -0.650 25259 14780 1 19 . 1 1 102 102 GLY N N 102 110.659 110.659 105.706 4.953 25259 14781 1 19 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.231 -1.339 25259 14782 1 19 . 1 1 102 102 GLY H H 102 8.738 8.738 7.402 1.336 25259 14783 1 19 . 1 1 103 103 PHE N N 103 123.097 123.097 121.473 1.624 25259 14784 1 19 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.258 -0.038 25259 14785 1 19 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.548 -2.780 25259 14786 1 19 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.370 -1.796 25259 14787 1 19 . 1 1 103 103 PHE H H 103 7.514 7.514 7.485 0.029 25259 14788 1 19 . 1 1 104 104 LYS N N 104 130.652 130.652 123.583 7.069 25259 14789 1 19 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.140 -0.020 25259 14790 1 19 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.392 -1.413 25259 14791 1 19 . 1 1 104 104 LYS CB C 104 34.237 34.237 37.030 -2.793 25259 14792 1 19 . 1 1 104 104 LYS H H 104 7.473 7.473 7.630 -0.157 25259 14793 1 19 . 1 1 105 105 LEU N N 105 127.372 127.372 121.447 5.925 25259 14794 1 19 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.055 -0.059 25259 14795 1 19 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.204 -1.468 25259 14796 1 19 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.942 -1.978 25259 14797 1 19 . 1 1 105 105 LEU H H 105 8.393 8.393 8.155 0.238 25259 14798 1 19 . 1 1 106 106 GLU N N 106 129.358 129.358 122.337 7.021 25259 14799 1 19 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.770 0.074 25259 14800 1 19 . 1 1 106 106 GLU CA C 106 52.790 52.790 54.606 -1.816 25259 14801 1 19 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.797 -2.169 25259 14802 1 19 . 1 1 106 106 GLU H H 106 8.849 8.849 9.024 -0.175 25259 14803 1 19 . 1 1 107 107 THR N N 107 131.118 131.118 113.681 17.437 25259 14804 1 19 . 1 1 107 107 THR HA H 107 5.110 5.110 5.129 -0.019 25259 14805 1 19 . 1 1 107 107 THR CA C 107 59.832 59.832 60.295 -0.464 25259 14806 1 19 . 1 1 107 107 THR CB C 107 66.671 66.671 71.414 -4.743 25259 14807 1 19 . 1 1 107 107 THR H H 107 9.433 9.433 8.353 1.080 25259 14808 1 19 . 1 1 108 108 LYS N N 108 129.114 129.114 122.548 6.566 25259 14809 1 19 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.651 0.173 25259 14810 1 19 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.207 -3.013 25259 14811 1 19 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.996 -1.609 25259 14812 1 19 . 1 1 108 108 LYS H H 108 9.410 9.410 9.141 0.269 25259 14813 1 19 . 1 1 109 109 LEU N N 109 129.323 129.323 127.241 2.082 25259 14814 1 19 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.571 0.133 25259 14815 1 19 . 1 1 109 109 LEU CA C 109 52.108 52.108 53.453 -1.345 25259 14816 1 19 . 1 1 109 109 LEU CB C 109 39.655 39.655 41.661 -2.006 25259 14817 1 19 . 1 1 109 109 LEU H H 109 8.862 8.862 9.147 -0.285 25259 14818 1 19 . 1 1 110 110 LEU N N 110 129.123 129.123 127.600 1.523 25259 14819 1 19 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.134 0.089 25259 14820 1 19 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.846 -3.064 25259 14821 1 19 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.401 -1.740 25259 14822 1 19 . 1 1 110 110 LEU H H 110 8.373 8.373 8.496 -0.123 25259 14823 1 19 . 1 1 111 111 SER N N 111 114.587 114.587 109.880 4.707 25259 14824 1 19 . 1 1 111 111 SER HA H 111 4.557 4.557 4.570 -0.013 25259 14825 1 19 . 1 1 111 111 SER CA C 111 53.889 53.889 57.295 -3.406 25259 14826 1 19 . 1 1 111 111 SER CB C 111 61.830 61.830 64.638 -2.808 25259 14827 1 19 . 1 1 111 111 SER H H 111 8.400 8.400 7.540 0.860 25259 14828 1 19 . 1 1 112 112 ALA N N 112 118.269 118.269 122.184 -3.915 25259 14829 1 19 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.322 -0.013 25259 14830 1 19 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.144 -2.930 25259 14831 1 19 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.208 -1.620 25259 14832 1 19 . 1 1 112 112 ALA H H 112 8.556 8.556 8.627 -0.071 25259 14833 1 19 . 1 1 113 113 THR N N 113 102.878 102.878 105.337 -2.459 25259 14834 1 19 . 1 1 113 113 THR HA H 113 4.662 4.662 4.573 0.089 25259 14835 1 19 . 1 1 113 113 THR CA C 113 58.689 58.689 61.820 -3.131 25259 14836 1 19 . 1 1 113 113 THR CB C 113 67.905 67.905 70.712 -2.807 25259 14837 1 19 . 1 1 113 113 THR H H 113 8.065 8.065 7.517 0.548 25259 14838 1 19 . 1 1 114 114 GLU N N 114 126.514 126.514 121.088 5.426 25259 14839 1 19 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.967 0.047 25259 14840 1 19 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.850 -1.843 25259 14841 1 19 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.109 -1.196 25259 14842 1 19 . 1 1 114 114 GLU H H 114 7.357 7.357 7.608 -0.251 25259 14843 1 19 . 1 1 115 115 LEU N N 115 128.058 128.058 119.883 8.175 25259 14844 1 19 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.191 -0.269 25259 14845 1 19 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.645 -1.321 25259 14846 1 19 . 1 1 115 115 LEU CB C 115 44.139 44.139 45.973 -1.834 25259 14847 1 19 . 1 1 115 115 LEU H H 115 8.930 8.930 8.477 0.453 25259 14848 1 19 . 1 1 116 116 GLN N N 116 126.540 126.540 118.277 8.263 25259 14849 1 19 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.026 0.689 25259 14850 1 19 . 1 1 116 116 GLN CA C 116 51.700 51.700 55.117 -3.417 25259 14851 1 19 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.545 -1.253 25259 14852 1 19 . 1 1 116 116 GLN H H 116 9.221 9.221 8.967 0.254 25259 14853 1 19 . 1 1 117 117 THR N N 117 125.213 125.213 121.658 3.555 25259 14854 1 19 . 1 1 117 117 THR HA H 117 5.353 5.353 5.239 0.114 25259 14855 1 19 . 1 1 117 117 THR CA C 117 58.926 58.926 61.561 -2.635 25259 14856 1 19 . 1 1 117 117 THR CB C 117 68.948 68.948 72.681 -3.733 25259 14857 1 19 . 1 1 117 117 THR H H 117 9.030 9.030 8.716 0.314 25259 14858 1 19 . 1 1 118 118 THR N N 118 127.799 127.799 119.626 8.173 25259 14859 1 19 . 1 1 118 118 THR HA H 118 5.527 5.527 5.077 0.450 25259 14860 1 19 . 1 1 118 118 THR CA C 118 59.201 59.201 61.862 -2.662 25259 14861 1 19 . 1 1 118 118 THR CB C 118 67.721 67.721 71.643 -3.922 25259 14862 1 19 . 1 1 118 118 THR H H 118 9.459 9.459 8.761 0.698 25259 14863 1 19 . 1 1 119 119 THR N N 119 129.258 129.258 123.485 5.773 25259 14864 1 19 . 1 1 119 119 THR HA H 119 4.885 4.885 4.496 0.389 25259 14865 1 19 . 1 1 119 119 THR CA C 119 58.463 58.463 62.340 -3.877 25259 14866 1 19 . 1 1 119 119 THR CB C 119 67.459 67.459 69.672 -2.213 25259 14867 1 19 . 1 1 119 119 THR H H 119 9.147 9.147 8.751 0.396 25259 14868 1 19 . 1 1 120 120 SER N N 120 123.389 123.389 119.891 3.498 25259 14869 1 19 . 1 1 120 120 SER HA H 120 5.328 5.328 5.117 0.211 25259 14870 1 19 . 1 1 120 120 SER CA C 120 54.386 54.386 56.985 -2.599 25259 14871 1 19 . 1 1 120 120 SER CB C 120 63.031 63.031 65.760 -2.729 25259 14872 1 19 . 1 1 120 120 SER H H 120 8.786 8.786 8.468 0.318 25259 14873 1 19 . 1 1 121 121 PHE N N 121 121.245 121.245 120.793 0.452 25259 14874 1 19 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.906 0.206 25259 14875 1 19 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.714 -3.522 25259 14876 1 19 . 1 1 121 121 PHE CB C 121 40.265 40.265 41.190 -0.925 25259 14877 1 19 . 1 1 121 121 PHE H H 121 8.831 8.831 9.258 -0.427 25259 14878 1 19 . 1 1 122 122 ASP N N 122 124.765 124.765 126.677 -1.912 25259 14879 1 19 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.860 -0.020 25259 14880 1 19 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.513 -3.676 25259 14881 1 19 . 1 1 122 122 ASP CB C 122 38.485 38.485 39.508 -1.023 25259 14882 1 19 . 1 1 122 122 ASP H H 122 8.819 8.819 9.061 -0.242 25259 14883 1 19 . 1 1 123 123 PHE N N 123 124.303 124.303 122.807 1.496 25259 14884 1 19 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.262 0.412 25259 14885 1 19 . 1 1 123 123 PHE CA C 123 57.798 57.798 59.954 -2.156 25259 14886 1 19 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.331 -2.791 25259 14887 1 19 . 1 1 123 123 PHE H H 123 8.262 8.262 7.879 0.383 25259 14888 1 19 . 1 1 124 124 GLN N N 124 120.792 120.792 116.954 3.838 25259 14889 1 19 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.151 0.283 25259 14890 1 19 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.233 -2.150 25259 14891 1 19 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.008 -1.879 25259 14892 1 19 . 1 1 124 124 GLN H H 124 8.954 8.954 8.043 0.911 25259 14893 1 19 . 1 1 125 125 VAL N N 125 114.091 114.091 110.320 3.771 25259 14894 1 19 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.398 0.011 25259 14895 1 19 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.688 -2.390 25259 14896 1 19 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.655 -1.083 25259 14897 1 19 . 1 1 125 125 VAL H H 125 7.026 7.026 7.976 -0.950 25259 14898 1 19 . 1 1 126 126 LEU N N 126 125.158 125.158 122.318 2.840 25259 14899 1 19 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.555 -0.080 25259 14900 1 19 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.851 -1.676 25259 14901 1 19 . 1 1 126 126 LEU CB C 126 42.054 42.054 44.017 -1.963 25259 14902 1 19 . 1 1 126 126 LEU H H 126 8.106 8.106 7.751 0.355 25259 14903 1 19 . 1 1 127 127 ASP N N 127 130.026 130.026 126.301 3.725 25259 14904 1 19 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.806 0.035 25259 14905 1 19 . 1 1 127 127 ASP CA C 127 50.198 50.198 52.737 -2.539 25259 14906 1 19 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.060 -2.371 25259 14907 1 19 . 1 1 127 127 ASP H H 127 9.129 9.129 8.826 0.303 25259 14908 1 19 . 1 1 128 128 VAL N N 128 128.833 128.833 124.748 4.085 25259 14909 1 19 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.603 -0.079 25259 14910 1 19 . 1 1 128 128 VAL CA C 128 63.668 63.668 65.535 -1.867 25259 14911 1 19 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.723 -2.228 25259 14912 1 19 . 1 1 128 128 VAL H H 128 8.288 8.288 7.883 0.405 25259 14913 1 19 . 1 1 129 129 LYS N N 129 123.914 123.914 120.490 3.424 25259 14914 1 19 . 1 1 129 129 LYS HA H 129 4.043 4.043 3.978 0.065 25259 14915 1 19 . 1 1 129 129 LYS CA C 129 56.789 56.789 59.294 -2.505 25259 14916 1 19 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.961 -3.024 25259 14917 1 19 . 1 1 129 129 LYS H H 129 8.226 8.226 8.112 0.114 25259 14918 1 19 . 1 1 130 130 LYS N N 130 121.888 121.888 117.285 4.603 25259 14919 1 19 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.191 -0.106 25259 14920 1 19 . 1 1 130 130 LYS CA C 130 56.146 56.146 58.492 -2.345 25259 14921 1 19 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.032 -2.692 25259 14922 1 19 . 1 1 130 130 LYS H H 130 7.590 7.590 7.910 -0.320 25259 14923 1 19 . 1 1 131 131 ALA N N 131 123.088 123.088 123.535 -0.447 25259 14924 1 19 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.110 -0.183 25259 14925 1 19 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.321 -2.919 25259 14926 1 19 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.101 -1.654 25259 14927 1 19 . 1 1 131 131 ALA H H 131 8.506 8.506 8.558 -0.052 25259 14928 1 19 . 1 1 132 132 SER N N 132 110.456 110.456 112.260 -1.804 25259 14929 1 19 . 1 1 132 132 SER HA H 132 4.117 4.117 4.202 -0.085 25259 14930 1 19 . 1 1 132 132 SER CA C 132 58.289 58.289 60.543 -2.254 25259 14931 1 19 . 1 1 132 132 SER CB C 132 61.034 61.034 62.856 -1.822 25259 14932 1 19 . 1 1 132 132 SER H H 132 7.986 7.986 7.890 0.096 25259 14933 1 19 . 1 1 133 133 GLN N N 133 119.034 119.034 118.495 0.539 25259 14934 1 19 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.406 -0.004 25259 14935 1 19 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.817 -2.292 25259 14936 1 19 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.446 -2.212 25259 14937 1 19 . 1 1 133 133 GLN H H 133 7.233 7.233 7.663 -0.430 25259 14938 1 19 . 1 1 134 134 LEU N N 134 123.291 123.291 121.702 1.589 25259 14939 1 19 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.358 0.035 25259 14940 1 19 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.539 -2.223 25259 14941 1 19 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.248 -3.401 25259 14942 1 19 . 1 1 134 134 LEU H H 134 7.411 7.411 7.495 -0.084 25259 14943 1 19 . 1 1 135 135 GLU N N 135 128.446 128.446 126.192 2.254 25259 14944 1 19 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.961 -0.015 25259 14945 1 19 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.987 -2.603 25259 14946 1 19 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.364 -2.068 25259 14947 1 19 . 1 1 135 135 GLU H H 135 8.986 8.986 9.214 -0.228 25259 14948 1 19 . 1 1 136 136 HIS N N 136 117.593 117.593 117.074 0.519 25259 14949 1 19 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.456 -0.073 25259 14950 1 19 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.304 -1.619 25259 14951 1 19 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.982 -1.569 25259 14952 1 19 . 1 1 136 136 HIS H H 136 9.226 9.226 8.248 0.978 25259 14953 1 19 . 1 1 137 137 LEU N N 137 115.463 115.463 115.194 0.269 25259 14954 1 19 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.577 -0.070 25259 14955 1 19 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.870 -2.922 25259 14956 1 19 . 1 1 137 137 LEU CB C 137 39.807 39.807 43.273 -3.466 25259 14957 1 19 . 1 1 137 137 LEU H H 137 7.090 7.090 8.110 -1.020 25259 14958 1 19 . 1 1 138 138 LYS N N 138 124.686 124.686 121.208 3.478 25259 14959 1 19 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.247 -0.078 25259 14960 1 19 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.770 -1.612 25259 14961 1 19 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.151 -2.063 25259 14962 1 19 . 1 1 138 138 LYS H H 138 7.698 7.698 7.949 -0.251 25259 14963 1 19 . 1 1 139 139 ASN N N 139 118.077 118.077 112.910 5.167 25259 14964 1 19 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.664 0.009 25259 14965 1 19 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.447 -1.665 25259 14966 1 19 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.498 -2.681 25259 14967 1 19 . 1 1 139 139 ASN H H 139 8.485 8.485 8.147 0.338 25259 14968 1 19 . 1 1 140 140 ILE N N 140 120.880 120.880 120.638 0.242 25259 14969 1 19 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.181 -0.151 25259 14970 1 19 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.504 -1.938 25259 14971 1 19 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.434 -2.660 25259 14972 1 19 . 1 1 140 140 ILE H H 140 7.549 7.549 7.699 -0.150 25259 14973 1 19 . 1 1 141 141 GLY N N 141 110.676 110.676 114.214 -3.538 25259 14974 1 19 . 1 1 141 141 GLY CA C 141 44.664 44.664 45.018 -0.354 25259 14975 1 19 . 1 1 141 141 GLY H H 141 7.663 7.663 8.696 -1.033 25259 14976 1 19 . 1 1 142 142 LEU N N 142 123.857 123.857 122.123 1.734 25259 14977 1 19 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.695 -0.002 25259 14978 1 19 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.363 -2.170 25259 14979 1 19 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.946 -1.337 25259 14980 1 19 . 1 1 142 142 LEU H H 142 8.496 8.496 7.388 1.108 25259 14981 1 19 . 1 1 143 143 GLU N N 143 118.407 118.407 119.160 -0.753 25259 14982 1 19 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.804 -0.018 25259 14983 1 19 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.750 -2.528 25259 14984 1 19 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.209 -2.696 25259 14985 1 19 . 1 1 143 143 GLU H H 143 8.672 8.672 8.262 0.410 25259 14986 1 19 . 1 1 144 144 ASN N N 144 118.477 118.477 117.393 1.084 25259 14987 1 19 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.435 0.007 25259 14988 1 19 . 1 1 144 144 ASN CA C 144 52.712 52.712 55.309 -2.597 25259 14989 1 19 . 1 1 144 144 ASN CB C 144 35.955 35.955 37.912 -1.957 25259 14990 1 19 . 1 1 144 144 ASN H H 144 7.656 7.656 8.065 -0.409 25259 14991 1 19 . 1 1 145 145 LEU N N 145 125.354 125.354 122.872 2.482 25259 14992 1 19 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.764 0.033 25259 14993 1 19 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.741 -1.418 25259 14994 1 19 . 1 1 145 145 LEU CB C 145 39.573 39.573 41.709 -2.136 25259 14995 1 19 . 1 1 145 145 LEU H H 145 7.758 7.758 7.818 -0.060 25259 14996 1 19 . 1 1 146 146 LEU N N 146 116.372 116.372 114.736 1.636 25259 14997 1 19 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.607 0.269 25259 14998 1 19 . 1 1 146 146 LEU CA C 146 53.243 53.243 56.324 -3.081 25259 14999 1 19 . 1 1 146 146 LEU CB C 146 38.897 38.897 41.757 -2.860 25259 15000 1 19 . 1 1 146 146 LEU H H 146 7.242 7.242 7.643 -0.401 25259 15001 1 19 . 1 1 147 147 LYS N N 147 120.054 120.054 118.385 1.669 25259 15002 1 19 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.236 0.076 25259 15003 1 19 . 1 1 147 147 LYS CA C 147 54.623 54.623 56.499 -1.876 25259 15004 1 19 . 1 1 147 147 LYS CB C 147 30.260 30.260 31.982 -1.722 25259 15005 1 19 . 1 1 147 147 LYS H H 147 7.185 7.185 7.544 -0.359 25259 15006 1 19 . 1 1 148 148 ASN N N 148 119.498 119.498 116.755 2.743 25259 15007 1 19 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.885 0.077 25259 15008 1 19 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.383 -1.609 25259 15009 1 19 . 1 1 148 148 ASN CB C 148 39.486 39.486 39.881 -0.395 25259 15010 1 19 . 1 1 148 148 ASN H H 148 7.698 7.698 7.650 0.048 25259 15011 1 19 . 1 1 149 149 GLU N N 149 122.834 122.834 118.125 4.709 25259 15012 1 19 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.449 0.152 25259 15013 1 19 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.807 -2.588 25259 15014 1 19 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.570 -2.760 25259 15015 1 19 . 1 1 149 149 GLU H H 149 8.767 8.767 8.564 0.203 25259 15016 1 19 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.796 0.812 25259 15017 1 19 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.063 -0.821 25259 15018 1 19 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.144 -3.049 25259 15019 1 19 . 1 1 151 151 SER N N 151 112.839 112.839 112.102 0.737 25259 15020 1 19 . 1 1 151 151 SER HA H 151 3.835 3.835 4.223 -0.388 25259 15021 1 19 . 1 1 151 151 SER CA C 151 59.270 59.270 59.455 -0.185 25259 15022 1 19 . 1 1 151 151 SER CB C 151 59.451 59.451 62.517 -3.066 25259 15023 1 19 . 1 1 151 151 SER H H 151 8.519 8.519 7.715 0.804 25259 15024 1 19 . 1 1 152 152 LYS N N 152 126.710 126.710 121.723 4.987 25259 15025 1 19 . 1 1 152 152 LYS HA H 152 4.248 4.248 3.996 0.252 25259 15026 1 19 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.794 -4.029 25259 15027 1 19 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.377 -2.120 25259 15028 1 19 . 1 1 152 152 LYS H H 152 7.006 7.006 7.816 -0.810 25259 15029 1 19 . 1 1 153 153 TYR N N 153 123.239 123.239 115.087 8.152 25259 15030 1 19 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.494 -0.236 25259 15031 1 19 . 1 1 153 153 TYR CA C 153 59.309 59.309 57.173 2.136 25259 15032 1 19 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.364 -1.030 25259 15033 1 19 . 1 1 153 153 TYR H H 153 8.058 8.058 8.282 -0.224 25259 15034 1 19 . 1 1 154 154 ILE N N 154 120.253 120.253 121.144 -0.891 25259 15035 1 19 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.289 0.084 25259 15036 1 19 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.128 -2.014 25259 15037 1 19 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.174 -1.226 25259 15038 1 19 . 1 1 154 154 ILE H H 154 8.193 8.193 7.609 0.584 25259 15039 1 19 . 1 1 155 155 SER N N 155 117.178 117.178 115.492 1.686 25259 15040 1 19 . 1 1 155 155 SER HA H 155 4.091 4.091 4.034 0.057 25259 15041 1 19 . 1 1 155 155 SER CA C 155 59.961 59.961 61.937 -1.976 25259 15042 1 19 . 1 1 155 155 SER CB C 155 60.148 60.148 62.704 -2.556 25259 15043 1 19 . 1 1 155 155 SER H H 155 8.020 8.020 7.884 0.136 25259 15044 1 19 . 1 1 156 156 ASP N N 156 125.479 125.479 119.656 5.823 25259 15045 1 19 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.449 -0.022 25259 15046 1 19 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.654 -1.894 25259 15047 1 19 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.994 -3.121 25259 15048 1 19 . 1 1 156 156 ASP H H 156 8.638 8.638 7.773 0.865 25259 15049 1 19 . 1 1 157 157 ARG N N 157 121.542 121.542 118.532 3.010 25259 15050 1 19 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.147 -0.036 25259 15051 1 19 . 1 1 157 157 ARG CA C 157 55.928 55.928 57.591 -1.663 25259 15052 1 19 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.456 -1.640 25259 15053 1 19 . 1 1 157 157 ARG H H 157 7.888 7.888 7.475 0.413 25259 15054 1 19 . 1 1 158 158 LEU N N 158 124.257 124.257 121.134 3.123 25259 15055 1 19 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.208 0.063 25259 15056 1 19 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.319 -3.106 25259 15057 1 19 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.471 -2.526 25259 15058 1 19 . 1 1 158 158 LEU H H 158 8.442 8.442 7.735 0.707 25259 15059 1 19 . 1 1 159 159 ALA N N 159 124.146 124.146 121.412 2.734 25259 15060 1 19 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.069 0.263 25259 15061 1 19 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.682 -3.250 25259 15062 1 19 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.091 -2.184 25259 15063 1 19 . 1 1 159 159 ALA H H 159 8.086 8.086 8.426 -0.340 25259 15064 1 19 . 1 1 160 160 ASN N N 160 118.093 118.093 115.984 2.109 25259 15065 1 19 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.748 0.244 25259 15066 1 19 . 1 1 160 160 ASN CA C 160 50.577 50.577 52.959 -2.382 25259 15067 1 19 . 1 1 160 160 ASN CB C 160 37.733 37.733 39.170 -1.437 25259 15068 1 19 . 1 1 160 160 ASN H H 160 7.445 7.445 7.807 -0.362 25259 15069 1 19 . 1 1 161 161 GLY N N 161 108.365 108.365 107.414 0.951 25259 15070 1 19 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.084 -1.438 25259 15071 1 19 . 1 1 161 161 GLY H H 161 7.743 7.743 8.004 -0.261 25259 15072 1 19 . 1 1 162 162 ALA N N 162 123.928 123.928 122.746 1.182 25259 15073 1 19 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.071 -0.198 25259 15074 1 19 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.006 -1.480 25259 15075 1 19 . 1 1 162 162 ALA CB C 162 18.060 18.060 22.196 -4.136 25259 15076 1 19 . 1 1 162 162 ALA H H 162 8.035 8.035 7.496 0.539 25259 15077 1 19 . 1 1 163 163 THR N N 163 113.286 113.286 110.985 2.301 25259 15078 1 19 . 1 1 163 163 THR HA H 163 4.703 4.703 4.662 0.041 25259 15079 1 19 . 1 1 163 163 THR CA C 163 57.791 57.791 60.401 -2.610 25259 15080 1 19 . 1 1 163 163 THR CB C 163 68.974 68.974 71.513 -2.539 25259 15081 1 19 . 1 1 163 163 THR H H 163 8.451 8.451 8.653 -0.202 25259 15082 1 19 . 1 1 164 164 GLU N N 164 125.905 125.905 119.790 6.115 25259 15083 1 19 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.695 0.365 25259 15084 1 19 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.497 -1.912 25259 15085 1 19 . 1 1 164 164 GLU CB C 164 29.211 29.211 30.859 -1.648 25259 15086 1 19 . 1 1 164 164 GLU H H 164 8.716 8.716 8.499 0.217 25259 15087 1 20 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.207 -0.532 25259 15088 1 20 . 1 1 2 2 PRO CA C 2 60.808 60.808 62.828 -2.020 25259 15089 1 20 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.584 -3.514 25259 15090 1 20 . 1 1 3 3 ALA N N 3 126.741 126.741 122.065 4.676 25259 15091 1 20 . 1 1 3 3 ALA HA H 3 4.494 4.494 5.079 -0.585 25259 15092 1 20 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.688 -1.486 25259 15093 1 20 . 1 1 3 3 ALA CB C 3 16.818 16.818 21.569 -4.751 25259 15094 1 20 . 1 1 3 3 ALA H H 3 8.440 8.440 8.910 -0.470 25259 15095 1 20 . 1 1 4 4 THR N N 4 116.015 116.015 113.304 2.711 25259 15096 1 20 . 1 1 4 4 THR HA H 4 4.393 4.393 4.821 -0.428 25259 15097 1 20 . 1 1 4 4 THR CA C 4 59.148 59.148 61.652 -2.504 25259 15098 1 20 . 1 1 4 4 THR CB C 4 67.580 67.580 69.826 -2.245 25259 15099 1 20 . 1 1 4 4 THR H H 4 8.050 8.050 8.421 -0.371 25259 15100 1 20 . 1 1 5 5 LYS N N 5 126.350 126.350 122.429 3.921 25259 15101 1 20 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.610 -0.105 25259 15102 1 20 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.774 -1.857 25259 15103 1 20 . 1 1 5 5 LYS CB C 5 30.684 30.684 33.912 -3.228 25259 15104 1 20 . 1 1 5 5 LYS H H 5 8.332 8.332 8.545 -0.213 25259 15105 1 20 . 1 1 6 6 THR N N 6 118.124 118.124 115.836 2.288 25259 15106 1 20 . 1 1 6 6 THR HA H 6 4.440 4.440 4.596 -0.156 25259 15107 1 20 . 1 1 6 6 THR CA C 6 59.282 59.282 61.649 -2.367 25259 15108 1 20 . 1 1 6 6 THR CB C 6 67.685 67.685 70.488 -2.803 25259 15109 1 20 . 1 1 6 6 THR H H 6 8.283 8.283 8.482 -0.199 25259 15110 1 20 . 1 1 7 7 GLU N N 7 125.934 125.934 123.602 2.332 25259 15111 1 20 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.854 -0.510 25259 15112 1 20 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.441 -1.260 25259 15113 1 20 . 1 1 7 7 GLU CB C 7 27.816 27.816 32.260 -4.444 25259 15114 1 20 . 1 1 7 7 GLU H H 7 8.487 8.487 8.631 -0.144 25259 15115 1 20 . 1 1 8 8 LYS N N 8 123.945 123.945 123.363 0.582 25259 15116 1 20 . 1 1 8 8 LYS CA C 8 53.935 53.935 56.081 -2.146 25259 15117 1 20 . 1 1 8 8 LYS CB C 8 30.565 30.565 33.493 -2.928 25259 15118 1 20 . 1 1 8 8 LYS H H 8 8.278 8.278 8.331 -0.053 25259 15119 1 20 . 1 1 9 9 ASP N N 9 123.624 123.624 124.594 -0.970 25259 15120 1 20 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.540 -0.201 25259 15121 1 20 . 1 1 9 9 ASP CA C 9 52.123 52.123 55.273 -3.150 25259 15122 1 20 . 1 1 9 9 ASP CB C 9 38.933 38.933 40.868 -1.935 25259 15123 1 20 . 1 1 9 9 ASP H H 9 8.277 8.277 8.696 -0.419 25259 15124 1 20 . 1 1 10 10 THR N N 10 116.812 116.812 119.732 -2.920 25259 15125 1 20 . 1 1 10 10 THR HA H 10 4.349 4.349 4.520 -0.171 25259 15126 1 20 . 1 1 10 10 THR CA C 10 59.634 59.634 62.455 -2.821 25259 15127 1 20 . 1 1 10 10 THR CB C 10 67.254 67.254 68.878 -1.624 25259 15128 1 20 . 1 1 10 10 THR H H 10 8.049 8.049 8.481 -0.432 25259 15129 1 20 . 1 1 11 11 LEU N N 11 126.610 126.610 125.628 0.982 25259 15130 1 20 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.932 -0.540 25259 15131 1 20 . 1 1 11 11 LEU CA C 11 53.078 53.078 53.046 0.032 25259 15132 1 20 . 1 1 11 11 LEU CB C 11 39.633 39.633 44.131 -4.498 25259 15133 1 20 . 1 1 11 11 LEU H H 11 8.191 8.191 7.858 0.333 25259 15134 1 20 . 1 1 12 12 GLN N N 12 123.274 123.274 119.980 3.294 25259 15135 1 20 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.714 -0.332 25259 15136 1 20 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.652 -2.078 25259 15137 1 20 . 1 1 12 12 GLN CB C 12 26.803 26.803 29.216 -2.413 25259 15138 1 20 . 1 1 12 12 GLN H H 12 8.280 8.280 8.533 -0.253 25259 15139 1 20 . 1 1 13 13 SER N N 13 119.027 119.027 118.713 0.314 25259 15140 1 20 . 1 1 13 13 SER HA H 13 4.471 4.471 4.719 -0.248 25259 15141 1 20 . 1 1 13 13 SER CA C 13 55.869 55.869 57.349 -1.480 25259 15142 1 20 . 1 1 13 13 SER CB C 13 61.424 61.424 64.603 -3.179 25259 15143 1 20 . 1 1 13 13 SER H H 13 8.178 8.178 8.531 -0.353 25259 15144 1 20 . 1 1 14 14 ALA N N 14 128.314 128.314 127.479 0.835 25259 15145 1 20 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.658 -0.224 25259 15146 1 20 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.589 -1.893 25259 15147 1 20 . 1 1 14 14 ALA CB C 14 17.081 17.081 17.773 -0.692 25259 15148 1 20 . 1 1 14 14 ALA H H 14 8.195 8.195 8.535 -0.340 25259 15149 1 20 . 1 1 15 15 LEU N N 15 125.175 125.175 123.268 1.907 25259 15150 1 20 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.949 -0.309 25259 15151 1 20 . 1 1 15 15 LEU CA C 15 50.604 50.604 52.721 -2.117 25259 15152 1 20 . 1 1 15 15 LEU CB C 15 39.467 39.467 41.473 -2.006 25259 15153 1 20 . 1 1 15 15 LEU H H 15 8.050 8.050 7.787 0.263 25259 15154 1 20 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.551 -0.047 25259 15155 1 20 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.486 -1.855 25259 15156 1 20 . 1 1 16 16 PRO CB C 16 29.658 29.658 31.882 -2.224 25259 15157 1 20 . 1 1 17 17 VAL N N 17 123.223 123.223 117.437 5.786 25259 15158 1 20 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.072 0.062 25259 15159 1 20 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.539 -1.712 25259 15160 1 20 . 1 1 17 17 VAL CB C 17 30.377 30.377 31.933 -1.556 25259 15161 1 20 . 1 1 17 17 VAL H H 17 8.134 8.134 7.926 0.208 25259 15162 1 20 . 1 1 18 18 ILE N N 18 127.777 127.777 119.376 8.401 25259 15163 1 20 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.840 -0.597 25259 15164 1 20 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.536 -2.214 25259 15165 1 20 . 1 1 18 18 ILE CB C 18 36.254 36.254 41.078 -4.824 25259 15166 1 20 . 1 1 18 18 ILE H H 18 8.187 8.187 8.614 -0.427 25259 15167 1 20 . 1 1 19 19 GLU N N 19 128.148 128.148 123.514 4.634 25259 15168 1 20 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.470 -0.133 25259 15169 1 20 . 1 1 19 19 GLU CA C 19 54.091 54.091 56.023 -1.932 25259 15170 1 20 . 1 1 19 19 GLU CB C 19 28.176 28.176 31.815 -3.639 25259 15171 1 20 . 1 1 19 19 GLU H H 19 8.475 8.475 8.629 -0.154 25259 15172 1 20 . 1 1 20 20 ASN N N 20 122.788 122.788 122.142 0.646 25259 15173 1 20 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.996 -0.301 25259 15174 1 20 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.364 -2.542 25259 15175 1 20 . 1 1 20 20 ASN CB C 20 36.366 36.366 38.593 -2.227 25259 15176 1 20 . 1 1 20 20 ASN H H 20 8.477 8.477 8.759 -0.282 25259 15177 1 20 . 1 1 21 21 ALA N N 21 127.253 127.253 126.056 1.197 25259 15178 1 20 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.461 -0.140 25259 15179 1 20 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.817 -1.129 25259 15180 1 20 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.184 -3.271 25259 15181 1 20 . 1 1 21 21 ALA H H 21 8.325 8.325 8.180 0.145 25259 15182 1 20 . 1 1 22 22 GLU N N 22 122.044 122.044 120.380 1.664 25259 15183 1 20 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.355 -0.062 25259 15184 1 20 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.351 -1.768 25259 15185 1 20 . 1 1 22 22 GLU CB C 22 27.285 27.285 28.429 -1.144 25259 15186 1 20 . 1 1 22 22 GLU H H 22 8.415 8.415 8.352 0.063 25259 15187 1 20 . 1 1 23 23 LYS N N 23 123.622 123.622 123.110 0.512 25259 15188 1 20 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.455 -0.130 25259 15189 1 20 . 1 1 23 23 LYS CA C 23 54.496 54.496 56.015 -1.519 25259 15190 1 20 . 1 1 23 23 LYS CB C 23 30.653 30.653 33.397 -2.744 25259 15191 1 20 . 1 1 23 23 LYS H H 23 8.127 8.127 8.223 -0.096 25259 15192 1 20 . 1 1 24 24 ASN N N 24 120.652 120.652 117.929 2.723 25259 15193 1 20 . 1 1 24 24 ASN HA H 24 4.841 4.841 5.015 -0.174 25259 15194 1 20 . 1 1 24 24 ASN CA C 24 50.663 50.663 52.222 -1.559 25259 15195 1 20 . 1 1 24 24 ASN CB C 24 36.775 36.775 40.190 -3.415 25259 15196 1 20 . 1 1 24 24 ASN H H 24 8.424 8.424 8.614 -0.190 25259 15197 1 20 . 1 1 25 25 THR N N 25 117.102 117.102 112.604 4.498 25259 15198 1 20 . 1 1 25 25 THR HA H 25 4.367 4.367 4.372 -0.005 25259 15199 1 20 . 1 1 25 25 THR CA C 25 59.500 59.500 62.447 -2.947 25259 15200 1 20 . 1 1 25 25 THR CB C 25 67.610 67.610 69.879 -2.269 25259 15201 1 20 . 1 1 25 25 THR H H 25 7.852 7.852 8.391 -0.539 25259 15202 1 20 . 1 1 26 26 VAL N N 26 126.491 126.491 121.926 4.565 25259 15203 1 20 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.136 0.031 25259 15204 1 20 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.507 -1.314 25259 15205 1 20 . 1 1 26 26 VAL CB C 26 29.605 29.605 35.273 -5.668 25259 15206 1 20 . 1 1 26 26 VAL H H 26 8.080 8.080 8.171 -0.090 25259 15207 1 20 . 1 1 27 27 VAL N N 27 132.992 132.992 129.458 3.534 25259 15208 1 20 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.129 -0.048 25259 15209 1 20 . 1 1 27 27 VAL CA C 27 58.984 58.984 61.425 -2.441 25259 15210 1 20 . 1 1 27 27 VAL CB C 27 31.540 31.540 32.362 -0.822 25259 15211 1 20 . 1 1 27 27 VAL H H 27 8.830 8.830 9.141 -0.311 25259 15212 1 20 . 1 1 28 28 THR N N 28 123.576 123.576 123.672 -0.096 25259 15213 1 20 . 1 1 28 28 THR HA H 28 5.553 5.553 4.948 0.605 25259 15214 1 20 . 1 1 28 28 THR CA C 28 58.738 58.738 61.410 -2.672 25259 15215 1 20 . 1 1 28 28 THR CB C 28 68.443 68.443 70.741 -2.298 25259 15216 1 20 . 1 1 28 28 THR H H 28 8.165 8.165 8.402 -0.237 25259 15217 1 20 . 1 1 29 29 LYS N N 29 129.099 129.099 127.430 1.669 25259 15218 1 20 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.703 0.239 25259 15219 1 20 . 1 1 29 29 LYS CA C 29 51.779 51.779 54.584 -2.805 25259 15220 1 20 . 1 1 29 29 LYS CB C 29 35.096 35.096 36.995 -1.899 25259 15221 1 20 . 1 1 29 29 LYS H H 29 9.273 9.273 9.270 0.003 25259 15222 1 20 . 1 1 30 30 THR N N 30 123.510 123.510 117.334 6.176 25259 15223 1 20 . 1 1 30 30 THR HA H 30 5.428 5.428 4.860 0.568 25259 15224 1 20 . 1 1 30 30 THR CA C 30 59.784 59.784 62.090 -2.306 25259 15225 1 20 . 1 1 30 30 THR CB C 30 67.818 67.818 71.142 -3.324 25259 15226 1 20 . 1 1 30 30 THR H H 30 8.993 8.993 8.305 0.688 25259 15227 1 20 . 1 1 31 31 LEU N N 31 128.293 128.293 127.122 1.171 25259 15228 1 20 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.996 0.224 25259 15229 1 20 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.815 -3.760 25259 15230 1 20 . 1 1 31 31 LEU CB C 31 43.399 43.399 45.103 -1.704 25259 15231 1 20 . 1 1 31 31 LEU H H 31 9.557 9.557 9.294 0.263 25259 15232 1 20 . 1 1 32 32 VAL N N 32 126.919 126.919 125.125 1.794 25259 15233 1 20 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.019 0.432 25259 15234 1 20 . 1 1 32 32 VAL CA C 32 59.664 59.664 62.381 -2.717 25259 15235 1 20 . 1 1 32 32 VAL CB C 32 29.449 29.449 30.736 -1.287 25259 15236 1 20 . 1 1 32 32 VAL H H 32 9.364 9.364 8.412 0.952 25259 15237 1 20 . 1 1 33 33 LEU N N 33 133.503 133.503 129.260 4.243 25259 15238 1 20 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.410 0.146 25259 15239 1 20 . 1 1 33 33 LEU CA C 33 52.004 52.004 53.835 -1.831 25259 15240 1 20 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.101 -4.254 25259 15241 1 20 . 1 1 33 33 LEU H H 33 8.587 8.587 7.854 0.733 25259 15242 1 20 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.440 0.041 25259 15243 1 20 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.333 -1.888 25259 15244 1 20 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.160 -2.595 25259 15245 1 20 . 1 1 35 35 LYS N N 35 127.420 127.420 119.430 7.990 25259 15246 1 20 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.203 0.163 25259 15247 1 20 . 1 1 35 35 LYS CA C 35 55.119 55.119 57.363 -2.244 25259 15248 1 20 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.726 -2.132 25259 15249 1 20 . 1 1 35 35 LYS H H 35 8.666 8.666 8.426 0.240 25259 15250 1 20 . 1 1 36 36 SER N N 36 122.222 122.222 117.139 5.083 25259 15251 1 20 . 1 1 36 36 SER HA H 36 4.753 4.753 4.397 0.356 25259 15252 1 20 . 1 1 36 36 SER CA C 36 55.328 55.328 58.820 -3.492 25259 15253 1 20 . 1 1 36 36 SER CB C 36 61.728 61.728 62.331 -0.603 25259 15254 1 20 . 1 1 36 36 SER H H 36 8.771 8.771 8.827 -0.056 25259 15255 1 20 . 1 1 37 37 ASP N N 37 126.346 126.346 119.278 7.068 25259 15256 1 20 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.264 0.190 25259 15257 1 20 . 1 1 37 37 ASP CA C 37 54.616 54.616 57.128 -2.512 25259 15258 1 20 . 1 1 37 37 ASP CB C 37 37.985 37.985 39.737 -1.752 25259 15259 1 20 . 1 1 37 37 ASP H H 37 8.859 8.859 7.776 1.083 25259 15260 1 20 . 1 1 38 38 ASP N N 38 119.171 119.171 122.339 -3.168 25259 15261 1 20 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.610 0.005 25259 15262 1 20 . 1 1 38 38 ASP CA C 38 50.788 50.788 53.311 -2.523 25259 15263 1 20 . 1 1 38 38 ASP CB C 38 37.635 37.635 39.823 -2.188 25259 15264 1 20 . 1 1 38 38 ASP H H 38 7.944 7.944 8.088 -0.144 25259 15265 1 20 . 1 1 39 39 GLY N N 39 110.352 110.352 109.287 1.065 25259 15266 1 20 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.758 -2.997 25259 15267 1 20 . 1 1 39 39 GLY H H 39 8.145 8.145 8.297 -0.152 25259 15268 1 20 . 1 1 40 40 SER N N 40 120.090 120.090 113.937 6.153 25259 15269 1 20 . 1 1 40 40 SER HA H 40 4.877 4.877 5.137 -0.260 25259 15270 1 20 . 1 1 40 40 SER CA C 40 56.525 56.525 56.953 -0.428 25259 15271 1 20 . 1 1 40 40 SER CB C 40 62.245 62.245 65.922 -3.677 25259 15272 1 20 . 1 1 40 40 SER H H 40 8.344 8.344 7.528 0.816 25259 15273 1 20 . 1 1 41 41 GLN N N 41 122.551 122.551 120.508 2.043 25259 15274 1 20 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.779 0.148 25259 15275 1 20 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.343 -0.929 25259 15276 1 20 . 1 1 41 41 GLN CB C 41 30.314 30.314 33.030 -2.716 25259 15277 1 20 . 1 1 41 41 GLN H H 41 8.627 8.627 9.135 -0.508 25259 15278 1 20 . 1 1 42 42 GLN N N 42 131.724 131.724 116.673 15.051 25259 15279 1 20 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.838 0.773 25259 15280 1 20 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.877 -2.805 25259 15281 1 20 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.406 -2.087 25259 15282 1 20 . 1 1 42 42 GLN H H 42 9.189 9.189 8.560 0.629 25259 15283 1 20 . 1 1 43 43 THR N N 43 122.202 122.202 116.797 5.405 25259 15284 1 20 . 1 1 43 43 THR HA H 43 5.380 5.380 4.931 0.449 25259 15285 1 20 . 1 1 43 43 THR CA C 43 58.863 58.863 62.108 -3.245 25259 15286 1 20 . 1 1 43 43 THR CB C 43 68.893 68.893 71.192 -2.299 25259 15287 1 20 . 1 1 43 43 THR H H 43 9.139 9.139 8.820 0.319 25259 15288 1 20 . 1 1 44 44 GLN N N 44 127.190 127.190 127.679 -0.489 25259 15289 1 20 . 1 1 44 44 GLN HA H 44 5.634 5.634 4.927 0.707 25259 15290 1 20 . 1 1 44 44 GLN CA C 44 51.668 51.668 56.189 -4.521 25259 15291 1 20 . 1 1 44 44 GLN CB C 44 28.910 28.910 30.608 -1.698 25259 15292 1 20 . 1 1 44 44 GLN H H 44 9.760 9.760 8.971 0.789 25259 15293 1 20 . 1 1 45 45 THR N N 45 123.479 123.479 113.980 9.499 25259 15294 1 20 . 1 1 45 45 THR HA H 45 5.421 5.421 5.216 0.205 25259 15295 1 20 . 1 1 45 45 THR CA C 45 60.071 60.071 60.544 -0.473 25259 15296 1 20 . 1 1 45 45 THR CB C 45 67.541 67.541 71.732 -4.191 25259 15297 1 20 . 1 1 45 45 THR H H 45 9.518 9.518 9.083 0.435 25259 15298 1 20 . 1 1 46 46 ILE N N 46 133.908 133.908 123.426 10.482 25259 15299 1 20 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.713 0.290 25259 15300 1 20 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.660 -2.189 25259 15301 1 20 . 1 1 46 46 ILE CB C 46 39.945 39.945 41.898 -1.954 25259 15302 1 20 . 1 1 46 46 ILE H H 46 9.830 9.830 9.261 0.569 25259 15303 1 20 . 1 1 47 47 THR N N 47 124.701 124.701 123.445 1.256 25259 15304 1 20 . 1 1 47 47 THR HA H 47 6.048 6.048 5.466 0.582 25259 15305 1 20 . 1 1 47 47 THR CA C 47 58.551 58.551 61.342 -2.791 25259 15306 1 20 . 1 1 47 47 THR CB C 47 67.819 67.819 71.173 -3.354 25259 15307 1 20 . 1 1 47 47 THR H H 47 8.843 8.843 8.648 0.195 25259 15308 1 20 . 1 1 48 48 TYR N N 48 127.369 127.369 122.283 5.086 25259 15309 1 20 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.245 0.033 25259 15310 1 20 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.132 -2.403 25259 15311 1 20 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.574 -2.142 25259 15312 1 20 . 1 1 48 48 TYR H H 48 9.638 9.638 9.022 0.616 25259 15313 1 20 . 1 1 49 49 LYS N N 49 122.138 122.138 117.733 4.405 25259 15314 1 20 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.523 0.133 25259 15315 1 20 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.428 -3.456 25259 15316 1 20 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.072 -0.469 25259 15317 1 20 . 1 1 49 49 LYS H H 49 8.560 8.560 8.858 -0.298 25259 15318 1 20 . 1 1 50 50 ASP N N 50 130.208 130.208 120.736 9.472 25259 15319 1 20 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.706 -0.402 25259 15320 1 20 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.045 -0.285 25259 15321 1 20 . 1 1 50 50 ASP CB C 50 37.339 37.339 43.177 -5.838 25259 15322 1 20 . 1 1 50 50 ASP H H 50 9.597 9.597 8.529 1.068 25259 15323 1 20 . 1 1 51 51 LYS N N 51 124.586 124.586 117.481 7.105 25259 15324 1 20 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.354 0.177 25259 15325 1 20 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.410 -2.676 25259 15326 1 20 . 1 1 51 51 LYS CB C 51 30.395 30.395 33.810 -3.415 25259 15327 1 20 . 1 1 51 51 LYS H H 51 8.450 8.450 7.953 0.497 25259 15328 1 20 . 1 1 52 52 THR N N 52 120.044 120.044 114.619 5.425 25259 15329 1 20 . 1 1 52 52 THR HA H 52 4.717 4.717 4.528 0.189 25259 15330 1 20 . 1 1 52 52 THR CA C 52 59.313 59.313 61.374 -2.061 25259 15331 1 20 . 1 1 52 52 THR CB C 52 68.815 68.815 71.438 -2.623 25259 15332 1 20 . 1 1 52 52 THR H H 52 8.658 8.658 7.504 1.154 25259 15333 1 20 . 1 1 53 53 PHE N N 53 128.987 128.987 123.922 5.065 25259 15334 1 20 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.464 -0.181 25259 15335 1 20 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.346 -1.357 25259 15336 1 20 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.999 0.312 25259 15337 1 20 . 1 1 53 53 PHE H H 53 9.218 9.218 8.885 0.333 25259 15338 1 20 . 1 1 54 54 LEU N N 54 124.874 124.874 125.657 -0.783 25259 15339 1 20 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.330 0.599 25259 15340 1 20 . 1 1 54 54 LEU CA C 54 54.241 54.241 57.396 -3.155 25259 15341 1 20 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.566 -2.049 25259 15342 1 20 . 1 1 54 54 LEU H H 54 9.391 9.391 8.650 0.741 25259 15343 1 20 . 1 1 55 55 SER N N 55 115.516 115.516 109.372 6.144 25259 15344 1 20 . 1 1 55 55 SER HA H 55 5.194 5.194 5.371 -0.177 25259 15345 1 20 . 1 1 55 55 SER CA C 55 55.818 55.818 57.417 -1.599 25259 15346 1 20 . 1 1 55 55 SER CB C 55 63.474 63.474 66.514 -3.040 25259 15347 1 20 . 1 1 55 55 SER H H 55 8.736 8.736 7.915 0.821 25259 15348 1 20 . 1 1 56 56 LEU N N 56 124.352 124.352 120.906 3.446 25259 15349 1 20 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.439 0.104 25259 15350 1 20 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.266 -2.629 25259 15351 1 20 . 1 1 56 56 LEU CB C 56 45.513 45.513 47.062 -1.549 25259 15352 1 20 . 1 1 56 56 LEU H H 56 8.328 8.328 8.388 -0.060 25259 15353 1 20 . 1 1 57 57 ALA N N 57 131.450 131.450 124.708 6.742 25259 15354 1 20 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.539 -0.034 25259 15355 1 20 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.452 -2.250 25259 15356 1 20 . 1 1 57 57 ALA CB C 57 18.964 18.964 22.947 -3.983 25259 15357 1 20 . 1 1 57 57 ALA H H 57 9.208 9.208 8.896 0.312 25259 15358 1 20 . 1 1 58 58 ILE N N 58 126.248 126.248 119.750 6.498 25259 15359 1 20 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.609 0.175 25259 15360 1 20 . 1 1 58 58 ILE CA C 58 58.247 58.247 60.838 -2.591 25259 15361 1 20 . 1 1 58 58 ILE CB C 58 38.045 38.045 41.259 -3.214 25259 15362 1 20 . 1 1 58 58 ILE H H 58 9.597 9.597 9.129 0.468 25259 15363 1 20 . 1 1 59 59 GLN N N 59 132.065 132.065 127.201 4.864 25259 15364 1 20 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.635 0.612 25259 15365 1 20 . 1 1 59 59 GLN CA C 59 52.164 52.164 56.230 -4.066 25259 15366 1 20 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.869 -1.208 25259 15367 1 20 . 1 1 59 59 GLN H H 59 9.389 9.389 8.986 0.403 25259 15368 1 20 . 1 1 60 60 GLN N N 60 130.314 130.314 123.418 6.896 25259 15369 1 20 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.878 0.331 25259 15370 1 20 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.043 -3.022 25259 15371 1 20 . 1 1 60 60 GLN CB C 60 29.476 29.476 32.977 -3.501 25259 15372 1 20 . 1 1 60 60 GLN H H 60 9.471 9.471 9.178 0.293 25259 15373 1 20 . 1 1 61 61 LYS N N 61 131.044 131.044 127.448 3.596 25259 15374 1 20 . 1 1 61 61 LYS HA H 61 5.415 5.415 4.913 0.502 25259 15375 1 20 . 1 1 61 61 LYS CA C 61 53.120 53.120 55.984 -2.864 25259 15376 1 20 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.796 -3.379 25259 15377 1 20 . 1 1 61 61 LYS H H 61 8.893 8.893 9.069 -0.176 25259 15378 1 20 . 1 1 62 62 ARG N N 62 125.397 125.397 123.738 1.659 25259 15379 1 20 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.048 -0.045 25259 15380 1 20 . 1 1 62 62 ARG CA C 62 51.091 51.091 52.856 -1.765 25259 15381 1 20 . 1 1 62 62 ARG CB C 62 29.878 29.878 30.728 -0.850 25259 15382 1 20 . 1 1 62 62 ARG H H 62 9.120 9.120 7.991 1.129 25259 15383 1 20 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.773 0.202 25259 15384 1 20 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.402 -2.905 25259 15385 1 20 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.406 -2.522 25259 15386 1 20 . 1 1 64 64 VAL N N 64 121.305 121.305 115.263 6.042 25259 15387 1 20 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.533 -0.509 25259 15388 1 20 . 1 1 64 64 VAL CA C 64 59.677 59.677 60.597 -0.920 25259 15389 1 20 . 1 1 64 64 VAL CB C 64 30.365 30.365 34.611 -4.246 25259 15390 1 20 . 1 1 64 64 VAL H H 64 7.520 7.520 7.919 -0.399 25259 15391 1 20 . 1 1 65 65 SER N N 65 123.215 123.215 116.081 7.134 25259 15392 1 20 . 1 1 65 65 SER HA H 65 4.521 4.521 4.601 -0.080 25259 15393 1 20 . 1 1 65 65 SER CA C 65 54.897 54.897 59.057 -4.160 25259 15394 1 20 . 1 1 65 65 SER CB C 65 62.564 62.564 63.678 -1.114 25259 15395 1 20 . 1 1 65 65 SER H H 65 8.080 8.080 8.605 -0.525 25259 15396 1 20 . 1 1 66 66 ASP N N 66 123.802 123.802 121.671 2.131 25259 15397 1 20 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.725 -0.296 25259 15398 1 20 . 1 1 66 66 ASP CA C 66 55.378 55.378 55.154 0.224 25259 15399 1 20 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.734 -2.696 25259 15400 1 20 . 1 1 66 66 ASP H H 66 8.900 8.900 8.055 0.845 25259 15401 1 20 . 1 1 67 67 GLU N N 67 121.943 121.943 120.875 1.068 25259 15402 1 20 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.127 0.062 25259 15403 1 20 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.316 -1.876 25259 15404 1 20 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.568 -2.783 25259 15405 1 20 . 1 1 67 67 GLU H H 67 8.717 8.717 8.499 0.218 25259 15406 1 20 . 1 1 68 68 LEU N N 68 125.458 125.458 118.656 6.802 25259 15407 1 20 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.336 0.007 25259 15408 1 20 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.772 -2.300 25259 15409 1 20 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.855 -2.451 25259 15410 1 20 . 1 1 68 68 LEU H H 68 7.820 7.820 8.078 -0.258 25259 15411 1 20 . 1 1 69 69 LYS N N 69 123.868 123.868 119.737 4.131 25259 15412 1 20 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.101 -0.095 25259 15413 1 20 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.105 -1.488 25259 15414 1 20 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.913 -1.876 25259 15415 1 20 . 1 1 69 69 LYS H H 69 8.690 8.690 7.682 1.008 25259 15416 1 20 . 1 1 70 70 THR N N 70 117.109 117.109 116.667 0.442 25259 15417 1 20 . 1 1 70 70 THR HA H 70 4.088 4.088 4.035 0.053 25259 15418 1 20 . 1 1 70 70 THR CA C 70 63.879 63.879 66.769 -2.890 25259 15419 1 20 . 1 1 70 70 THR CB C 70 66.383 66.383 68.835 -2.452 25259 15420 1 20 . 1 1 70 70 THR H H 70 7.935 7.935 7.790 0.145 25259 15421 1 20 . 1 1 71 71 TYR N N 71 127.006 127.006 123.366 3.640 25259 15422 1 20 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.226 -0.021 25259 15423 1 20 . 1 1 71 71 TYR CA C 71 60.225 60.225 62.132 -1.907 25259 15424 1 20 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.284 -1.739 25259 15425 1 20 . 1 1 71 71 TYR H H 71 7.683 7.683 7.549 0.134 25259 15426 1 20 . 1 1 72 72 ILE N N 72 125.064 125.064 118.320 6.744 25259 15427 1 20 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.840 -0.161 25259 15428 1 20 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.069 -2.174 25259 15429 1 20 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.728 -1.452 25259 15430 1 20 . 1 1 72 72 ILE H H 72 9.083 9.083 8.702 0.381 25259 15431 1 20 . 1 1 73 73 ASP N N 73 124.900 124.900 119.909 4.991 25259 15432 1 20 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.481 -0.092 25259 15433 1 20 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.424 -1.386 25259 15434 1 20 . 1 1 73 73 ASP CB C 73 38.107 38.107 41.296 -3.189 25259 15435 1 20 . 1 1 73 73 ASP H H 73 8.751 8.751 7.802 0.949 25259 15436 1 20 . 1 1 74 74 GLN N N 74 117.025 117.025 117.367 -0.342 25259 15437 1 20 . 1 1 74 74 GLN HA H 74 4.138 4.138 3.995 0.143 25259 15438 1 20 . 1 1 74 74 GLN CA C 74 54.810 54.810 57.944 -3.135 25259 15439 1 20 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.331 -1.767 25259 15440 1 20 . 1 1 74 74 GLN H H 74 7.447 7.447 8.187 -0.740 25259 15441 1 20 . 1 1 75 75 HIS N N 75 116.494 116.494 114.591 1.903 25259 15442 1 20 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.640 0.076 25259 15443 1 20 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.174 -2.108 25259 15444 1 20 . 1 1 75 75 HIS CB C 75 28.302 28.302 33.246 -4.944 25259 15445 1 20 . 1 1 75 75 HIS H H 75 8.402 8.402 8.239 0.163 25259 15446 1 20 . 1 1 76 76 GLY N N 76 112.564 112.564 106.341 6.223 25259 15447 1 20 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.646 -2.750 25259 15448 1 20 . 1 1 76 76 GLY H H 76 9.091 9.091 8.061 1.030 25259 15449 1 20 . 1 1 77 77 VAL N N 77 124.763 124.763 121.295 3.468 25259 15450 1 20 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.761 -0.196 25259 15451 1 20 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.218 -0.267 25259 15452 1 20 . 1 1 77 77 VAL CB C 77 29.838 29.838 31.680 -1.842 25259 15453 1 20 . 1 1 77 77 VAL H H 77 8.927 8.927 8.653 0.274 25259 15454 1 20 . 1 1 78 78 GLU N N 78 124.388 124.388 118.592 5.796 25259 15455 1 20 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.216 -0.068 25259 15456 1 20 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.076 -0.760 25259 15457 1 20 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.946 -2.487 25259 15458 1 20 . 1 1 78 78 GLU H H 78 8.781 8.781 8.720 0.061 25259 15459 1 20 . 1 1 79 79 GLU N N 79 121.887 121.887 118.207 3.680 25259 15460 1 20 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.202 -0.014 25259 15461 1 20 . 1 1 79 79 GLU CA C 79 56.545 56.545 59.033 -2.489 25259 15462 1 20 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.419 -2.386 25259 15463 1 20 . 1 1 79 79 GLU H H 79 9.231 9.231 8.614 0.617 25259 15464 1 20 . 1 1 80 80 THR N N 80 120.781 120.781 115.736 5.045 25259 15465 1 20 . 1 1 80 80 THR HA H 80 4.059 4.059 3.715 0.344 25259 15466 1 20 . 1 1 80 80 THR CA C 80 65.487 65.487 66.337 -0.850 25259 15467 1 20 . 1 1 80 80 THR CB C 80 64.369 64.369 68.449 -4.080 25259 15468 1 20 . 1 1 80 80 THR H H 80 7.858 7.858 7.986 -0.128 25259 15469 1 20 . 1 1 81 81 GLN N N 81 125.303 125.303 119.936 5.367 25259 15470 1 20 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.983 0.061 25259 15471 1 20 . 1 1 81 81 GLN CA C 81 56.969 56.969 58.790 -1.821 25259 15472 1 20 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.293 -2.216 25259 15473 1 20 . 1 1 81 81 GLN H H 81 8.765 8.765 7.708 1.057 25259 15474 1 20 . 1 1 82 82 LYS N N 82 120.458 120.458 118.997 1.461 25259 15475 1 20 . 1 1 82 82 LYS HA H 82 4.089 4.089 4.003 0.086 25259 15476 1 20 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.016 -0.704 25259 15477 1 20 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.771 -1.617 25259 15478 1 20 . 1 1 82 82 LYS H H 82 7.521 7.521 7.919 -0.398 25259 15479 1 20 . 1 1 83 83 ALA N N 83 125.234 125.234 122.687 2.547 25259 15480 1 20 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.632 0.585 25259 15481 1 20 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.694 -2.252 25259 15482 1 20 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.368 -2.081 25259 15483 1 20 . 1 1 83 83 ALA H H 83 7.782 7.782 7.440 0.342 25259 15484 1 20 . 1 1 84 84 LEU N N 84 123.348 123.348 115.984 7.364 25259 15485 1 20 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.998 0.060 25259 15486 1 20 . 1 1 84 84 LEU CA C 84 55.499 55.499 56.810 -1.311 25259 15487 1 20 . 1 1 84 84 LEU CB C 84 39.308 39.308 40.269 -0.961 25259 15488 1 20 . 1 1 84 84 LEU H H 84 8.590 8.590 7.448 1.142 25259 15489 1 20 . 1 1 85 85 LEU N N 85 122.872 122.872 119.675 3.197 25259 15490 1 20 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.897 0.273 25259 15491 1 20 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.685 -2.289 25259 15492 1 20 . 1 1 85 85 LEU CB C 85 38.741 38.741 41.317 -2.576 25259 15493 1 20 . 1 1 85 85 LEU H H 85 7.892 7.892 7.413 0.479 25259 15494 1 20 . 1 1 86 86 GLU N N 86 122.713 122.713 119.607 3.106 25259 15495 1 20 . 1 1 86 86 GLU HA H 86 4.085 4.085 3.956 0.129 25259 15496 1 20 . 1 1 86 86 GLU CA C 86 56.745 56.745 59.513 -2.768 25259 15497 1 20 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.639 -2.736 25259 15498 1 20 . 1 1 86 86 GLU H H 86 8.124 8.124 8.493 -0.369 25259 15499 1 20 . 1 1 87 87 ALA N N 87 123.163 123.163 119.497 3.666 25259 15500 1 20 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.251 -0.110 25259 15501 1 20 . 1 1 87 87 ALA CA C 87 52.268 52.268 53.794 -1.526 25259 15502 1 20 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.352 -2.720 25259 15503 1 20 . 1 1 87 87 ALA H H 87 7.765 7.765 7.509 0.256 25259 15504 1 20 . 1 1 88 88 GLU N N 88 121.945 121.945 118.656 3.289 25259 15505 1 20 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.027 0.057 25259 15506 1 20 . 1 1 88 88 GLU CA C 88 56.935 56.935 59.207 -2.272 25259 15507 1 20 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.800 -1.773 25259 15508 1 20 . 1 1 88 88 GLU H H 88 7.846 7.846 7.682 0.164 25259 15509 1 20 . 1 1 89 89 GLU N N 89 117.978 117.978 117.736 0.242 25259 15510 1 20 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.143 -0.050 25259 15511 1 20 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.396 -3.182 25259 15512 1 20 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.305 -1.897 25259 15513 1 20 . 1 1 89 89 GLU H H 89 7.634 7.634 7.704 -0.070 25259 15514 1 20 . 1 1 90 90 LYS N N 90 117.519 117.519 117.794 -0.275 25259 15515 1 20 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.327 0.104 25259 15516 1 20 . 1 1 90 90 LYS CA C 90 53.018 53.018 56.566 -3.548 25259 15517 1 20 . 1 1 90 90 LYS CB C 90 31.031 31.031 33.065 -2.034 25259 15518 1 20 . 1 1 90 90 LYS H H 90 7.247 7.247 7.529 -0.282 25259 15519 1 20 . 1 1 91 91 ASP N N 91 124.888 124.888 121.225 3.663 25259 15520 1 20 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.724 -0.041 25259 15521 1 20 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.014 -1.815 25259 15522 1 20 . 1 1 91 91 ASP CB C 91 39.581 39.581 41.655 -2.074 25259 15523 1 20 . 1 1 91 91 ASP H H 91 7.370 7.370 7.471 -0.101 25259 15524 1 20 . 1 1 92 92 LYS N N 92 129.311 129.311 127.722 1.589 25259 15525 1 20 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.858 0.155 25259 15526 1 20 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.822 -2.606 25259 15527 1 20 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.532 -2.517 25259 15528 1 20 . 1 1 92 92 LYS H H 92 8.795 8.795 8.795 -0.000 25259 15529 1 20 . 1 1 93 93 SER N N 93 118.112 118.112 114.519 3.593 25259 15530 1 20 . 1 1 93 93 SER HA H 93 4.439 4.439 4.442 -0.003 25259 15531 1 20 . 1 1 93 93 SER CA C 93 58.945 58.945 61.997 -3.052 25259 15532 1 20 . 1 1 93 93 SER CB C 93 60.278 60.278 63.191 -2.913 25259 15533 1 20 . 1 1 93 93 SER H H 93 8.488 8.488 8.434 0.054 25259 15534 1 20 . 1 1 94 94 ILE N N 94 128.950 128.950 122.364 6.586 25259 15535 1 20 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.530 -0.048 25259 15536 1 20 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.567 -2.218 25259 15537 1 20 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.642 -2.889 25259 15538 1 20 . 1 1 94 94 ILE H H 94 7.722 7.722 7.393 0.329 25259 15539 1 20 . 1 1 95 95 ILE N N 95 123.598 123.598 120.356 3.242 25259 15540 1 20 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.567 0.028 25259 15541 1 20 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.288 -2.542 25259 15542 1 20 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.578 -1.606 25259 15543 1 20 . 1 1 95 95 ILE H H 95 8.378 8.378 8.210 0.168 25259 15544 1 20 . 1 1 96 96 GLU N N 96 118.317 118.317 117.421 0.896 25259 15545 1 20 . 1 1 96 96 GLU HA H 96 3.984 3.984 4.071 -0.087 25259 15546 1 20 . 1 1 96 96 GLU CA C 96 56.495 56.495 58.650 -2.155 25259 15547 1 20 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.872 -2.699 25259 15548 1 20 . 1 1 96 96 GLU H H 96 7.680 7.680 7.503 0.177 25259 15549 1 20 . 1 1 97 97 ALA N N 97 124.797 124.797 122.330 2.467 25259 15550 1 20 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.720 0.105 25259 15551 1 20 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.521 -2.224 25259 15552 1 20 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.468 -2.479 25259 15553 1 20 . 1 1 97 97 ALA H H 97 7.383 7.383 7.958 -0.575 25259 15554 1 20 . 1 1 98 98 ARG N N 98 115.469 115.469 115.234 0.235 25259 15555 1 20 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.294 0.012 25259 15556 1 20 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.773 -1.283 25259 15557 1 20 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.979 -1.740 25259 15558 1 20 . 1 1 98 98 ARG H H 98 8.229 8.229 7.768 0.461 25259 15559 1 20 . 1 1 99 99 LYS N N 99 120.219 120.219 117.256 2.963 25259 15560 1 20 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.244 0.014 25259 15561 1 20 . 1 1 99 99 LYS CA C 99 55.241 55.241 55.801 -0.560 25259 15562 1 20 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.490 -1.994 25259 15563 1 20 . 1 1 99 99 LYS H H 99 7.270 7.270 7.764 -0.494 25259 15564 1 20 . 1 1 100 100 LEU N N 100 123.800 123.800 120.809 2.991 25259 15565 1 20 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.573 -0.232 25259 15566 1 20 . 1 1 100 100 LEU CA C 100 52.079 52.079 53.769 -1.690 25259 15567 1 20 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.308 -3.177 25259 15568 1 20 . 1 1 100 100 LEU H H 100 7.837 7.837 7.629 0.208 25259 15569 1 20 . 1 1 101 101 ALA N N 101 130.512 130.512 124.632 5.880 25259 15570 1 20 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.390 -0.014 25259 15571 1 20 . 1 1 101 101 ALA CA C 101 50.404 50.404 53.410 -3.006 25259 15572 1 20 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.811 -3.015 25259 15573 1 20 . 1 1 101 101 ALA H H 101 8.213 8.213 9.016 -0.803 25259 15574 1 20 . 1 1 102 102 GLY N N 102 110.659 110.659 105.071 5.588 25259 15575 1 20 . 1 1 102 102 GLY CA C 102 43.893 43.893 44.721 -0.828 25259 15576 1 20 . 1 1 102 102 GLY H H 102 8.738 8.738 7.939 0.799 25259 15577 1 20 . 1 1 103 103 PHE N N 103 123.097 123.097 121.949 1.148 25259 15578 1 20 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.353 -0.133 25259 15579 1 20 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.498 -2.730 25259 15580 1 20 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.333 -1.759 25259 15581 1 20 . 1 1 103 103 PHE H H 103 7.514 7.514 7.443 0.071 25259 15582 1 20 . 1 1 104 104 LYS N N 104 130.652 130.652 124.696 5.956 25259 15583 1 20 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.156 -0.036 25259 15584 1 20 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.470 -1.491 25259 15585 1 20 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.881 -2.644 25259 15586 1 20 . 1 1 104 104 LYS H H 104 7.473 7.473 7.632 -0.159 25259 15587 1 20 . 1 1 105 105 LEU N N 105 127.372 127.372 121.184 6.188 25259 15588 1 20 . 1 1 105 105 LEU HA H 105 4.996 4.996 5.195 -0.199 25259 15589 1 20 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.422 -1.686 25259 15590 1 20 . 1 1 105 105 LEU CB C 105 43.964 43.964 46.099 -2.135 25259 15591 1 20 . 1 1 105 105 LEU H H 105 8.393 8.393 8.184 0.209 25259 15592 1 20 . 1 1 106 106 GLU N N 106 129.358 129.358 123.413 5.945 25259 15593 1 20 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.698 0.146 25259 15594 1 20 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.421 -2.631 25259 15595 1 20 . 1 1 106 106 GLU CB C 106 31.628 31.628 34.030 -2.402 25259 15596 1 20 . 1 1 106 106 GLU H H 106 8.849 8.849 8.855 -0.006 25259 15597 1 20 . 1 1 107 107 THR N N 107 131.118 131.118 118.809 12.309 25259 15598 1 20 . 1 1 107 107 THR HA H 107 5.110 5.110 5.013 0.097 25259 15599 1 20 . 1 1 107 107 THR CA C 107 59.832 59.832 60.795 -0.963 25259 15600 1 20 . 1 1 107 107 THR CB C 107 66.671 66.671 71.039 -4.368 25259 15601 1 20 . 1 1 107 107 THR H H 107 9.433 9.433 8.362 1.071 25259 15602 1 20 . 1 1 108 108 LYS N N 108 129.114 129.114 122.324 6.790 25259 15603 1 20 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.663 0.161 25259 15604 1 20 . 1 1 108 108 LYS CA C 108 52.194 52.194 54.627 -2.433 25259 15605 1 20 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.474 -1.086 25259 15606 1 20 . 1 1 108 108 LYS H H 108 9.410 9.410 9.094 0.316 25259 15607 1 20 . 1 1 109 109 LEU N N 109 129.323 129.323 126.798 2.525 25259 15608 1 20 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.387 0.317 25259 15609 1 20 . 1 1 109 109 LEU CA C 109 52.108 52.108 55.205 -3.097 25259 15610 1 20 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.237 -2.582 25259 15611 1 20 . 1 1 109 109 LEU H H 109 8.862 8.862 8.631 0.231 25259 15612 1 20 . 1 1 110 110 LEU N N 110 129.123 129.123 127.185 1.938 25259 15613 1 20 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.353 -0.130 25259 15614 1 20 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.510 -2.728 25259 15615 1 20 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.709 -2.048 25259 15616 1 20 . 1 1 110 110 LEU H H 110 8.373 8.373 8.433 -0.060 25259 15617 1 20 . 1 1 111 111 SER N N 111 114.587 114.587 110.171 4.416 25259 15618 1 20 . 1 1 111 111 SER HA H 111 4.557 4.557 4.534 0.023 25259 15619 1 20 . 1 1 111 111 SER CA C 111 53.889 53.889 57.151 -3.262 25259 15620 1 20 . 1 1 111 111 SER CB C 111 61.830 61.830 64.642 -2.812 25259 15621 1 20 . 1 1 111 111 SER H H 111 8.400 8.400 7.943 0.457 25259 15622 1 20 . 1 1 112 112 ALA N N 112 118.269 118.269 123.000 -4.731 25259 15623 1 20 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.348 -0.039 25259 15624 1 20 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.247 -3.033 25259 15625 1 20 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.116 -1.528 25259 15626 1 20 . 1 1 112 112 ALA H H 112 8.556 8.556 8.587 -0.031 25259 15627 1 20 . 1 1 113 113 THR N N 113 102.878 102.878 102.568 0.310 25259 15628 1 20 . 1 1 113 113 THR HA H 113 4.662 4.662 4.430 0.232 25259 15629 1 20 . 1 1 113 113 THR CA C 113 58.689 58.689 61.926 -3.237 25259 15630 1 20 . 1 1 113 113 THR CB C 113 67.905 67.905 70.022 -2.116 25259 15631 1 20 . 1 1 113 113 THR H H 113 8.065 8.065 7.621 0.444 25259 15632 1 20 . 1 1 114 114 GLU N N 114 126.514 126.514 119.356 7.158 25259 15633 1 20 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.851 0.163 25259 15634 1 20 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.629 -1.622 25259 15635 1 20 . 1 1 114 114 GLU CB C 114 32.913 32.913 33.503 -0.590 25259 15636 1 20 . 1 1 114 114 GLU H H 114 7.357 7.357 7.970 -0.613 25259 15637 1 20 . 1 1 115 115 LEU N N 115 128.058 128.058 118.183 9.875 25259 15638 1 20 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.253 -0.331 25259 15639 1 20 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.880 -1.556 25259 15640 1 20 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.131 -1.992 25259 15641 1 20 . 1 1 115 115 LEU H H 115 8.930 8.930 8.257 0.673 25259 15642 1 20 . 1 1 116 116 GLN N N 116 126.540 126.540 117.549 8.991 25259 15643 1 20 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.030 0.685 25259 15644 1 20 . 1 1 116 116 GLN CA C 116 51.700 51.700 55.057 -3.357 25259 15645 1 20 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.236 -0.944 25259 15646 1 20 . 1 1 116 116 GLN H H 116 9.221 9.221 9.020 0.201 25259 15647 1 20 . 1 1 117 117 THR N N 117 125.213 125.213 119.028 6.185 25259 15648 1 20 . 1 1 117 117 THR HA H 117 5.353 5.353 5.298 0.055 25259 15649 1 20 . 1 1 117 117 THR CA C 117 58.926 58.926 61.007 -2.081 25259 15650 1 20 . 1 1 117 117 THR CB C 117 68.948 68.948 72.309 -3.361 25259 15651 1 20 . 1 1 117 117 THR H H 117 9.030 9.030 9.025 0.005 25259 15652 1 20 . 1 1 118 118 THR N N 118 127.799 127.799 119.518 8.281 25259 15653 1 20 . 1 1 118 118 THR HA H 118 5.527 5.527 5.220 0.307 25259 15654 1 20 . 1 1 118 118 THR CA C 118 59.201 59.201 61.867 -2.666 25259 15655 1 20 . 1 1 118 118 THR CB C 118 67.721 67.721 72.004 -4.283 25259 15656 1 20 . 1 1 118 118 THR H H 118 9.459 9.459 8.962 0.497 25259 15657 1 20 . 1 1 119 119 THR N N 119 129.258 129.258 122.228 7.030 25259 15658 1 20 . 1 1 119 119 THR HA H 119 4.885 4.885 4.885 0.000 25259 15659 1 20 . 1 1 119 119 THR CA C 119 58.463 58.463 61.273 -2.810 25259 15660 1 20 . 1 1 119 119 THR CB C 119 67.459 67.459 71.092 -3.633 25259 15661 1 20 . 1 1 119 119 THR H H 119 9.147 9.147 9.087 0.060 25259 15662 1 20 . 1 1 120 120 SER N N 120 123.389 123.389 119.821 3.568 25259 15663 1 20 . 1 1 120 120 SER HA H 120 5.328 5.328 4.976 0.352 25259 15664 1 20 . 1 1 120 120 SER CA C 120 54.386 54.386 56.412 -2.026 25259 15665 1 20 . 1 1 120 120 SER CB C 120 63.031 63.031 65.408 -2.377 25259 15666 1 20 . 1 1 120 120 SER H H 120 8.786 8.786 8.587 0.199 25259 15667 1 20 . 1 1 121 121 PHE N N 121 121.245 121.245 123.033 -1.788 25259 15668 1 20 . 1 1 121 121 PHE HA H 121 5.112 5.112 5.042 0.070 25259 15669 1 20 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.174 -2.982 25259 15670 1 20 . 1 1 121 121 PHE CB C 121 40.265 40.265 40.889 -0.625 25259 15671 1 20 . 1 1 121 121 PHE H H 121 8.831 8.831 9.155 -0.324 25259 15672 1 20 . 1 1 122 122 ASP N N 122 124.765 124.765 126.311 -1.546 25259 15673 1 20 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.771 0.069 25259 15674 1 20 . 1 1 122 122 ASP CA C 122 49.837 49.837 54.403 -4.566 25259 15675 1 20 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.279 -1.794 25259 15676 1 20 . 1 1 122 122 ASP H H 122 8.819 8.819 8.947 -0.128 25259 15677 1 20 . 1 1 123 123 PHE N N 123 124.303 124.303 123.288 1.015 25259 15678 1 20 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.251 0.423 25259 15679 1 20 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.936 -3.138 25259 15680 1 20 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.775 -3.235 25259 15681 1 20 . 1 1 123 123 PHE H H 123 8.262 8.262 7.930 0.332 25259 15682 1 20 . 1 1 124 124 GLN N N 124 120.792 120.792 117.395 3.397 25259 15683 1 20 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.170 0.264 25259 15684 1 20 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.406 -2.323 25259 15685 1 20 . 1 1 124 124 GLN CB C 124 27.129 27.129 29.040 -1.911 25259 15686 1 20 . 1 1 124 124 GLN H H 124 8.954 8.954 8.090 0.864 25259 15687 1 20 . 1 1 125 125 VAL N N 125 114.091 114.091 110.502 3.589 25259 15688 1 20 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.406 0.003 25259 15689 1 20 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.480 -2.182 25259 15690 1 20 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.426 -0.854 25259 15691 1 20 . 1 1 125 125 VAL H H 125 7.026 7.026 7.893 -0.867 25259 15692 1 20 . 1 1 126 126 LEU N N 126 125.158 125.158 121.622 3.536 25259 15693 1 20 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.636 -0.161 25259 15694 1 20 . 1 1 126 126 LEU CA C 126 53.175 53.175 54.477 -1.302 25259 15695 1 20 . 1 1 126 126 LEU CB C 126 42.054 42.054 44.265 -2.211 25259 15696 1 20 . 1 1 126 126 LEU H H 126 8.106 8.106 7.589 0.517 25259 15697 1 20 . 1 1 127 127 ASP N N 127 130.026 130.026 126.044 3.982 25259 15698 1 20 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.733 0.108 25259 15699 1 20 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.420 -3.223 25259 15700 1 20 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.672 -2.982 25259 15701 1 20 . 1 1 127 127 ASP H H 127 9.129 9.129 8.728 0.401 25259 15702 1 20 . 1 1 128 128 VAL N N 128 128.833 128.833 126.631 2.202 25259 15703 1 20 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.812 -0.288 25259 15704 1 20 . 1 1 128 128 VAL CA C 128 63.668 63.668 65.375 -1.707 25259 15705 1 20 . 1 1 128 128 VAL CB C 128 29.495 29.495 32.243 -2.748 25259 15706 1 20 . 1 1 128 128 VAL H H 128 8.288 8.288 8.166 0.122 25259 15707 1 20 . 1 1 129 129 LYS N N 129 123.914 123.914 119.273 4.641 25259 15708 1 20 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.050 -0.007 25259 15709 1 20 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.350 -1.561 25259 15710 1 20 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.786 -2.849 25259 15711 1 20 . 1 1 129 129 LYS H H 129 8.226 8.226 7.683 0.543 25259 15712 1 20 . 1 1 130 130 LYS N N 130 121.888 121.888 118.080 3.808 25259 15713 1 20 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.148 -0.063 25259 15714 1 20 . 1 1 130 130 LYS CA C 130 56.146 56.146 58.691 -2.545 25259 15715 1 20 . 1 1 130 130 LYS CB C 130 30.340 30.340 33.066 -2.726 25259 15716 1 20 . 1 1 130 130 LYS H H 130 7.590 7.590 7.968 -0.378 25259 15717 1 20 . 1 1 131 131 ALA N N 131 123.088 123.088 122.349 0.739 25259 15718 1 20 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.112 -0.185 25259 15719 1 20 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.192 -2.790 25259 15720 1 20 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.239 -1.792 25259 15721 1 20 . 1 1 131 131 ALA H H 131 8.506 8.506 8.498 0.008 25259 15722 1 20 . 1 1 132 132 SER N N 132 110.456 110.456 111.124 -0.668 25259 15723 1 20 . 1 1 132 132 SER HA H 132 4.117 4.117 4.588 -0.471 25259 15724 1 20 . 1 1 132 132 SER CA C 132 58.289 58.289 59.222 -0.933 25259 15725 1 20 . 1 1 132 132 SER CB C 132 61.034 61.034 63.607 -2.573 25259 15726 1 20 . 1 1 132 132 SER H H 132 7.986 7.986 7.705 0.281 25259 15727 1 20 . 1 1 133 133 GLN N N 133 119.034 119.034 117.411 1.623 25259 15728 1 20 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.645 -0.243 25259 15729 1 20 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.699 -2.174 25259 15730 1 20 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.876 -2.642 25259 15731 1 20 . 1 1 133 133 GLN H H 133 7.233 7.233 8.274 -1.041 25259 15732 1 20 . 1 1 134 134 LEU N N 134 123.291 123.291 123.555 -0.264 25259 15733 1 20 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.351 0.042 25259 15734 1 20 . 1 1 134 134 LEU CA C 134 52.316 52.316 54.923 -2.607 25259 15735 1 20 . 1 1 134 134 LEU CB C 134 38.847 38.847 39.606 -0.759 25259 15736 1 20 . 1 1 134 134 LEU H H 134 7.411 7.411 7.614 -0.203 25259 15737 1 20 . 1 1 135 135 GLU N N 135 128.446 128.446 122.631 5.815 25259 15738 1 20 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.715 0.231 25259 15739 1 20 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.516 -2.132 25259 15740 1 20 . 1 1 135 135 GLU CB C 135 27.296 27.296 28.473 -1.177 25259 15741 1 20 . 1 1 135 135 GLU H H 135 8.986 8.986 8.684 0.302 25259 15742 1 20 . 1 1 136 136 HIS N N 136 117.593 117.593 119.749 -2.156 25259 15743 1 20 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.341 0.042 25259 15744 1 20 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.788 -2.103 25259 15745 1 20 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.907 -1.494 25259 15746 1 20 . 1 1 136 136 HIS H H 136 9.226 9.226 8.133 1.093 25259 15747 1 20 . 1 1 137 137 LEU N N 137 115.463 115.463 115.796 -0.333 25259 15748 1 20 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.643 -0.136 25259 15749 1 20 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.658 -2.710 25259 15750 1 20 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.043 -2.236 25259 15751 1 20 . 1 1 137 137 LEU H H 137 7.090 7.090 8.186 -1.096 25259 15752 1 20 . 1 1 138 138 LYS N N 138 124.686 124.686 120.136 4.550 25259 15753 1 20 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.248 -0.079 25259 15754 1 20 . 1 1 138 138 LYS CA C 138 57.158 57.158 59.089 -1.931 25259 15755 1 20 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.319 -2.231 25259 15756 1 20 . 1 1 138 138 LYS H H 138 7.698 7.698 7.595 0.103 25259 15757 1 20 . 1 1 139 139 ASN N N 139 118.077 118.077 114.069 4.008 25259 15758 1 20 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.571 0.102 25259 15759 1 20 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.881 -2.099 25259 15760 1 20 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.554 -2.737 25259 15761 1 20 . 1 1 139 139 ASN H H 139 8.485 8.485 8.222 0.263 25259 15762 1 20 . 1 1 140 140 ILE N N 140 120.880 120.880 120.384 0.496 25259 15763 1 20 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.216 -0.186 25259 15764 1 20 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.118 -1.552 25259 15765 1 20 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.446 -2.672 25259 15766 1 20 . 1 1 140 140 ILE H H 140 7.549 7.549 7.650 -0.101 25259 15767 1 20 . 1 1 141 141 GLY N N 141 110.676 110.676 115.090 -4.414 25259 15768 1 20 . 1 1 141 141 GLY CA C 141 44.664 44.664 43.965 0.699 25259 15769 1 20 . 1 1 141 141 GLY H H 141 7.663 7.663 8.726 -1.063 25259 15770 1 20 . 1 1 142 142 LEU N N 142 123.857 123.857 124.022 -0.165 25259 15771 1 20 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.822 -0.129 25259 15772 1 20 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.713 -2.520 25259 15773 1 20 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.471 -0.862 25259 15774 1 20 . 1 1 142 142 LEU H H 142 8.496 8.496 7.475 1.021 25259 15775 1 20 . 1 1 143 143 GLU N N 143 118.407 118.407 116.066 2.341 25259 15776 1 20 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.985 -0.199 25259 15777 1 20 . 1 1 143 143 GLU CA C 143 57.222 57.222 58.663 -1.441 25259 15778 1 20 . 1 1 143 143 GLU CB C 143 26.513 26.513 28.954 -2.441 25259 15779 1 20 . 1 1 143 143 GLU H H 143 8.672 8.672 8.619 0.053 25259 15780 1 20 . 1 1 144 144 ASN N N 144 118.477 118.477 116.431 2.046 25259 15781 1 20 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.644 -0.202 25259 15782 1 20 . 1 1 144 144 ASN CA C 144 52.712 52.712 53.321 -0.609 25259 15783 1 20 . 1 1 144 144 ASN CB C 144 35.955 35.955 39.238 -3.283 25259 15784 1 20 . 1 1 144 144 ASN H H 144 7.656 7.656 7.586 0.070 25259 15785 1 20 . 1 1 145 145 LEU N N 145 125.354 125.354 120.726 4.628 25259 15786 1 20 . 1 1 145 145 LEU HA H 145 3.797 3.797 4.001 -0.204 25259 15787 1 20 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.185 -0.862 25259 15788 1 20 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.545 -2.972 25259 15789 1 20 . 1 1 145 145 LEU H H 145 7.758 7.758 7.580 0.178 25259 15790 1 20 . 1 1 146 146 LEU N N 146 116.372 116.372 118.289 -1.917 25259 15791 1 20 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.824 0.052 25259 15792 1 20 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.209 -1.966 25259 15793 1 20 . 1 1 146 146 LEU CB C 146 38.897 38.897 39.634 -0.737 25259 15794 1 20 . 1 1 146 146 LEU H H 146 7.242 7.242 7.573 -0.331 25259 15795 1 20 . 1 1 147 147 LYS N N 147 120.054 120.054 119.919 0.135 25259 15796 1 20 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.498 -0.186 25259 15797 1 20 . 1 1 147 147 LYS CA C 147 54.623 54.623 54.974 -0.351 25259 15798 1 20 . 1 1 147 147 LYS CB C 147 30.260 30.260 34.222 -3.962 25259 15799 1 20 . 1 1 147 147 LYS H H 147 7.185 7.185 8.575 -1.390 25259 15800 1 20 . 1 1 148 148 ASN N N 148 119.498 119.498 117.659 1.839 25259 15801 1 20 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.893 0.069 25259 15802 1 20 . 1 1 148 148 ASN CA C 148 49.774 49.774 52.102 -2.328 25259 15803 1 20 . 1 1 148 148 ASN CB C 148 39.486 39.486 39.998 -0.512 25259 15804 1 20 . 1 1 148 148 ASN H H 148 7.698 7.698 7.619 0.079 25259 15805 1 20 . 1 1 149 149 GLU N N 149 122.834 122.834 118.723 4.111 25259 15806 1 20 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.514 0.087 25259 15807 1 20 . 1 1 149 149 GLU CA C 149 52.219 52.219 53.820 -1.601 25259 15808 1 20 . 1 1 149 149 GLU CB C 149 26.810 26.810 30.190 -3.380 25259 15809 1 20 . 1 1 149 149 GLU H H 149 8.767 8.767 8.649 0.118 25259 15810 1 20 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.754 0.854 25259 15811 1 20 . 1 1 150 150 PRO CA C 150 63.242 63.242 65.015 -1.773 25259 15812 1 20 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.318 -3.223 25259 15813 1 20 . 1 1 151 151 SER N N 151 112.839 112.839 112.177 0.662 25259 15814 1 20 . 1 1 151 151 SER HA H 151 3.835 3.835 4.224 -0.389 25259 15815 1 20 . 1 1 151 151 SER CA C 151 59.270 59.270 60.191 -0.921 25259 15816 1 20 . 1 1 151 151 SER CB C 151 59.451 59.451 62.183 -2.732 25259 15817 1 20 . 1 1 151 151 SER H H 151 8.519 8.519 7.820 0.699 25259 15818 1 20 . 1 1 152 152 LYS N N 152 126.710 126.710 122.607 4.103 25259 15819 1 20 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.069 0.179 25259 15820 1 20 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.132 -3.366 25259 15821 1 20 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.101 -1.844 25259 15822 1 20 . 1 1 152 152 LYS H H 152 7.006 7.006 7.300 -0.294 25259 15823 1 20 . 1 1 153 153 TYR N N 153 123.239 123.239 116.968 6.271 25259 15824 1 20 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.367 -0.109 25259 15825 1 20 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.485 0.824 25259 15826 1 20 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.014 -0.680 25259 15827 1 20 . 1 1 153 153 TYR H H 153 8.058 8.058 7.790 0.268 25259 15828 1 20 . 1 1 154 154 ILE N N 154 120.253 120.253 120.420 -0.167 25259 15829 1 20 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.341 0.032 25259 15830 1 20 . 1 1 154 154 ILE CA C 154 63.114 63.114 64.900 -1.786 25259 15831 1 20 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.170 -1.222 25259 15832 1 20 . 1 1 154 154 ILE H H 154 8.193 8.193 7.303 0.890 25259 15833 1 20 . 1 1 155 155 SER N N 155 117.178 117.178 114.439 2.739 25259 15834 1 20 . 1 1 155 155 SER HA H 155 4.091 4.091 4.076 0.015 25259 15835 1 20 . 1 1 155 155 SER CA C 155 59.961 59.961 62.014 -2.053 25259 15836 1 20 . 1 1 155 155 SER CB C 155 60.148 60.148 62.727 -2.579 25259 15837 1 20 . 1 1 155 155 SER H H 155 8.020 8.020 7.864 0.156 25259 15838 1 20 . 1 1 156 156 ASP N N 156 125.479 125.479 121.089 4.390 25259 15839 1 20 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.527 -0.100 25259 15840 1 20 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.429 -1.669 25259 15841 1 20 . 1 1 156 156 ASP CB C 156 37.873 37.873 41.116 -3.243 25259 15842 1 20 . 1 1 156 156 ASP H H 156 8.638 8.638 7.623 1.015 25259 15843 1 20 . 1 1 157 157 ARG N N 157 121.542 121.542 120.033 1.509 25259 15844 1 20 . 1 1 157 157 ARG HA H 157 4.111 4.111 3.976 0.135 25259 15845 1 20 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.571 -2.643 25259 15846 1 20 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.680 -1.863 25259 15847 1 20 . 1 1 157 157 ARG H H 157 7.888 7.888 8.059 -0.171 25259 15848 1 20 . 1 1 158 158 LEU N N 158 124.257 124.257 118.965 5.292 25259 15849 1 20 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.039 0.232 25259 15850 1 20 . 1 1 158 158 LEU CA C 158 55.213 55.213 58.003 -2.790 25259 15851 1 20 . 1 1 158 158 LEU CB C 158 38.945 38.945 40.827 -1.882 25259 15852 1 20 . 1 1 158 158 LEU H H 158 8.442 8.442 7.608 0.834 25259 15853 1 20 . 1 1 159 159 ALA N N 159 124.146 124.146 118.603 5.543 25259 15854 1 20 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.072 0.260 25259 15855 1 20 . 1 1 159 159 ALA CA C 159 51.432 51.432 53.859 -2.427 25259 15856 1 20 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.519 -2.612 25259 15857 1 20 . 1 1 159 159 ALA H H 159 8.086 8.086 7.857 0.229 25259 15858 1 20 . 1 1 160 160 ASN N N 160 118.093 118.093 116.381 1.712 25259 15859 1 20 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.611 0.381 25259 15860 1 20 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.459 -2.882 25259 15861 1 20 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.834 -1.101 25259 15862 1 20 . 1 1 160 160 ASN H H 160 7.445 7.445 7.633 -0.188 25259 15863 1 20 . 1 1 161 161 GLY N N 161 108.365 108.365 106.581 1.784 25259 15864 1 20 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.032 -1.386 25259 15865 1 20 . 1 1 161 161 GLY H H 161 7.743 7.743 8.123 -0.380 25259 15866 1 20 . 1 1 162 162 ALA N N 162 123.928 123.928 121.617 2.311 25259 15867 1 20 . 1 1 162 162 ALA HA H 162 4.873 4.873 5.114 -0.241 25259 15868 1 20 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.174 -1.648 25259 15869 1 20 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.545 -3.485 25259 15870 1 20 . 1 1 162 162 ALA H H 162 8.035 8.035 7.738 0.297 25259 15871 1 20 . 1 1 163 163 THR N N 163 113.286 113.286 110.986 2.300 25259 15872 1 20 . 1 1 163 163 THR HA H 163 4.703 4.703 4.616 0.087 25259 15873 1 20 . 1 1 163 163 THR CA C 163 57.791 57.791 60.821 -3.030 25259 15874 1 20 . 1 1 163 163 THR CB C 163 68.974 68.974 71.497 -2.523 25259 15875 1 20 . 1 1 163 163 THR H H 163 8.451 8.451 8.462 -0.011 25259 15876 1 20 . 1 1 164 164 GLU N N 164 125.905 125.905 120.481 5.424 25259 15877 1 20 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.835 0.225 25259 15878 1 20 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.237 -1.652 25259 15879 1 20 . 1 1 164 164 GLU CB C 164 29.211 29.211 31.612 -2.401 25259 15880 1 20 . 1 1 164 164 GLU H H 164 8.716 8.716 8.492 0.224 25259 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 158 4.590 -3.446 3.042 25259 2 1 1 "Average Difference" HA 157 0.312 -0.045 0.310 25259 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25259 4 1 1 "Average Difference" CA 163 2.386 2.220 0.877 25259 5 1 1 "Average Difference" CB 158 2.644 2.400 1.113 25259 6 1 1 "Average Difference" HN 158 0.548 -0.175 0.521 25259 7 1 2 "Average Difference" N 158 4.604 -3.317 3.204 25259 8 1 2 "Average Difference" HA 157 0.321 -0.041 0.320 25259 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25259 10 1 2 "Average Difference" CA 163 2.422 2.228 0.952 25259 11 1 2 "Average Difference" CB 158 2.592 2.343 1.113 25259 12 1 2 "Average Difference" HN 158 0.554 -0.140 0.538 25259 13 1 3 "Average Difference" N 158 4.440 -3.360 2.912 25259 14 1 3 "Average Difference" HA 157 0.296 -0.070 0.288 25259 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25259 16 1 3 "Average Difference" CA 163 2.431 2.212 1.012 25259 17 1 3 "Average Difference" CB 158 2.665 2.390 1.182 25259 18 1 3 "Average Difference" HN 158 0.506 -0.150 0.485 25259 19 1 4 "Average Difference" N 158 4.723 -3.482 3.201 25259 20 1 4 "Average Difference" HA 157 0.273 -0.018 0.273 25259 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25259 22 1 4 "Average Difference" CA 163 2.257 2.058 0.929 25259 23 1 4 "Average Difference" CB 158 2.735 2.482 1.154 25259 24 1 4 "Average Difference" HN 158 0.551 -0.156 0.530 25259 25 1 5 "Average Difference" N 158 4.561 -3.506 2.925 25259 26 1 5 "Average Difference" HA 157 0.274 -0.045 0.272 25259 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25259 28 1 5 "Average Difference" CA 163 2.310 2.110 0.942 25259 29 1 5 "Average Difference" CB 158 2.666 2.434 1.089 25259 30 1 5 "Average Difference" HN 158 0.536 -0.186 0.504 25259 31 1 6 "Average Difference" N 158 4.526 -3.442 2.949 25259 32 1 6 "Average Difference" HA 157 0.274 -0.064 0.267 25259 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25259 34 1 6 "Average Difference" CA 163 2.397 2.204 0.946 25259 35 1 6 "Average Difference" CB 158 2.613 2.388 1.065 25259 36 1 6 "Average Difference" HN 158 0.528 -0.128 0.514 25259 37 1 7 "Average Difference" N 158 4.446 -3.336 2.949 25259 38 1 7 "Average Difference" HA 157 0.263 -0.044 0.260 25259 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25259 40 1 7 "Average Difference" CA 163 2.390 2.166 1.014 25259 41 1 7 "Average Difference" CB 158 2.728 2.473 1.155 25259 42 1 7 "Average Difference" HN 158 0.505 -0.149 0.484 25259 43 1 8 "Average Difference" N 158 4.641 -3.379 3.191 25259 44 1 8 "Average Difference" HA 157 0.271 -0.037 0.270 25259 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25259 46 1 8 "Average Difference" CA 163 2.351 2.165 0.919 25259 47 1 8 "Average Difference" CB 158 2.691 2.423 1.175 25259 48 1 8 "Average Difference" HN 158 0.546 -0.148 0.527 25259 49 1 9 "Average Difference" N 158 4.543 -3.307 3.124 25259 50 1 9 "Average Difference" HA 157 0.263 -0.055 0.259 25259 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25259 52 1 9 "Average Difference" CA 163 2.285 2.129 0.830 25259 53 1 9 "Average Difference" CB 158 2.666 2.432 1.096 25259 54 1 9 "Average Difference" HN 158 0.515 -0.184 0.483 25259 55 1 10 "Average Difference" N 158 4.539 -3.470 2.935 25259 56 1 10 "Average Difference" HA 157 0.307 -0.037 0.305 25259 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25259 58 1 10 "Average Difference" CA 163 2.313 2.146 0.866 25259 59 1 10 "Average Difference" CB 158 2.698 2.510 0.992 25259 60 1 10 "Average Difference" HN 158 0.520 -0.170 0.493 25259 61 1 11 "Average Difference" N 158 4.350 -3.241 2.911 25259 62 1 11 "Average Difference" HA 157 0.299 -0.045 0.297 25259 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25259 64 1 11 "Average Difference" CA 163 2.357 2.194 0.862 25259 65 1 11 "Average Difference" CB 158 2.656 2.395 1.152 25259 66 1 11 "Average Difference" HN 158 0.509 -0.147 0.489 25259 67 1 12 "Average Difference" N 158 4.761 -3.683 3.026 25259 68 1 12 "Average Difference" HA 157 0.257 -0.025 0.257 25259 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25259 70 1 12 "Average Difference" CA 163 2.356 2.154 0.958 25259 71 1 12 "Average Difference" CB 158 2.738 2.511 1.096 25259 72 1 12 "Average Difference" HN 158 0.522 -0.177 0.492 25259 73 1 13 "Average Difference" N 158 4.162 -3.122 2.762 25259 74 1 13 "Average Difference" HA 157 0.308 -0.070 0.301 25259 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25259 76 1 13 "Average Difference" CA 163 2.374 2.203 0.889 25259 77 1 13 "Average Difference" CB 158 2.623 2.380 1.108 25259 78 1 13 "Average Difference" HN 158 0.490 -0.149 0.468 25259 79 1 14 "Average Difference" N 158 4.819 -3.459 3.366 25259 80 1 14 "Average Difference" HA 157 0.317 -0.048 0.314 25259 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25259 82 1 14 "Average Difference" CA 163 2.365 2.169 0.945 25259 83 1 14 "Average Difference" CB 158 2.657 2.352 1.240 25259 84 1 14 "Average Difference" HN 158 0.574 -0.135 0.560 25259 85 1 15 "Average Difference" N 158 4.726 -3.410 3.283 25259 86 1 15 "Average Difference" HA 157 0.281 -0.079 0.270 25259 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25259 88 1 15 "Average Difference" CA 163 2.350 2.220 0.773 25259 89 1 15 "Average Difference" CB 158 2.545 2.321 1.047 25259 90 1 15 "Average Difference" HN 158 0.548 -0.196 0.514 25259 91 1 16 "Average Difference" N 158 4.701 -3.434 3.221 25259 92 1 16 "Average Difference" HA 157 0.319 -0.052 0.316 25259 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25259 94 1 16 "Average Difference" CA 163 2.326 2.154 0.881 25259 95 1 16 "Average Difference" CB 158 2.656 2.404 1.131 25259 96 1 16 "Average Difference" HN 158 0.594 -0.169 0.572 25259 97 1 17 "Average Difference" N 158 4.302 -3.038 3.055 25259 98 1 17 "Average Difference" HA 157 0.270 -0.032 0.269 25259 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25259 100 1 17 "Average Difference" CA 163 2.281 2.116 0.855 25259 101 1 17 "Average Difference" CB 158 2.697 2.441 1.150 25259 102 1 17 "Average Difference" HN 158 0.477 -0.092 0.470 25259 103 1 18 "Average Difference" N 158 4.618 -3.318 3.222 25259 104 1 18 "Average Difference" HA 157 0.271 -0.031 0.270 25259 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25259 106 1 18 "Average Difference" CA 163 2.329 2.136 0.931 25259 107 1 18 "Average Difference" CB 158 2.699 2.427 1.185 25259 108 1 18 "Average Difference" HN 158 0.511 -0.103 0.503 25259 109 1 19 "Average Difference" N 158 4.404 -3.334 2.887 25259 110 1 19 "Average Difference" HA 157 0.268 -0.040 0.266 25259 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25259 112 1 19 "Average Difference" CA 163 2.377 2.203 0.894 25259 113 1 19 "Average Difference" CB 158 2.648 2.432 1.050 25259 114 1 19 "Average Difference" HN 158 0.538 -0.130 0.524 25259 115 1 20 "Average Difference" N 158 4.592 -3.403 3.093 25259 116 1 20 "Average Difference" HA 157 0.271 -0.029 0.270 25259 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25259 118 1 20 "Average Difference" CA 163 2.309 2.119 0.921 25259 119 1 20 "Average Difference" CB 158 2.646 2.425 1.060 25259 120 1 20 "Average Difference" HN 158 0.519 -0.142 0.501 25259 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 25259 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 PRO HA H 2 4.675 4.675 5.002 -0.327 25259 2 1 . 1 1 2 2 PRO CA C 2 60.808 60.808 63.162 -2.354 25259 3 1 . 1 1 2 2 PRO CB C 2 30.070 30.070 33.129 -3.059 25259 4 1 . 1 1 3 3 ALA N N 3 126.741 126.741 123.231 3.510 25259 5 1 . 1 1 3 3 ALA HA H 3 4.494 4.494 4.737 -0.243 25259 6 1 . 1 1 3 3 ALA CA C 3 50.202 50.202 51.642 -1.440 25259 7 1 . 1 1 3 3 ALA CB C 3 16.818 16.818 20.875 -4.057 25259 8 1 . 1 1 3 3 ALA H H 3 8.440 8.440 8.478 -0.038 25259 9 1 . 1 1 4 4 THR N N 4 116.015 116.015 114.389 1.626 25259 10 1 . 1 1 4 4 THR HA H 4 4.393 4.393 4.617 -0.224 25259 11 1 . 1 1 4 4 THR CA C 4 59.148 59.148 61.931 -2.783 25259 12 1 . 1 1 4 4 THR CB C 4 67.580 67.580 69.740 -2.160 25259 13 1 . 1 1 4 4 THR H H 4 8.050 8.050 8.293 -0.243 25259 14 1 . 1 1 5 5 LYS N N 5 126.350 126.350 122.282 4.068 25259 15 1 . 1 1 5 5 LYS HA H 5 4.505 4.505 4.644 -0.139 25259 16 1 . 1 1 5 5 LYS CA C 5 53.917 53.917 55.831 -1.914 25259 17 1 . 1 1 5 5 LYS CB C 5 30.684 30.684 34.007 -3.323 25259 18 1 . 1 1 5 5 LYS H H 5 8.332 8.332 8.449 -0.117 25259 19 1 . 1 1 6 6 THR N N 6 118.124 118.124 114.282 3.842 25259 20 1 . 1 1 6 6 THR HA H 6 4.440 4.440 4.562 -0.122 25259 21 1 . 1 1 6 6 THR CA C 6 59.282 59.282 61.658 -2.376 25259 22 1 . 1 1 6 6 THR CB C 6 67.685 67.685 70.058 -2.373 25259 23 1 . 1 1 6 6 THR H H 6 8.283 8.283 8.306 -0.023 25259 24 1 . 1 1 7 7 GLU N N 7 125.934 125.934 122.691 3.243 25259 25 1 . 1 1 7 7 GLU HA H 7 4.344 4.344 4.707 -0.363 25259 26 1 . 1 1 7 7 GLU CA C 7 54.181 54.181 55.730 -1.549 25259 27 1 . 1 1 7 7 GLU CB C 7 27.816 27.816 31.653 -3.837 25259 28 1 . 1 1 7 7 GLU H H 7 8.487 8.487 8.588 -0.101 25259 29 1 . 1 1 8 8 LYS N N 8 123.945 123.945 120.485 3.460 25259 30 1 . 1 1 8 8 LYS CA C 8 53.935 53.935 55.677 -1.742 25259 31 1 . 1 1 8 8 LYS CB C 8 30.565 30.565 34.007 -3.442 25259 32 1 . 1 1 8 8 LYS H H 8 8.278 8.278 8.404 -0.126 25259 33 1 . 1 1 9 9 ASP N N 9 123.624 123.624 120.865 2.759 25259 34 1 . 1 1 9 9 ASP HA H 9 4.339 4.339 4.873 -0.534 25259 35 1 . 1 1 9 9 ASP CA C 9 52.123 52.123 53.965 -1.842 25259 36 1 . 1 1 9 9 ASP CB C 9 38.933 38.933 42.266 -3.333 25259 37 1 . 1 1 9 9 ASP H H 9 8.277 8.277 8.567 -0.290 25259 38 1 . 1 1 10 10 THR N N 10 116.812 116.812 115.423 1.389 25259 39 1 . 1 1 10 10 THR HA H 10 4.349 4.349 4.532 -0.183 25259 40 1 . 1 1 10 10 THR CA C 10 59.634 59.634 61.998 -2.364 25259 41 1 . 1 1 10 10 THR CB C 10 67.254 67.254 69.593 -2.339 25259 42 1 . 1 1 10 10 THR H H 10 8.049 8.049 8.284 -0.235 25259 43 1 . 1 1 11 11 LEU N N 11 126.610 126.610 124.319 2.291 25259 44 1 . 1 1 11 11 LEU HA H 11 4.392 4.392 4.614 -0.222 25259 45 1 . 1 1 11 11 LEU CA C 11 53.078 53.078 54.928 -1.850 25259 46 1 . 1 1 11 11 LEU CB C 11 39.633 39.633 43.320 -3.687 25259 47 1 . 1 1 11 11 LEU H H 11 8.191 8.191 8.466 -0.275 25259 48 1 . 1 1 12 12 GLN N N 12 123.274 123.274 120.659 2.615 25259 49 1 . 1 1 12 12 GLN HA H 12 4.382 4.382 4.680 -0.298 25259 50 1 . 1 1 12 12 GLN CA C 12 53.574 53.574 55.305 -1.731 25259 51 1 . 1 1 12 12 GLN CB C 12 26.803 26.803 30.671 -3.868 25259 52 1 . 1 1 12 12 GLN H H 12 8.280 8.280 8.549 -0.269 25259 53 1 . 1 1 13 13 SER N N 13 119.027 119.027 115.799 3.228 25259 54 1 . 1 1 13 13 SER HA H 13 4.471 4.471 4.902 -0.431 25259 55 1 . 1 1 13 13 SER CA C 13 55.869 55.869 57.810 -1.941 25259 56 1 . 1 1 13 13 SER CB C 13 61.424 61.424 64.371 -2.947 25259 57 1 . 1 1 13 13 SER H H 13 8.178 8.178 8.580 -0.402 25259 58 1 . 1 1 14 14 ALA N N 14 128.314 128.314 124.560 3.754 25259 59 1 . 1 1 14 14 ALA HA H 14 4.434 4.434 4.776 -0.342 25259 60 1 . 1 1 14 14 ALA CA C 14 49.696 49.696 51.764 -2.068 25259 61 1 . 1 1 14 14 ALA CB C 14 17.081 17.081 19.552 -2.471 25259 62 1 . 1 1 14 14 ALA H H 14 8.195 8.195 8.460 -0.265 25259 63 1 . 1 1 15 15 LEU N N 15 125.175 125.175 120.372 4.803 25259 64 1 . 1 1 15 15 LEU HA H 15 4.640 4.640 4.885 -0.245 25259 65 1 . 1 1 15 15 LEU CA C 15 50.604 50.604 53.163 -2.559 25259 66 1 . 1 1 15 15 LEU CB C 15 39.467 39.467 42.659 -3.192 25259 67 1 . 1 1 15 15 LEU H H 15 8.050 8.050 8.453 -0.403 25259 68 1 . 1 1 16 16 PRO HA H 16 4.504 4.504 4.648 -0.144 25259 69 1 . 1 1 16 16 PRO CA C 16 60.631 60.631 62.807 -2.176 25259 70 1 . 1 1 16 16 PRO CB C 16 29.658 29.658 32.528 -2.870 25259 71 1 . 1 1 17 17 VAL N N 17 123.223 123.223 119.382 3.841 25259 72 1 . 1 1 17 17 VAL HA H 17 4.134 4.134 4.369 -0.235 25259 73 1 . 1 1 17 17 VAL CA C 17 59.827 59.827 61.452 -1.625 25259 74 1 . 1 1 17 17 VAL CB C 17 30.377 30.377 33.300 -2.923 25259 75 1 . 1 1 17 17 VAL H H 17 8.134 8.134 8.222 -0.087 25259 76 1 . 1 1 18 18 ILE N N 18 127.777 127.777 121.974 5.803 25259 77 1 . 1 1 18 18 ILE HA H 18 4.243 4.243 4.592 -0.349 25259 78 1 . 1 1 18 18 ILE CA C 18 58.322 58.322 60.909 -2.587 25259 79 1 . 1 1 18 18 ILE CB C 18 36.254 36.254 39.846 -3.592 25259 80 1 . 1 1 18 18 ILE H H 18 8.187 8.187 8.473 -0.286 25259 81 1 . 1 1 19 19 GLU N N 19 128.148 128.148 123.524 4.624 25259 82 1 . 1 1 19 19 GLU HA H 19 4.337 4.337 4.677 -0.340 25259 83 1 . 1 1 19 19 GLU CA C 19 54.091 54.091 55.741 -1.650 25259 84 1 . 1 1 19 19 GLU CB C 19 28.176 28.176 31.874 -3.698 25259 85 1 . 1 1 19 19 GLU H H 19 8.475 8.475 8.686 -0.211 25259 86 1 . 1 1 20 20 ASN N N 20 122.788 122.788 119.086 3.702 25259 87 1 . 1 1 20 20 ASN HA H 20 4.695 4.695 4.990 -0.295 25259 88 1 . 1 1 20 20 ASN CA C 20 50.822 50.822 53.010 -2.188 25259 89 1 . 1 1 20 20 ASN CB C 20 36.366 36.366 40.105 -3.740 25259 90 1 . 1 1 20 20 ASN H H 20 8.477 8.477 8.588 -0.111 25259 91 1 . 1 1 21 21 ALA N N 21 127.253 127.253 124.413 2.841 25259 92 1 . 1 1 21 21 ALA HA H 21 4.321 4.321 4.523 -0.202 25259 93 1 . 1 1 21 21 ALA CA C 21 50.688 50.688 51.966 -1.278 25259 94 1 . 1 1 21 21 ALA CB C 21 16.913 16.913 20.223 -3.310 25259 95 1 . 1 1 21 21 ALA H H 21 8.325 8.325 8.383 -0.058 25259 96 1 . 1 1 22 22 GLU N N 22 122.044 122.044 121.107 0.937 25259 97 1 . 1 1 22 22 GLU HA H 22 4.293 4.293 4.326 -0.033 25259 98 1 . 1 1 22 22 GLU CA C 22 54.583 54.583 56.569 -1.987 25259 99 1 . 1 1 22 22 GLU CB C 22 27.285 27.285 29.111 -1.826 25259 100 1 . 1 1 22 22 GLU H H 22 8.415 8.415 8.504 -0.089 25259 101 1 . 1 1 23 23 LYS N N 23 123.622 123.622 122.652 0.970 25259 102 1 . 1 1 23 23 LYS HA H 23 4.325 4.325 4.442 -0.117 25259 103 1 . 1 1 23 23 LYS CA C 23 54.496 54.496 55.782 -1.286 25259 104 1 . 1 1 23 23 LYS CB C 23 30.653 30.653 33.435 -2.782 25259 105 1 . 1 1 23 23 LYS H H 23 8.127 8.127 8.101 0.026 25259 106 1 . 1 1 24 24 ASN N N 24 120.652 120.652 120.308 0.344 25259 107 1 . 1 1 24 24 ASN HA H 24 4.841 4.841 4.809 0.032 25259 108 1 . 1 1 24 24 ASN CA C 24 50.663 50.663 53.106 -2.443 25259 109 1 . 1 1 24 24 ASN CB C 24 36.775 36.775 39.424 -2.649 25259 110 1 . 1 1 24 24 ASN H H 24 8.424 8.424 8.396 0.028 25259 111 1 . 1 1 25 25 THR N N 25 117.102 117.102 114.497 2.605 25259 112 1 . 1 1 25 25 THR HA H 25 4.367 4.367 4.360 0.007 25259 113 1 . 1 1 25 25 THR CA C 25 59.500 59.500 61.903 -2.403 25259 114 1 . 1 1 25 25 THR CB C 25 67.610 67.610 69.909 -2.299 25259 115 1 . 1 1 25 25 THR H H 25 7.852 7.852 8.271 -0.419 25259 116 1 . 1 1 26 26 VAL N N 26 126.491 126.491 124.776 1.715 25259 117 1 . 1 1 26 26 VAL HA H 26 4.167 4.167 4.214 -0.047 25259 118 1 . 1 1 26 26 VAL CA C 26 60.193 60.193 61.836 -1.643 25259 119 1 . 1 1 26 26 VAL CB C 26 29.605 29.605 32.971 -3.365 25259 120 1 . 1 1 26 26 VAL H H 26 8.080 8.080 8.309 -0.229 25259 121 1 . 1 1 27 27 VAL N N 27 132.992 132.992 126.692 6.300 25259 122 1 . 1 1 27 27 VAL HA H 27 4.081 4.081 4.370 -0.289 25259 123 1 . 1 1 27 27 VAL CA C 27 58.984 58.984 60.591 -1.607 25259 124 1 . 1 1 27 27 VAL CB C 27 31.540 31.540 33.378 -1.838 25259 125 1 . 1 1 27 27 VAL H H 27 8.830 8.830 8.795 0.035 25259 126 1 . 1 1 28 28 THR N N 28 123.576 123.576 118.780 4.796 25259 127 1 . 1 1 28 28 THR HA H 28 5.553 5.553 4.768 0.785 25259 128 1 . 1 1 28 28 THR CA C 28 58.738 58.738 61.275 -2.537 25259 129 1 . 1 1 28 28 THR CB C 28 68.443 68.443 69.993 -1.550 25259 130 1 . 1 1 28 28 THR H H 28 8.165 8.165 8.194 -0.029 25259 131 1 . 1 1 29 29 LYS N N 29 129.099 129.099 126.769 2.330 25259 132 1 . 1 1 29 29 LYS HA H 29 4.942 4.942 4.612 0.330 25259 133 1 . 1 1 29 29 LYS CA C 29 51.779 51.779 55.365 -3.586 25259 134 1 . 1 1 29 29 LYS CB C 29 35.096 35.096 35.158 -0.062 25259 135 1 . 1 1 29 29 LYS H H 29 9.273 9.273 8.817 0.456 25259 136 1 . 1 1 30 30 THR N N 30 123.510 123.510 118.349 5.161 25259 137 1 . 1 1 30 30 THR HA H 30 5.428 5.428 5.019 0.409 25259 138 1 . 1 1 30 30 THR CA C 30 59.784 59.784 61.901 -2.117 25259 139 1 . 1 1 30 30 THR CB C 30 67.818 67.818 70.788 -2.970 25259 140 1 . 1 1 30 30 THR H H 30 8.993 8.993 8.412 0.581 25259 141 1 . 1 1 31 31 LEU N N 31 128.293 128.293 125.956 2.337 25259 142 1 . 1 1 31 31 LEU HA H 31 5.220 5.220 4.926 0.294 25259 143 1 . 1 1 31 31 LEU CA C 31 50.055 50.055 53.471 -3.416 25259 144 1 . 1 1 31 31 LEU CB C 31 43.399 43.399 44.510 -1.111 25259 145 1 . 1 1 31 31 LEU H H 31 9.557 9.557 8.920 0.637 25259 146 1 . 1 1 32 32 VAL N N 32 126.919 126.919 123.926 2.993 25259 147 1 . 1 1 32 32 VAL HA H 32 4.451 4.451 4.172 0.279 25259 148 1 . 1 1 32 32 VAL CA C 32 59.664 59.664 61.753 -2.089 25259 149 1 . 1 1 32 32 VAL CB C 32 29.449 29.449 31.220 -1.770 25259 150 1 . 1 1 32 32 VAL H H 32 9.364 9.364 8.663 0.701 25259 151 1 . 1 1 33 33 LEU N N 33 133.503 133.503 129.216 4.287 25259 152 1 . 1 1 33 33 LEU HA H 33 4.556 4.556 4.477 0.079 25259 153 1 . 1 1 33 33 LEU CA C 33 52.004 52.004 53.267 -1.263 25259 154 1 . 1 1 33 33 LEU CB C 33 36.847 36.847 41.043 -4.196 25259 155 1 . 1 1 33 33 LEU H H 33 8.587 8.587 7.983 0.604 25259 156 1 . 1 1 34 34 PRO HA H 34 4.481 4.481 4.450 0.031 25259 157 1 . 1 1 34 34 PRO CA C 34 60.445 60.445 62.362 -1.917 25259 158 1 . 1 1 34 34 PRO CB C 34 29.565 29.565 32.236 -2.671 25259 159 1 . 1 1 35 35 LYS N N 35 127.420 127.420 118.802 8.618 25259 160 1 . 1 1 35 35 LYS HA H 35 4.366 4.366 4.317 0.049 25259 161 1 . 1 1 35 35 LYS CA C 35 55.119 55.119 56.839 -1.720 25259 162 1 . 1 1 35 35 LYS CB C 35 30.594 30.594 32.881 -2.287 25259 163 1 . 1 1 35 35 LYS H H 35 8.666 8.666 8.330 0.336 25259 164 1 . 1 1 36 36 SER N N 36 122.222 122.222 117.569 4.653 25259 165 1 . 1 1 36 36 SER HA H 36 4.753 4.753 4.527 0.226 25259 166 1 . 1 1 36 36 SER CA C 36 55.328 55.328 58.222 -2.894 25259 167 1 . 1 1 36 36 SER CB C 36 61.728 61.728 63.210 -1.482 25259 168 1 . 1 1 36 36 SER H H 36 8.771 8.771 8.576 0.195 25259 169 1 . 1 1 37 37 ASP N N 37 126.346 126.346 121.729 4.617 25259 170 1 . 1 1 37 37 ASP HA H 37 4.454 4.454 4.400 0.054 25259 171 1 . 1 1 37 37 ASP CA C 37 54.616 54.616 56.663 -2.047 25259 172 1 . 1 1 37 37 ASP CB C 37 37.985 37.985 40.490 -2.505 25259 173 1 . 1 1 37 37 ASP H H 37 8.859 8.859 8.525 0.334 25259 174 1 . 1 1 38 38 ASP N N 38 119.171 119.171 119.214 -0.043 25259 175 1 . 1 1 38 38 ASP HA H 38 4.615 4.615 4.728 -0.113 25259 176 1 . 1 1 38 38 ASP CA C 38 50.788 50.788 54.120 -3.332 25259 177 1 . 1 1 38 38 ASP CB C 38 37.635 37.635 41.321 -3.686 25259 178 1 . 1 1 38 38 ASP H H 38 7.944 7.944 8.077 -0.133 25259 179 1 . 1 1 39 39 GLY N N 39 110.352 110.352 109.394 0.958 25259 180 1 . 1 1 39 39 GLY CA C 39 42.761 42.761 45.374 -2.613 25259 181 1 . 1 1 39 39 GLY H H 39 8.145 8.145 8.179 -0.034 25259 182 1 . 1 1 40 40 SER N N 40 120.090 120.090 116.255 3.835 25259 183 1 . 1 1 40 40 SER HA H 40 4.877 4.877 4.876 0.001 25259 184 1 . 1 1 40 40 SER CA C 40 56.525 56.525 57.905 -1.380 25259 185 1 . 1 1 40 40 SER CB C 40 62.245 62.245 65.011 -2.766 25259 186 1 . 1 1 40 40 SER H H 40 8.344 8.344 7.768 0.576 25259 187 1 . 1 1 41 41 GLN N N 41 122.551 122.551 123.202 -0.651 25259 188 1 . 1 1 41 41 GLN HA H 41 4.927 4.927 4.702 0.225 25259 189 1 . 1 1 41 41 GLN CA C 41 53.414 53.414 54.905 -1.491 25259 190 1 . 1 1 41 41 GLN CB C 41 30.314 30.314 32.959 -2.645 25259 191 1 . 1 1 41 41 GLN H H 41 8.627 8.627 8.862 -0.235 25259 192 1 . 1 1 42 42 GLN N N 42 131.724 131.724 119.973 11.751 25259 193 1 . 1 1 42 42 GLN HA H 42 5.611 5.611 4.832 0.779 25259 194 1 . 1 1 42 42 GLN CA C 42 52.072 52.072 54.486 -2.414 25259 195 1 . 1 1 42 42 GLN CB C 42 30.319 30.319 32.328 -2.009 25259 196 1 . 1 1 42 42 GLN H H 42 9.189 9.189 8.643 0.546 25259 197 1 . 1 1 43 43 THR N N 43 122.202 122.202 114.997 7.205 25259 198 1 . 1 1 43 43 THR HA H 43 5.380 5.380 5.004 0.376 25259 199 1 . 1 1 43 43 THR CA C 43 58.863 58.863 61.100 -2.237 25259 200 1 . 1 1 43 43 THR CB C 43 68.893 68.893 72.047 -3.154 25259 201 1 . 1 1 43 43 THR H H 43 9.139 9.139 8.342 0.797 25259 202 1 . 1 1 44 44 GLN N N 44 127.190 127.190 121.918 5.272 25259 203 1 . 1 1 44 44 GLN HA H 44 5.634 5.634 5.103 0.531 25259 204 1 . 1 1 44 44 GLN CA C 44 51.668 51.668 54.919 -3.251 25259 205 1 . 1 1 44 44 GLN CB C 44 28.910 28.910 32.701 -3.791 25259 206 1 . 1 1 44 44 GLN H H 44 9.760 9.760 8.742 1.018 25259 207 1 . 1 1 45 45 THR N N 45 123.479 123.479 119.798 3.681 25259 208 1 . 1 1 45 45 THR HA H 45 5.421 5.421 5.057 0.364 25259 209 1 . 1 1 45 45 THR CA C 45 60.071 60.071 61.976 -1.905 25259 210 1 . 1 1 45 45 THR CB C 45 67.541 67.541 70.267 -2.726 25259 211 1 . 1 1 45 45 THR H H 45 9.518 9.518 9.014 0.504 25259 212 1 . 1 1 46 46 ILE N N 46 133.908 133.908 127.202 6.706 25259 213 1 . 1 1 46 46 ILE HA H 46 5.003 5.003 4.766 0.237 25259 214 1 . 1 1 46 46 ILE CA C 46 58.471 58.471 60.659 -2.188 25259 215 1 . 1 1 46 46 ILE CB C 46 39.945 39.945 40.058 -0.113 25259 216 1 . 1 1 46 46 ILE H H 46 9.830 9.830 9.196 0.634 25259 217 1 . 1 1 47 47 THR N N 47 124.701 124.701 124.295 0.406 25259 218 1 . 1 1 47 47 THR HA H 47 6.048 6.048 5.146 0.902 25259 219 1 . 1 1 47 47 THR CA C 47 58.551 58.551 61.997 -3.446 25259 220 1 . 1 1 47 47 THR CB C 47 67.819 67.819 69.504 -1.685 25259 221 1 . 1 1 47 47 THR H H 47 8.843 8.843 8.607 0.236 25259 222 1 . 1 1 48 48 TYR N N 48 127.369 127.369 122.109 5.260 25259 223 1 . 1 1 48 48 TYR HA H 48 5.278 5.278 5.126 0.152 25259 224 1 . 1 1 48 48 TYR CA C 48 53.729 53.729 56.206 -2.477 25259 225 1 . 1 1 48 48 TYR CB C 48 39.432 39.432 41.448 -2.016 25259 226 1 . 1 1 48 48 TYR H H 48 9.638 9.638 8.487 1.151 25259 227 1 . 1 1 49 49 LYS N N 49 122.138 122.138 117.705 4.433 25259 228 1 . 1 1 49 49 LYS HA H 49 4.656 4.656 4.596 0.060 25259 229 1 . 1 1 49 49 LYS CA C 49 52.972 52.972 56.220 -3.248 25259 230 1 . 1 1 49 49 LYS CB C 49 33.603 33.603 34.478 -0.875 25259 231 1 . 1 1 49 49 LYS H H 49 8.560 8.560 8.802 -0.242 25259 232 1 . 1 1 50 50 ASP N N 50 130.208 130.208 121.288 8.920 25259 233 1 . 1 1 50 50 ASP HA H 50 4.304 4.304 4.742 -0.438 25259 234 1 . 1 1 50 50 ASP CA C 50 54.760 54.760 55.140 -0.380 25259 235 1 . 1 1 50 50 ASP CB C 50 37.339 37.339 42.839 -5.500 25259 236 1 . 1 1 50 50 ASP H H 50 9.597 9.597 8.523 1.074 25259 237 1 . 1 1 51 51 LYS N N 51 124.586 124.586 118.344 6.242 25259 238 1 . 1 1 51 51 LYS HA H 51 4.531 4.531 4.451 0.080 25259 239 1 . 1 1 51 51 LYS CA C 51 53.734 53.734 56.288 -2.553 25259 240 1 . 1 1 51 51 LYS CB C 51 30.395 30.395 34.308 -3.913 25259 241 1 . 1 1 51 51 LYS H H 51 8.450 8.450 8.156 0.294 25259 242 1 . 1 1 52 52 THR N N 52 120.044 120.044 114.410 5.634 25259 243 1 . 1 1 52 52 THR HA H 52 4.717 4.717 4.518 0.199 25259 244 1 . 1 1 52 52 THR CA C 52 59.313 59.313 60.894 -1.581 25259 245 1 . 1 1 52 52 THR CB C 52 68.815 68.815 71.089 -2.274 25259 246 1 . 1 1 52 52 THR H H 52 8.658 8.658 7.667 0.991 25259 247 1 . 1 1 53 53 PHE N N 53 128.987 128.987 123.609 5.378 25259 248 1 . 1 1 53 53 PHE HA H 53 4.283 4.283 4.501 -0.218 25259 249 1 . 1 1 53 53 PHE CA C 53 57.989 57.989 59.071 -1.082 25259 250 1 . 1 1 53 53 PHE CB C 53 38.311 38.311 37.867 0.444 25259 251 1 . 1 1 53 53 PHE H H 53 9.218 9.218 8.720 0.498 25259 252 1 . 1 1 54 54 LEU N N 54 124.874 124.874 125.444 -0.570 25259 253 1 . 1 1 54 54 LEU HA H 54 4.929 4.929 4.355 0.574 25259 254 1 . 1 1 54 54 LEU CA C 54 54.241 54.241 56.925 -2.684 25259 255 1 . 1 1 54 54 LEU CB C 54 40.517 40.517 42.607 -2.090 25259 256 1 . 1 1 54 54 LEU H H 54 9.391 9.391 8.622 0.769 25259 257 1 . 1 1 55 55 SER N N 55 115.516 115.516 109.274 6.242 25259 258 1 . 1 1 55 55 SER HA H 55 5.194 5.194 5.245 -0.051 25259 259 1 . 1 1 55 55 SER CA C 55 55.818 55.818 57.496 -1.678 25259 260 1 . 1 1 55 55 SER CB C 55 63.474 63.474 66.689 -3.215 25259 261 1 . 1 1 55 55 SER H H 55 8.736 8.736 7.774 0.962 25259 262 1 . 1 1 56 56 LEU N N 56 124.352 124.352 122.497 1.855 25259 263 1 . 1 1 56 56 LEU HA H 56 5.543 5.543 5.387 0.156 25259 264 1 . 1 1 56 56 LEU CA C 56 51.637 51.637 54.148 -2.511 25259 265 1 . 1 1 56 56 LEU CB C 56 45.513 45.513 46.397 -0.884 25259 266 1 . 1 1 56 56 LEU H H 56 8.328 8.328 8.643 -0.315 25259 267 1 . 1 1 57 57 ALA N N 57 131.450 131.450 128.744 2.706 25259 268 1 . 1 1 57 57 ALA HA H 57 5.505 5.505 5.303 0.202 25259 269 1 . 1 1 57 57 ALA CA C 57 48.202 48.202 50.202 -2.000 25259 270 1 . 1 1 57 57 ALA CB C 57 18.964 18.964 21.582 -2.618 25259 271 1 . 1 1 57 57 ALA H H 57 9.208 9.208 8.789 0.419 25259 272 1 . 1 1 58 58 ILE N N 58 126.248 126.248 124.108 2.140 25259 273 1 . 1 1 58 58 ILE HA H 58 4.784 4.784 4.562 0.222 25259 274 1 . 1 1 58 58 ILE CA C 58 58.247 58.247 61.077 -2.830 25259 275 1 . 1 1 58 58 ILE CB C 58 38.045 38.045 39.212 -1.167 25259 276 1 . 1 1 58 58 ILE H H 58 9.597 9.597 8.721 0.876 25259 277 1 . 1 1 59 59 GLN N N 59 132.065 132.065 127.249 4.816 25259 278 1 . 1 1 59 59 GLN HA H 59 5.247 5.247 4.617 0.630 25259 279 1 . 1 1 59 59 GLN CA C 59 52.164 52.164 55.985 -3.821 25259 280 1 . 1 1 59 59 GLN CB C 59 29.661 29.661 30.612 -0.951 25259 281 1 . 1 1 59 59 GLN H H 59 9.389 9.389 8.618 0.771 25259 282 1 . 1 1 60 60 GLN N N 60 130.314 130.314 119.733 10.581 25259 283 1 . 1 1 60 60 GLN HA H 60 5.209 5.209 4.839 0.370 25259 284 1 . 1 1 60 60 GLN CA C 60 52.021 52.021 55.009 -2.989 25259 285 1 . 1 1 60 60 GLN CB C 60 29.476 29.476 33.330 -3.854 25259 286 1 . 1 1 60 60 GLN H H 60 9.471 9.471 8.892 0.579 25259 287 1 . 1 1 61 61 LYS N N 61 131.044 131.044 124.936 6.108 25259 288 1 . 1 1 61 61 LYS HA H 61 5.415 5.415 5.085 0.330 25259 289 1 . 1 1 61 61 LYS CA C 61 53.120 53.120 56.034 -2.914 25259 290 1 . 1 1 61 61 LYS CB C 61 32.417 32.417 35.978 -3.561 25259 291 1 . 1 1 61 61 LYS H H 61 8.893 8.893 8.869 0.024 25259 292 1 . 1 1 62 62 ARG N N 62 125.397 125.397 122.442 2.955 25259 293 1 . 1 1 62 62 ARG HA H 62 5.003 5.003 5.097 -0.094 25259 294 1 . 1 1 62 62 ARG CA C 62 51.091 51.091 53.374 -2.283 25259 295 1 . 1 1 62 62 ARG CB C 62 29.878 29.878 32.103 -2.225 25259 296 1 . 1 1 62 62 ARG H H 62 9.120 9.120 8.257 0.863 25259 297 1 . 1 1 63 63 PRO HA H 63 4.975 4.975 4.752 0.223 25259 298 1 . 1 1 63 63 PRO CA C 63 59.497 59.497 62.563 -3.066 25259 299 1 . 1 1 63 63 PRO CB C 63 29.884 29.884 32.334 -2.450 25259 300 1 . 1 1 64 64 VAL N N 64 121.305 121.305 116.832 4.473 25259 301 1 . 1 1 64 64 VAL HA H 64 4.024 4.024 4.342 -0.318 25259 302 1 . 1 1 64 64 VAL CA C 64 59.677 59.677 61.246 -1.569 25259 303 1 . 1 1 64 64 VAL CB C 64 30.365 30.365 33.227 -2.862 25259 304 1 . 1 1 64 64 VAL H H 64 7.520 7.520 8.023 -0.503 25259 305 1 . 1 1 65 65 SER N N 65 123.215 123.215 115.011 8.204 25259 306 1 . 1 1 65 65 SER HA H 65 4.521 4.521 4.725 -0.204 25259 307 1 . 1 1 65 65 SER CA C 65 54.897 54.897 57.649 -2.752 25259 308 1 . 1 1 65 65 SER CB C 65 62.564 62.564 65.204 -2.640 25259 309 1 . 1 1 65 65 SER H H 65 8.080 8.080 8.230 -0.150 25259 310 1 . 1 1 66 66 ASP N N 66 123.802 123.802 122.249 1.553 25259 311 1 . 1 1 66 66 ASP HA H 66 4.429 4.429 4.562 -0.133 25259 312 1 . 1 1 66 66 ASP CA C 66 55.378 55.378 56.449 -1.071 25259 313 1 . 1 1 66 66 ASP CB C 66 38.038 38.038 40.915 -2.877 25259 314 1 . 1 1 66 66 ASP H H 66 8.900 8.900 8.585 0.315 25259 315 1 . 1 1 67 67 GLU N N 67 121.943 121.943 119.987 1.956 25259 316 1 . 1 1 67 67 GLU HA H 67 4.189 4.189 4.079 0.110 25259 317 1 . 1 1 67 67 GLU CA C 67 57.440 57.440 59.147 -1.707 25259 318 1 . 1 1 67 67 GLU CB C 67 26.785 26.785 29.541 -2.756 25259 319 1 . 1 1 67 67 GLU H H 67 8.717 8.717 8.565 0.152 25259 320 1 . 1 1 68 68 LEU N N 68 125.458 125.458 119.600 5.858 25259 321 1 . 1 1 68 68 LEU HA H 68 4.343 4.343 4.291 0.052 25259 322 1 . 1 1 68 68 LEU CA C 68 54.472 54.472 56.688 -2.216 25259 323 1 . 1 1 68 68 LEU CB C 68 39.404 39.404 41.687 -2.283 25259 324 1 . 1 1 68 68 LEU H H 68 7.820 7.820 7.862 -0.042 25259 325 1 . 1 1 69 69 LYS N N 69 123.868 123.868 119.953 3.915 25259 326 1 . 1 1 69 69 LYS HA H 69 4.006 4.006 4.044 -0.038 25259 327 1 . 1 1 69 69 LYS CA C 69 57.617 57.617 59.671 -2.054 25259 328 1 . 1 1 69 69 LYS CB C 69 30.037 30.037 31.990 -1.953 25259 329 1 . 1 1 69 69 LYS H H 69 8.690 8.690 8.045 0.645 25259 330 1 . 1 1 70 70 THR N N 70 117.109 117.109 116.338 0.771 25259 331 1 . 1 1 70 70 THR HA H 70 4.088 4.088 4.007 0.081 25259 332 1 . 1 1 70 70 THR CA C 70 63.879 63.879 66.831 -2.952 25259 333 1 . 1 1 70 70 THR CB C 70 66.383 66.383 68.755 -2.372 25259 334 1 . 1 1 70 70 THR H H 70 7.935 7.935 7.816 0.119 25259 335 1 . 1 1 71 71 TYR N N 71 127.006 127.006 122.872 4.134 25259 336 1 . 1 1 71 71 TYR HA H 71 4.205 4.205 4.257 -0.052 25259 337 1 . 1 1 71 71 TYR CA C 71 60.225 60.225 61.937 -1.712 25259 338 1 . 1 1 71 71 TYR CB C 71 36.545 36.545 38.278 -1.733 25259 339 1 . 1 1 71 71 TYR H H 71 7.683 7.683 7.720 -0.037 25259 340 1 . 1 1 72 72 ILE N N 72 125.064 125.064 119.780 5.284 25259 341 1 . 1 1 72 72 ILE HA H 72 3.679 3.679 3.751 -0.072 25259 342 1 . 1 1 72 72 ILE CA C 72 62.895 62.895 65.131 -2.236 25259 343 1 . 1 1 72 72 ILE CB C 72 36.276 36.276 37.879 -1.603 25259 344 1 . 1 1 72 72 ILE H H 72 9.083 9.083 8.202 0.881 25259 345 1 . 1 1 73 73 ASP N N 73 124.900 124.900 119.295 5.605 25259 346 1 . 1 1 73 73 ASP HA H 73 4.389 4.389 4.426 -0.037 25259 347 1 . 1 1 73 73 ASP CA C 73 55.038 55.038 56.826 -1.788 25259 348 1 . 1 1 73 73 ASP CB C 73 38.107 38.107 40.983 -2.876 25259 349 1 . 1 1 73 73 ASP H H 73 8.751 8.751 7.943 0.808 25259 350 1 . 1 1 74 74 GLN N N 74 117.025 117.025 117.176 -0.151 25259 351 1 . 1 1 74 74 GLN HA H 74 4.138 4.138 4.013 0.125 25259 352 1 . 1 1 74 74 GLN CA C 74 54.810 54.810 58.031 -3.222 25259 353 1 . 1 1 74 74 GLN CB C 74 27.564 27.564 29.349 -1.785 25259 354 1 . 1 1 74 74 GLN H H 74 7.447 7.447 7.950 -0.503 25259 355 1 . 1 1 75 75 HIS N N 75 116.494 116.494 114.847 1.647 25259 356 1 . 1 1 75 75 HIS HA H 75 4.716 4.716 4.612 0.104 25259 357 1 . 1 1 75 75 HIS CA C 75 54.066 54.066 56.674 -2.608 25259 358 1 . 1 1 75 75 HIS CB C 75 28.302 28.302 32.791 -4.489 25259 359 1 . 1 1 75 75 HIS H H 75 8.402 8.402 8.038 0.364 25259 360 1 . 1 1 76 76 GLY N N 76 112.564 112.564 105.571 6.993 25259 361 1 . 1 1 76 76 GLY CA C 76 41.896 41.896 44.735 -2.839 25259 362 1 . 1 1 76 76 GLY H H 76 9.091 9.091 7.718 1.373 25259 363 1 . 1 1 77 77 VAL N N 77 124.763 124.763 121.449 3.314 25259 364 1 . 1 1 77 77 VAL HA H 77 3.565 3.565 3.754 -0.190 25259 365 1 . 1 1 77 77 VAL CA C 77 64.951 64.951 65.330 -0.379 25259 366 1 . 1 1 77 77 VAL CB C 77 29.838 29.838 32.047 -2.209 25259 367 1 . 1 1 77 77 VAL H H 77 8.927 8.927 8.694 0.233 25259 368 1 . 1 1 78 78 GLU N N 78 124.388 124.388 118.605 5.783 25259 369 1 . 1 1 78 78 GLU HA H 78 4.148 4.148 4.040 0.108 25259 370 1 . 1 1 78 78 GLU CA C 78 58.316 58.316 59.600 -1.284 25259 371 1 . 1 1 78 78 GLU CB C 78 26.459 26.459 28.950 -2.491 25259 372 1 . 1 1 78 78 GLU H H 78 8.781 8.781 8.623 0.158 25259 373 1 . 1 1 79 79 GLU N N 79 121.887 121.887 118.334 3.553 25259 374 1 . 1 1 79 79 GLU HA H 79 4.188 4.188 4.214 -0.026 25259 375 1 . 1 1 79 79 GLU CA C 79 56.545 56.545 58.972 -2.427 25259 376 1 . 1 1 79 79 GLU CB C 79 27.033 27.033 29.430 -2.397 25259 377 1 . 1 1 79 79 GLU H H 79 9.231 9.231 8.232 0.999 25259 378 1 . 1 1 80 80 THR N N 80 120.781 120.781 116.806 3.975 25259 379 1 . 1 1 80 80 THR HA H 80 4.059 4.059 3.906 0.153 25259 380 1 . 1 1 80 80 THR CA C 80 65.487 65.487 66.660 -1.173 25259 381 1 . 1 1 80 80 THR CB C 80 64.369 64.369 68.513 -4.144 25259 382 1 . 1 1 80 80 THR H H 80 7.858 7.858 8.202 -0.344 25259 383 1 . 1 1 81 81 GLN N N 81 125.303 125.303 120.939 4.364 25259 384 1 . 1 1 81 81 GLN HA H 81 4.044 4.044 3.925 0.119 25259 385 1 . 1 1 81 81 GLN CA C 81 56.969 56.969 59.233 -2.264 25259 386 1 . 1 1 81 81 GLN CB C 81 26.077 26.077 28.392 -2.315 25259 387 1 . 1 1 81 81 GLN H H 81 8.765 8.765 7.903 0.862 25259 388 1 . 1 1 82 82 LYS N N 82 120.458 120.458 119.117 1.341 25259 389 1 . 1 1 82 82 LYS HA H 82 4.089 4.089 3.957 0.132 25259 390 1 . 1 1 82 82 LYS CA C 82 57.312 57.312 58.779 -1.466 25259 391 1 . 1 1 82 82 LYS CB C 82 30.154 30.154 31.863 -1.709 25259 392 1 . 1 1 82 82 LYS H H 82 7.521 7.521 7.647 -0.126 25259 393 1 . 1 1 83 83 ALA N N 83 125.234 125.234 121.614 3.620 25259 394 1 . 1 1 83 83 ALA HA H 83 4.217 4.217 3.901 0.316 25259 395 1 . 1 1 83 83 ALA CA C 83 52.442 52.442 54.604 -2.162 25259 396 1 . 1 1 83 83 ALA CB C 83 15.287 15.287 17.673 -2.386 25259 397 1 . 1 1 83 83 ALA H H 83 7.782 7.782 7.728 0.054 25259 398 1 . 1 1 84 84 LEU N N 84 123.348 123.348 118.372 4.976 25259 399 1 . 1 1 84 84 LEU HA H 84 4.058 4.058 3.893 0.165 25259 400 1 . 1 1 84 84 LEU CA C 84 55.499 55.499 57.686 -2.187 25259 401 1 . 1 1 84 84 LEU CB C 84 39.308 39.308 41.269 -1.961 25259 402 1 . 1 1 84 84 LEU H H 84 8.590 8.590 7.552 1.038 25259 403 1 . 1 1 85 85 LEU N N 85 122.872 122.872 118.760 4.112 25259 404 1 . 1 1 85 85 LEU HA H 85 4.170 4.170 3.955 0.215 25259 405 1 . 1 1 85 85 LEU CA C 85 55.396 55.396 57.406 -2.010 25259 406 1 . 1 1 85 85 LEU CB C 85 38.741 38.741 40.853 -2.112 25259 407 1 . 1 1 85 85 LEU H H 85 7.892 7.892 7.590 0.302 25259 408 1 . 1 1 86 86 GLU N N 86 122.713 122.713 118.581 4.132 25259 409 1 . 1 1 86 86 GLU HA H 86 4.085 4.085 4.017 0.068 25259 410 1 . 1 1 86 86 GLU CA C 86 56.745 56.745 58.933 -2.188 25259 411 1 . 1 1 86 86 GLU CB C 86 26.903 26.903 29.659 -2.756 25259 412 1 . 1 1 86 86 GLU H H 86 8.124 8.124 8.238 -0.114 25259 413 1 . 1 1 87 87 ALA N N 87 123.163 123.163 121.352 1.811 25259 414 1 . 1 1 87 87 ALA HA H 87 4.141 4.141 4.130 0.011 25259 415 1 . 1 1 87 87 ALA CA C 87 52.268 52.268 54.639 -2.371 25259 416 1 . 1 1 87 87 ALA CB C 87 15.632 15.632 18.603 -2.971 25259 417 1 . 1 1 87 87 ALA H H 87 7.765 7.765 7.505 0.260 25259 418 1 . 1 1 88 88 GLU N N 88 121.945 121.945 117.830 4.115 25259 419 1 . 1 1 88 88 GLU HA H 88 4.084 4.084 4.075 0.009 25259 420 1 . 1 1 88 88 GLU CA C 88 56.935 56.935 58.654 -1.719 25259 421 1 . 1 1 88 88 GLU CB C 88 28.027 28.027 29.370 -1.343 25259 422 1 . 1 1 88 88 GLU H H 88 7.846 7.846 8.030 -0.184 25259 423 1 . 1 1 89 89 GLU N N 89 117.978 117.978 117.820 0.158 25259 424 1 . 1 1 89 89 GLU HA H 89 4.093 4.093 4.118 -0.025 25259 425 1 . 1 1 89 89 GLU CA C 89 55.214 55.214 58.506 -3.292 25259 426 1 . 1 1 89 89 GLU CB C 89 27.407 27.407 29.306 -1.899 25259 427 1 . 1 1 89 89 GLU H H 89 7.634 7.634 7.909 -0.275 25259 428 1 . 1 1 90 90 LYS N N 90 117.519 117.519 116.103 1.416 25259 429 1 . 1 1 90 90 LYS HA H 90 4.431 4.431 4.396 0.035 25259 430 1 . 1 1 90 90 LYS CA C 90 53.018 53.018 55.623 -2.605 25259 431 1 . 1 1 90 90 LYS CB C 90 31.031 31.031 32.828 -1.797 25259 432 1 . 1 1 90 90 LYS H H 90 7.247 7.247 7.522 -0.275 25259 433 1 . 1 1 91 91 ASP N N 91 124.888 124.888 122.788 2.100 25259 434 1 . 1 1 91 91 ASP HA H 91 4.683 4.683 4.619 0.064 25259 435 1 . 1 1 91 91 ASP CA C 91 51.199 51.199 53.967 -2.768 25259 436 1 . 1 1 91 91 ASP CB C 91 39.581 39.581 41.939 -2.359 25259 437 1 . 1 1 91 91 ASP H H 91 7.370 7.370 7.645 -0.275 25259 438 1 . 1 1 92 92 LYS N N 92 129.311 129.311 126.793 2.518 25259 439 1 . 1 1 92 92 LYS HA H 92 4.013 4.013 3.901 0.112 25259 440 1 . 1 1 92 92 LYS CA C 92 57.216 57.216 59.519 -2.303 25259 441 1 . 1 1 92 92 LYS CB C 92 30.015 30.015 32.318 -2.303 25259 442 1 . 1 1 92 92 LYS H H 92 8.795 8.795 8.742 0.053 25259 443 1 . 1 1 93 93 SER N N 93 118.112 118.112 114.853 3.259 25259 444 1 . 1 1 93 93 SER HA H 93 4.439 4.439 4.250 0.189 25259 445 1 . 1 1 93 93 SER CA C 93 58.945 58.945 61.179 -2.235 25259 446 1 . 1 1 93 93 SER CB C 93 60.278 60.278 63.141 -2.863 25259 447 1 . 1 1 93 93 SER H H 93 8.488 8.488 8.237 0.251 25259 448 1 . 1 1 94 94 ILE N N 94 128.950 128.950 122.343 6.607 25259 449 1 . 1 1 94 94 ILE HA H 94 3.482 3.482 3.568 -0.086 25259 450 1 . 1 1 94 94 ILE CA C 94 62.349 62.349 64.414 -2.065 25259 451 1 . 1 1 94 94 ILE CB C 94 34.753 34.753 37.986 -3.233 25259 452 1 . 1 1 94 94 ILE H H 94 7.722 7.722 7.633 0.089 25259 453 1 . 1 1 95 95 ILE N N 95 123.598 123.598 120.633 2.965 25259 454 1 . 1 1 95 95 ILE HA H 95 3.595 3.595 3.514 0.081 25259 455 1 . 1 1 95 95 ILE CA C 95 62.747 62.747 65.762 -3.015 25259 456 1 . 1 1 95 95 ILE CB C 95 35.972 35.972 37.554 -1.582 25259 457 1 . 1 1 95 95 ILE H H 95 8.378 8.378 8.211 0.167 25259 458 1 . 1 1 96 96 GLU N N 96 118.317 118.317 118.131 0.186 25259 459 1 . 1 1 96 96 GLU HA H 96 3.984 3.984 3.967 0.017 25259 460 1 . 1 1 96 96 GLU CA C 96 56.495 56.495 59.141 -2.646 25259 461 1 . 1 1 96 96 GLU CB C 96 27.173 27.173 29.237 -2.064 25259 462 1 . 1 1 96 96 GLU H H 96 7.680 7.680 7.914 -0.234 25259 463 1 . 1 1 97 97 ALA N N 97 124.797 124.797 121.850 2.947 25259 464 1 . 1 1 97 97 ALA HA H 97 3.825 3.825 3.884 -0.059 25259 465 1 . 1 1 97 97 ALA CA C 97 52.297 52.297 54.142 -1.845 25259 466 1 . 1 1 97 97 ALA CB C 97 14.989 14.989 17.757 -2.768 25259 467 1 . 1 1 97 97 ALA H H 97 7.383 7.383 7.487 -0.104 25259 468 1 . 1 1 98 98 ARG N N 98 115.469 115.469 116.169 -0.700 25259 469 1 . 1 1 98 98 ARG HA H 98 4.306 4.306 4.312 -0.005 25259 470 1 . 1 1 98 98 ARG CA C 98 56.490 56.490 57.910 -1.420 25259 471 1 . 1 1 98 98 ARG CB C 98 28.238 28.238 29.889 -1.651 25259 472 1 . 1 1 98 98 ARG H H 98 8.229 8.229 8.010 0.219 25259 473 1 . 1 1 99 99 LYS N N 99 120.219 120.219 117.614 2.605 25259 474 1 . 1 1 99 99 LYS HA H 99 4.258 4.258 4.144 0.114 25259 475 1 . 1 1 99 99 LYS CA C 99 55.241 55.241 57.239 -1.998 25259 476 1 . 1 1 99 99 LYS CB C 99 30.496 30.496 32.521 -2.025 25259 477 1 . 1 1 99 99 LYS H H 99 7.270 7.270 7.440 -0.170 25259 478 1 . 1 1 100 100 LEU N N 100 123.800 123.800 120.116 3.684 25259 479 1 . 1 1 100 100 LEU HA H 100 4.341 4.341 4.354 -0.013 25259 480 1 . 1 1 100 100 LEU CA C 100 52.079 52.079 54.482 -2.404 25259 481 1 . 1 1 100 100 LEU CB C 100 39.131 39.131 42.381 -3.250 25259 482 1 . 1 1 100 100 LEU H H 100 7.837 7.837 7.645 0.192 25259 483 1 . 1 1 101 101 ALA N N 101 130.512 130.512 124.753 5.759 25259 484 1 . 1 1 101 101 ALA HA H 101 4.376 4.376 4.456 -0.080 25259 485 1 . 1 1 101 101 ALA CA C 101 50.404 50.404 52.907 -2.503 25259 486 1 . 1 1 101 101 ALA CB C 101 15.796 15.796 18.890 -3.094 25259 487 1 . 1 1 101 101 ALA H H 101 8.213 8.213 8.893 -0.680 25259 488 1 . 1 1 102 102 GLY N N 102 110.659 110.659 105.546 5.113 25259 489 1 . 1 1 102 102 GLY CA C 102 43.893 43.893 45.006 -1.113 25259 490 1 . 1 1 102 102 GLY H H 102 8.738 8.738 8.027 0.711 25259 491 1 . 1 1 103 103 PHE N N 103 123.097 123.097 121.982 1.115 25259 492 1 . 1 1 103 103 PHE HA H 103 5.220 5.220 5.361 -0.141 25259 493 1 . 1 1 103 103 PHE CA C 103 53.768 53.768 56.549 -2.781 25259 494 1 . 1 1 103 103 PHE CB C 103 40.574 40.574 42.191 -1.617 25259 495 1 . 1 1 103 103 PHE H H 103 7.514 7.514 7.557 -0.043 25259 496 1 . 1 1 104 104 LYS N N 104 130.652 130.652 125.262 5.390 25259 497 1 . 1 1 104 104 LYS HA H 104 4.120 4.120 4.327 -0.207 25259 498 1 . 1 1 104 104 LYS CA C 104 52.979 52.979 54.431 -1.452 25259 499 1 . 1 1 104 104 LYS CB C 104 34.237 34.237 36.677 -2.440 25259 500 1 . 1 1 104 104 LYS H H 104 7.473 7.473 8.029 -0.556 25259 501 1 . 1 1 105 105 LEU N N 105 127.372 127.372 122.871 4.501 25259 502 1 . 1 1 105 105 LEU HA H 105 4.996 4.996 4.934 0.062 25259 503 1 . 1 1 105 105 LEU CA C 105 51.736 51.736 53.822 -2.086 25259 504 1 . 1 1 105 105 LEU CB C 105 43.964 43.964 45.280 -1.316 25259 505 1 . 1 1 105 105 LEU H H 105 8.393 8.393 8.172 0.221 25259 506 1 . 1 1 106 106 GLU N N 106 129.358 129.358 125.041 4.317 25259 507 1 . 1 1 106 106 GLU HA H 106 4.844 4.844 4.700 0.144 25259 508 1 . 1 1 106 106 GLU CA C 106 52.790 52.790 55.027 -2.237 25259 509 1 . 1 1 106 106 GLU CB C 106 31.628 31.628 33.535 -1.907 25259 510 1 . 1 1 106 106 GLU H H 106 8.849 8.849 8.846 0.003 25259 511 1 . 1 1 107 107 THR N N 107 131.118 131.118 117.112 14.006 25259 512 1 . 1 1 107 107 THR HA H 107 5.110 5.110 4.904 0.206 25259 513 1 . 1 1 107 107 THR CA C 107 59.832 59.832 61.100 -1.268 25259 514 1 . 1 1 107 107 THR CB C 107 66.671 66.671 70.878 -4.207 25259 515 1 . 1 1 107 107 THR H H 107 9.433 9.433 8.339 1.094 25259 516 1 . 1 1 108 108 LYS N N 108 129.114 129.114 123.501 5.613 25259 517 1 . 1 1 108 108 LYS HA H 108 4.824 4.824 4.632 0.192 25259 518 1 . 1 1 108 108 LYS CA C 108 52.194 52.194 55.121 -2.927 25259 519 1 . 1 1 108 108 LYS CB C 108 34.388 34.388 35.756 -1.368 25259 520 1 . 1 1 108 108 LYS H H 108 9.410 9.410 9.003 0.407 25259 521 1 . 1 1 109 109 LEU N N 109 129.323 129.323 126.294 3.029 25259 522 1 . 1 1 109 109 LEU HA H 109 4.704 4.704 4.456 0.248 25259 523 1 . 1 1 109 109 LEU CA C 109 52.108 52.108 54.682 -2.574 25259 524 1 . 1 1 109 109 LEU CB C 109 39.655 39.655 42.341 -2.686 25259 525 1 . 1 1 109 109 LEU H H 109 8.862 8.862 8.769 0.093 25259 526 1 . 1 1 110 110 LEU N N 110 129.123 129.123 127.233 1.890 25259 527 1 . 1 1 110 110 LEU HA H 110 4.223 4.223 4.306 -0.083 25259 528 1 . 1 1 110 110 LEU CA C 110 53.782 53.782 56.367 -2.585 25259 529 1 . 1 1 110 110 LEU CB C 110 40.661 40.661 42.648 -1.987 25259 530 1 . 1 1 110 110 LEU H H 110 8.373 8.373 8.561 -0.189 25259 531 1 . 1 1 111 111 SER N N 111 114.587 114.587 111.026 3.561 25259 532 1 . 1 1 111 111 SER HA H 111 4.557 4.557 4.593 -0.036 25259 533 1 . 1 1 111 111 SER CA C 111 53.889 53.889 57.601 -3.712 25259 534 1 . 1 1 111 111 SER CB C 111 61.830 61.830 64.861 -3.031 25259 535 1 . 1 1 111 111 SER H H 111 8.400 8.400 7.710 0.690 25259 536 1 . 1 1 112 112 ALA N N 112 118.269 118.269 123.071 -4.802 25259 537 1 . 1 1 112 112 ALA HA H 112 4.309 4.309 4.296 0.013 25259 538 1 . 1 1 112 112 ALA CA C 112 51.214 51.214 54.429 -3.215 25259 539 1 . 1 1 112 112 ALA CB C 112 16.588 16.588 18.521 -1.932 25259 540 1 . 1 1 112 112 ALA H H 112 8.556 8.556 8.611 -0.055 25259 541 1 . 1 1 113 113 THR N N 113 102.878 102.878 103.337 -0.459 25259 542 1 . 1 1 113 113 THR HA H 113 4.662 4.662 4.460 0.202 25259 543 1 . 1 1 113 113 THR CA C 113 58.689 58.689 61.580 -2.891 25259 544 1 . 1 1 113 113 THR CB C 113 67.905 67.905 69.818 -1.913 25259 545 1 . 1 1 113 113 THR H H 113 8.065 8.065 7.655 0.410 25259 546 1 . 1 1 114 114 GLU N N 114 126.514 126.514 120.783 5.731 25259 547 1 . 1 1 114 114 GLU HA H 114 5.014 5.014 4.989 0.025 25259 548 1 . 1 1 114 114 GLU CA C 114 54.007 54.007 55.941 -1.934 25259 549 1 . 1 1 114 114 GLU CB C 114 32.913 32.913 34.202 -1.289 25259 550 1 . 1 1 114 114 GLU H H 114 7.357 7.357 7.766 -0.409 25259 551 1 . 1 1 115 115 LEU N N 115 128.058 128.058 119.244 8.814 25259 552 1 . 1 1 115 115 LEU HA H 115 4.922 4.922 5.192 -0.270 25259 553 1 . 1 1 115 115 LEU CA C 115 51.324 51.324 52.925 -1.601 25259 554 1 . 1 1 115 115 LEU CB C 115 44.139 44.139 46.088 -1.948 25259 555 1 . 1 1 115 115 LEU H H 115 8.930 8.930 8.617 0.313 25259 556 1 . 1 1 116 116 GLN N N 116 126.540 126.540 118.770 7.770 25259 557 1 . 1 1 116 116 GLN HA H 116 5.715 5.715 5.118 0.597 25259 558 1 . 1 1 116 116 GLN CA C 116 51.700 51.700 54.576 -2.876 25259 559 1 . 1 1 116 116 GLN CB C 116 32.292 32.292 33.287 -0.995 25259 560 1 . 1 1 116 116 GLN H H 116 9.221 9.221 8.952 0.269 25259 561 1 . 1 1 117 117 THR N N 117 125.213 125.213 120.043 5.170 25259 562 1 . 1 1 117 117 THR HA H 117 5.353 5.353 5.255 0.098 25259 563 1 . 1 1 117 117 THR CA C 117 58.926 58.926 61.049 -2.123 25259 564 1 . 1 1 117 117 THR CB C 117 68.948 68.948 72.272 -3.324 25259 565 1 . 1 1 117 117 THR H H 117 9.030 9.030 8.768 0.262 25259 566 1 . 1 1 118 118 THR N N 118 127.799 127.799 118.552 9.247 25259 567 1 . 1 1 118 118 THR HA H 118 5.527 5.527 5.066 0.461 25259 568 1 . 1 1 118 118 THR CA C 118 59.201 59.201 61.801 -2.600 25259 569 1 . 1 1 118 118 THR CB C 118 67.721 67.721 71.830 -4.109 25259 570 1 . 1 1 118 118 THR H H 118 9.459 9.459 8.735 0.724 25259 571 1 . 1 1 119 119 THR N N 119 129.258 129.258 122.305 6.953 25259 572 1 . 1 1 119 119 THR HA H 119 4.885 4.885 4.658 0.227 25259 573 1 . 1 1 119 119 THR CA C 119 58.463 58.463 61.458 -2.995 25259 574 1 . 1 1 119 119 THR CB C 119 67.459 67.459 70.089 -2.630 25259 575 1 . 1 1 119 119 THR H H 119 9.147 9.147 8.909 0.238 25259 576 1 . 1 1 120 120 SER N N 120 123.389 123.389 120.641 2.748 25259 577 1 . 1 1 120 120 SER HA H 120 5.328 5.328 4.900 0.428 25259 578 1 . 1 1 120 120 SER CA C 120 54.386 54.386 56.789 -2.403 25259 579 1 . 1 1 120 120 SER CB C 120 63.031 63.031 64.617 -1.586 25259 580 1 . 1 1 120 120 SER H H 120 8.786 8.786 8.429 0.357 25259 581 1 . 1 1 121 121 PHE N N 121 121.245 121.245 123.958 -2.713 25259 582 1 . 1 1 121 121 PHE HA H 121 5.112 5.112 4.930 0.182 25259 583 1 . 1 1 121 121 PHE CA C 121 53.192 53.192 56.355 -3.163 25259 584 1 . 1 1 121 121 PHE CB C 121 40.265 40.265 40.519 -0.254 25259 585 1 . 1 1 121 121 PHE H H 121 8.831 8.831 9.120 -0.289 25259 586 1 . 1 1 122 122 ASP N N 122 124.765 124.765 125.714 -0.949 25259 587 1 . 1 1 122 122 ASP HA H 122 4.840 4.840 4.910 -0.070 25259 588 1 . 1 1 122 122 ASP CA C 122 49.837 49.837 53.388 -3.551 25259 589 1 . 1 1 122 122 ASP CB C 122 38.485 38.485 40.421 -1.936 25259 590 1 . 1 1 122 122 ASP H H 122 8.819 8.819 8.882 -0.063 25259 591 1 . 1 1 123 123 PHE N N 123 124.303 124.303 122.691 1.612 25259 592 1 . 1 1 123 123 PHE HA H 123 4.674 4.674 4.272 0.402 25259 593 1 . 1 1 123 123 PHE CA C 123 57.798 57.798 60.593 -2.795 25259 594 1 . 1 1 123 123 PHE CB C 123 35.540 35.540 38.639 -3.099 25259 595 1 . 1 1 123 123 PHE H H 123 8.262 8.262 8.157 0.105 25259 596 1 . 1 1 124 124 GLN N N 124 120.792 120.792 117.457 3.335 25259 597 1 . 1 1 124 124 GLN HA H 124 4.434 4.434 4.210 0.224 25259 598 1 . 1 1 124 124 GLN CA C 124 56.083 56.083 58.266 -2.183 25259 599 1 . 1 1 124 124 GLN CB C 124 27.129 27.129 28.999 -1.870 25259 600 1 . 1 1 124 124 GLN H H 124 8.954 8.954 8.254 0.700 25259 601 1 . 1 1 125 125 VAL N N 125 114.091 114.091 112.093 1.998 25259 602 1 . 1 1 125 125 VAL HA H 125 4.409 4.409 4.352 0.057 25259 603 1 . 1 1 125 125 VAL CA C 125 59.298 59.298 61.772 -2.474 25259 604 1 . 1 1 125 125 VAL CB C 125 32.572 32.572 33.474 -0.902 25259 605 1 . 1 1 125 125 VAL H H 125 7.026 7.026 7.856 -0.830 25259 606 1 . 1 1 126 126 LEU N N 126 125.158 125.158 123.282 1.876 25259 607 1 . 1 1 126 126 LEU HA H 126 4.475 4.475 4.439 0.036 25259 608 1 . 1 1 126 126 LEU CA C 126 53.175 53.175 55.003 -1.828 25259 609 1 . 1 1 126 126 LEU CB C 126 42.054 42.054 43.125 -1.071 25259 610 1 . 1 1 126 126 LEU H H 126 8.106 8.106 7.781 0.325 25259 611 1 . 1 1 127 127 ASP N N 127 130.026 130.026 128.406 1.620 25259 612 1 . 1 1 127 127 ASP HA H 127 4.841 4.841 4.693 0.148 25259 613 1 . 1 1 127 127 ASP CA C 127 50.198 50.198 53.917 -3.719 25259 614 1 . 1 1 127 127 ASP CB C 127 37.689 37.689 40.099 -2.410 25259 615 1 . 1 1 127 127 ASP H H 127 9.129 9.129 8.838 0.291 25259 616 1 . 1 1 128 128 VAL N N 128 128.833 128.833 124.451 4.382 25259 617 1 . 1 1 128 128 VAL HA H 128 3.524 3.524 3.598 -0.074 25259 618 1 . 1 1 128 128 VAL CA C 128 63.668 63.668 66.162 -2.494 25259 619 1 . 1 1 128 128 VAL CB C 128 29.495 29.495 31.792 -2.297 25259 620 1 . 1 1 128 128 VAL H H 128 8.288 8.288 8.009 0.279 25259 621 1 . 1 1 129 129 LYS N N 129 123.914 123.914 118.717 5.197 25259 622 1 . 1 1 129 129 LYS HA H 129 4.043 4.043 4.027 0.016 25259 623 1 . 1 1 129 129 LYS CA C 129 56.789 56.789 58.908 -2.119 25259 624 1 . 1 1 129 129 LYS CB C 129 28.937 28.937 31.867 -2.930 25259 625 1 . 1 1 129 129 LYS H H 129 8.226 8.226 8.180 0.046 25259 626 1 . 1 1 130 130 LYS N N 130 121.888 121.888 117.507 4.381 25259 627 1 . 1 1 130 130 LYS HA H 130 4.085 4.085 4.227 -0.142 25259 628 1 . 1 1 130 130 LYS CA C 130 56.146 56.146 57.736 -1.590 25259 629 1 . 1 1 130 130 LYS CB C 130 30.340 30.340 32.989 -2.649 25259 630 1 . 1 1 130 130 LYS H H 130 7.590 7.590 7.755 -0.166 25259 631 1 . 1 1 131 131 ALA N N 131 123.088 123.088 122.960 0.128 25259 632 1 . 1 1 131 131 ALA HA H 131 3.927 3.927 4.076 -0.149 25259 633 1 . 1 1 131 131 ALA CA C 131 52.402 52.402 55.132 -2.730 25259 634 1 . 1 1 131 131 ALA CB C 131 16.447 16.447 18.322 -1.875 25259 635 1 . 1 1 131 131 ALA H H 131 8.506 8.506 8.321 0.185 25259 636 1 . 1 1 132 132 SER N N 132 110.456 110.456 111.871 -1.415 25259 637 1 . 1 1 132 132 SER HA H 132 4.117 4.117 4.186 -0.069 25259 638 1 . 1 1 132 132 SER CA C 132 58.289 58.289 60.216 -1.927 25259 639 1 . 1 1 132 132 SER CB C 132 61.034 61.034 63.139 -2.105 25259 640 1 . 1 1 132 132 SER H H 132 7.986 7.986 7.925 0.061 25259 641 1 . 1 1 133 133 GLN N N 133 119.034 119.034 118.201 0.833 25259 642 1 . 1 1 133 133 GLN HA H 133 4.402 4.402 4.479 -0.077 25259 643 1 . 1 1 133 133 GLN CA C 133 52.525 52.525 54.882 -2.357 25259 644 1 . 1 1 133 133 GLN CB C 133 27.234 27.234 29.166 -1.932 25259 645 1 . 1 1 133 133 GLN H H 133 7.233 7.233 7.731 -0.498 25259 646 1 . 1 1 134 134 LEU N N 134 123.291 123.291 121.230 2.061 25259 647 1 . 1 1 134 134 LEU HA H 134 4.393 4.393 4.494 -0.101 25259 648 1 . 1 1 134 134 LEU CA C 134 52.316 52.316 53.781 -1.465 25259 649 1 . 1 1 134 134 LEU CB C 134 38.847 38.847 42.486 -3.639 25259 650 1 . 1 1 134 134 LEU H H 134 7.411 7.411 7.567 -0.156 25259 651 1 . 1 1 135 135 GLU N N 135 128.446 128.446 123.130 5.316 25259 652 1 . 1 1 135 135 GLU HA H 135 3.946 3.946 3.892 0.054 25259 653 1 . 1 1 135 135 GLU CA C 135 57.384 57.384 59.486 -2.102 25259 654 1 . 1 1 135 135 GLU CB C 135 27.296 27.296 29.367 -2.071 25259 655 1 . 1 1 135 135 GLU H H 135 8.986 8.986 8.850 0.136 25259 656 1 . 1 1 136 136 HIS N N 136 117.593 117.593 117.539 0.054 25259 657 1 . 1 1 136 136 HIS HA H 136 4.383 4.383 4.395 -0.012 25259 658 1 . 1 1 136 136 HIS CA C 136 56.685 56.685 58.543 -1.858 25259 659 1 . 1 1 136 136 HIS CB C 136 28.413 28.413 29.787 -1.374 25259 660 1 . 1 1 136 136 HIS H H 136 9.226 9.226 8.341 0.885 25259 661 1 . 1 1 137 137 LEU N N 137 115.463 115.463 116.544 -1.081 25259 662 1 . 1 1 137 137 LEU HA H 137 4.507 4.507 4.525 -0.018 25259 663 1 . 1 1 137 137 LEU CA C 137 51.948 51.948 54.891 -2.943 25259 664 1 . 1 1 137 137 LEU CB C 137 39.807 39.807 42.360 -2.553 25259 665 1 . 1 1 137 137 LEU H H 137 7.090 7.090 8.011 -0.921 25259 666 1 . 1 1 138 138 LYS N N 138 124.686 124.686 120.853 3.833 25259 667 1 . 1 1 138 138 LYS HA H 138 4.169 4.169 4.148 0.021 25259 668 1 . 1 1 138 138 LYS CA C 138 57.158 57.158 58.838 -1.680 25259 669 1 . 1 1 138 138 LYS CB C 138 30.088 30.088 32.208 -2.120 25259 670 1 . 1 1 138 138 LYS H H 138 7.698 7.698 7.869 -0.171 25259 671 1 . 1 1 139 139 ASN N N 139 118.077 118.077 114.940 3.137 25259 672 1 . 1 1 139 139 ASN HA H 139 4.673 4.673 4.614 0.059 25259 673 1 . 1 1 139 139 ASN CA C 139 51.782 51.782 53.923 -2.141 25259 674 1 . 1 1 139 139 ASN CB C 139 35.817 35.817 38.678 -2.861 25259 675 1 . 1 1 139 139 ASN H H 139 8.485 8.485 8.227 0.258 25259 676 1 . 1 1 140 140 ILE N N 140 120.880 120.880 119.942 0.938 25259 677 1 . 1 1 140 140 ILE HA H 140 4.030 4.030 4.208 -0.178 25259 678 1 . 1 1 140 140 ILE CA C 140 59.566 59.566 61.096 -1.530 25259 679 1 . 1 1 140 140 ILE CB C 140 35.774 35.774 38.709 -2.935 25259 680 1 . 1 1 140 140 ILE H H 140 7.549 7.549 7.544 0.005 25259 681 1 . 1 1 141 141 GLY N N 141 110.676 110.676 114.047 -3.371 25259 682 1 . 1 1 141 141 GLY CA C 141 44.664 44.664 44.760 -0.096 25259 683 1 . 1 1 141 141 GLY H H 141 7.663 7.663 8.608 -0.945 25259 684 1 . 1 1 142 142 LEU N N 142 123.857 123.857 122.975 0.882 25259 685 1 . 1 1 142 142 LEU HA H 142 3.693 3.693 3.828 -0.135 25259 686 1 . 1 1 142 142 LEU CA C 142 55.193 55.193 57.593 -2.400 25259 687 1 . 1 1 142 142 LEU CB C 142 40.609 40.609 41.685 -1.076 25259 688 1 . 1 1 142 142 LEU H H 142 8.496 8.496 7.655 0.841 25259 689 1 . 1 1 143 143 GLU N N 143 118.407 118.407 117.833 0.574 25259 690 1 . 1 1 143 143 GLU HA H 143 3.786 3.786 3.938 -0.152 25259 691 1 . 1 1 143 143 GLU CA C 143 57.222 57.222 59.003 -1.781 25259 692 1 . 1 1 143 143 GLU CB C 143 26.513 26.513 29.019 -2.506 25259 693 1 . 1 1 143 143 GLU H H 143 8.672 8.672 8.467 0.205 25259 694 1 . 1 1 144 144 ASN N N 144 118.477 118.477 116.737 1.740 25259 695 1 . 1 1 144 144 ASN HA H 144 4.442 4.442 4.515 -0.073 25259 696 1 . 1 1 144 144 ASN CA C 144 52.712 52.712 54.705 -1.993 25259 697 1 . 1 1 144 144 ASN CB C 144 35.955 35.955 38.525 -2.570 25259 698 1 . 1 1 144 144 ASN H H 144 7.656 7.656 7.889 -0.233 25259 699 1 . 1 1 145 145 LEU N N 145 125.354 125.354 121.260 4.094 25259 700 1 . 1 1 145 145 LEU HA H 145 3.797 3.797 3.780 0.017 25259 701 1 . 1 1 145 145 LEU CA C 145 56.323 56.323 57.389 -1.066 25259 702 1 . 1 1 145 145 LEU CB C 145 39.573 39.573 42.054 -2.481 25259 703 1 . 1 1 145 145 LEU H H 145 7.758 7.758 7.648 0.110 25259 704 1 . 1 1 146 146 LEU N N 146 116.372 116.372 116.679 -0.307 25259 705 1 . 1 1 146 146 LEU HA H 146 3.876 3.876 3.883 -0.007 25259 706 1 . 1 1 146 146 LEU CA C 146 53.243 53.243 55.579 -2.336 25259 707 1 . 1 1 146 146 LEU CB C 146 38.897 38.897 40.921 -2.025 25259 708 1 . 1 1 146 146 LEU H H 146 7.242 7.242 7.511 -0.269 25259 709 1 . 1 1 147 147 LYS N N 147 120.054 120.054 118.209 1.845 25259 710 1 . 1 1 147 147 LYS HA H 147 4.312 4.312 4.378 -0.066 25259 711 1 . 1 1 147 147 LYS CA C 147 54.623 54.623 55.825 -1.202 25259 712 1 . 1 1 147 147 LYS CB C 147 30.260 30.260 32.700 -2.440 25259 713 1 . 1 1 147 147 LYS H H 147 7.185 7.185 7.933 -0.748 25259 714 1 . 1 1 148 148 ASN N N 148 119.498 119.498 117.323 2.175 25259 715 1 . 1 1 148 148 ASN HA H 148 4.962 4.962 4.853 0.109 25259 716 1 . 1 1 148 148 ASN CA C 148 49.774 49.774 51.991 -2.217 25259 717 1 . 1 1 148 148 ASN CB C 148 39.486 39.486 40.308 -0.822 25259 718 1 . 1 1 148 148 ASN H H 148 7.698 7.698 7.625 0.073 25259 719 1 . 1 1 149 149 GLU N N 149 122.834 122.834 118.269 4.565 25259 720 1 . 1 1 149 149 GLU HA H 149 4.601 4.601 4.471 0.130 25259 721 1 . 1 1 149 149 GLU CA C 149 52.219 52.219 54.527 -2.308 25259 722 1 . 1 1 149 149 GLU CB C 149 26.810 26.810 29.442 -2.632 25259 723 1 . 1 1 149 149 GLU H H 149 8.767 8.767 8.651 0.116 25259 724 1 . 1 1 150 150 PRO HA H 150 3.608 3.608 2.770 0.838 25259 725 1 . 1 1 150 150 PRO CA C 150 63.242 63.242 64.375 -1.133 25259 726 1 . 1 1 150 150 PRO CB C 150 28.095 28.095 31.086 -2.991 25259 727 1 . 1 1 151 151 SER N N 151 112.839 112.839 110.999 1.840 25259 728 1 . 1 1 151 151 SER HA H 151 3.835 3.835 4.360 -0.525 25259 729 1 . 1 1 151 151 SER CA C 151 59.270 59.270 58.496 0.774 25259 730 1 . 1 1 151 151 SER CB C 151 59.451 59.451 62.910 -3.459 25259 731 1 . 1 1 151 151 SER H H 151 8.519 8.519 7.846 0.673 25259 732 1 . 1 1 152 152 LYS N N 152 126.710 126.710 123.029 3.681 25259 733 1 . 1 1 152 152 LYS HA H 152 4.248 4.248 4.081 0.167 25259 734 1 . 1 1 152 152 LYS CA C 152 55.765 55.765 59.311 -3.546 25259 735 1 . 1 1 152 152 LYS CB C 152 30.257 30.257 32.528 -2.271 25259 736 1 . 1 1 152 152 LYS H H 152 7.006 7.006 7.743 -0.737 25259 737 1 . 1 1 153 153 TYR N N 153 123.239 123.239 116.519 6.720 25259 738 1 . 1 1 153 153 TYR HA H 153 4.258 4.258 4.469 -0.211 25259 739 1 . 1 1 153 153 TYR CA C 153 59.309 59.309 58.146 1.163 25259 740 1 . 1 1 153 153 TYR CB C 153 36.334 36.334 37.536 -1.202 25259 741 1 . 1 1 153 153 TYR H H 153 8.058 8.058 8.172 -0.114 25259 742 1 . 1 1 154 154 ILE N N 154 120.253 120.253 121.338 -1.086 25259 743 1 . 1 1 154 154 ILE HA H 154 3.373 3.373 3.190 0.183 25259 744 1 . 1 1 154 154 ILE CA C 154 63.114 63.114 65.136 -2.022 25259 745 1 . 1 1 154 154 ILE CB C 154 35.948 35.948 37.212 -1.264 25259 746 1 . 1 1 154 154 ILE H H 154 8.193 8.193 7.695 0.498 25259 747 1 . 1 1 155 155 SER N N 155 117.178 117.178 114.589 2.589 25259 748 1 . 1 1 155 155 SER HA H 155 4.091 4.091 4.058 0.033 25259 749 1 . 1 1 155 155 SER CA C 155 59.961 59.961 61.704 -1.743 25259 750 1 . 1 1 155 155 SER CB C 155 60.148 60.148 62.790 -2.642 25259 751 1 . 1 1 155 155 SER H H 155 8.020 8.020 7.930 0.090 25259 752 1 . 1 1 156 156 ASP N N 156 125.479 125.479 121.217 4.262 25259 753 1 . 1 1 156 156 ASP HA H 156 4.427 4.427 4.455 -0.028 25259 754 1 . 1 1 156 156 ASP CA C 156 54.760 54.760 56.720 -1.960 25259 755 1 . 1 1 156 156 ASP CB C 156 37.873 37.873 40.981 -3.108 25259 756 1 . 1 1 156 156 ASP H H 156 8.638 8.638 7.712 0.926 25259 757 1 . 1 1 157 157 ARG N N 157 121.542 121.542 119.478 2.064 25259 758 1 . 1 1 157 157 ARG HA H 157 4.111 4.111 4.060 0.051 25259 759 1 . 1 1 157 157 ARG CA C 157 55.928 55.928 58.445 -2.517 25259 760 1 . 1 1 157 157 ARG CB C 157 27.816 27.816 29.760 -1.944 25259 761 1 . 1 1 157 157 ARG H H 157 7.888 7.888 7.812 0.076 25259 762 1 . 1 1 158 158 LEU N N 158 124.257 124.257 119.680 4.577 25259 763 1 . 1 1 158 158 LEU HA H 158 4.271 4.271 4.237 0.034 25259 764 1 . 1 1 158 158 LEU CA C 158 55.213 55.213 57.986 -2.773 25259 765 1 . 1 1 158 158 LEU CB C 158 38.945 38.945 41.096 -2.151 25259 766 1 . 1 1 158 158 LEU H H 158 8.442 8.442 7.822 0.620 25259 767 1 . 1 1 159 159 ALA N N 159 124.146 124.146 120.285 3.861 25259 768 1 . 1 1 159 159 ALA HA H 159 4.332 4.332 4.104 0.228 25259 769 1 . 1 1 159 159 ALA CA C 159 51.432 51.432 54.189 -2.757 25259 770 1 . 1 1 159 159 ALA CB C 159 15.907 15.907 18.503 -2.596 25259 771 1 . 1 1 159 159 ALA H H 159 8.086 8.086 7.905 0.181 25259 772 1 . 1 1 160 160 ASN N N 160 118.093 118.093 116.107 1.986 25259 773 1 . 1 1 160 160 ASN HA H 160 4.992 4.992 4.677 0.315 25259 774 1 . 1 1 160 160 ASN CA C 160 50.577 50.577 53.261 -2.684 25259 775 1 . 1 1 160 160 ASN CB C 160 37.733 37.733 38.805 -1.071 25259 776 1 . 1 1 160 160 ASN H H 160 7.445 7.445 7.859 -0.414 25259 777 1 . 1 1 161 161 GLY N N 161 108.365 108.365 106.393 1.972 25259 778 1 . 1 1 161 161 GLY CA C 161 43.646 43.646 45.119 -1.473 25259 779 1 . 1 1 161 161 GLY H H 161 7.743 7.743 7.859 -0.116 25259 780 1 . 1 1 162 162 ALA N N 162 123.928 123.928 122.326 1.602 25259 781 1 . 1 1 162 162 ALA HA H 162 4.873 4.873 4.971 -0.098 25259 782 1 . 1 1 162 162 ALA CA C 162 49.526 49.526 51.309 -1.783 25259 783 1 . 1 1 162 162 ALA CB C 162 18.060 18.060 21.281 -3.221 25259 784 1 . 1 1 162 162 ALA H H 162 8.035 8.035 7.632 0.403 25259 785 1 . 1 1 163 163 THR N N 163 113.286 113.286 111.404 1.882 25259 786 1 . 1 1 163 163 THR HA H 163 4.703 4.703 4.671 0.032 25259 787 1 . 1 1 163 163 THR CA C 163 57.791 57.791 60.529 -2.738 25259 788 1 . 1 1 163 163 THR CB C 163 68.974 68.974 71.373 -2.399 25259 789 1 . 1 1 163 163 THR H H 163 8.451 8.451 8.483 -0.032 25259 790 1 . 1 1 164 164 GLU N N 164 125.905 125.905 119.866 6.039 25259 791 1 . 1 1 164 164 GLU HA H 164 5.060 5.060 4.841 0.219 25259 792 1 . 1 1 164 164 GLU CA C 164 53.585 53.585 55.127 -1.542 25259 793 1 . 1 1 164 164 GLU CB C 164 29.211 29.211 32.017 -2.806 25259 794 1 . 1 1 164 164 GLU H H 164 8.716 8.716 8.504 0.212 25259 stop_ save_