data_17893 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17893 _Entry.PDB_ID 2LII 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 17893 _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 ILE N N 2 123.389 123.389 120.797 2.592 17893 2 1 1 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.063 0.058 17893 3 1 1 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.097 1.076 17893 4 1 1 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.984 0.148 17893 5 1 1 . 1 1 2 2 ILE H H 2 9.112 9.112 7.675 1.437 17893 6 1 1 . 1 1 3 3 ILE N N 3 108.863 108.863 128.794 -19.931 17893 7 1 1 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.191 0.242 17893 8 1 1 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.272 -0.118 17893 9 1 1 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.524 -0.869 17893 10 1 1 . 1 1 3 3 ILE H H 3 9.418 9.418 9.063 0.355 17893 11 1 1 . 1 1 4 4 ASN N N 4 123.919 123.919 125.806 -1.887 17893 12 1 1 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.843 0.789 17893 13 1 1 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.252 -0.874 17893 14 1 1 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.871 2.166 17893 15 1 1 . 1 1 4 4 ASN H H 4 9.056 9.056 8.880 0.176 17893 16 1 1 . 1 1 5 5 ASN N N 5 120.944 120.944 123.725 -2.781 17893 17 1 1 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.777 0.666 17893 18 1 1 . 1 1 5 5 ASN CA C 5 51.415 51.415 53.566 -2.151 17893 19 1 1 . 1 1 5 5 ASN CB C 5 39.813 39.813 39.404 0.409 17893 20 1 1 . 1 1 5 5 ASN H H 5 9.383 9.383 9.044 0.339 17893 21 1 1 . 1 1 6 6 LEU N N 6 120.594 120.594 123.101 -2.507 17893 22 1 1 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.873 -0.106 17893 23 1 1 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.053 0.646 17893 24 1 1 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.543 -0.738 17893 25 1 1 . 1 1 6 6 LEU H H 6 8.531 8.531 9.217 -0.686 17893 26 1 1 . 1 1 7 7 LYS N N 7 118.212 118.212 118.030 0.182 17893 27 1 1 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.969 -0.036 17893 28 1 1 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.307 0.956 17893 29 1 1 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.404 0.899 17893 30 1 1 . 1 1 7 7 LYS H H 7 8.933 8.933 7.744 1.189 17893 31 1 1 . 1 1 8 8 LEU N N 8 116.414 116.414 120.632 -4.218 17893 32 1 1 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.086 0.087 17893 33 1 1 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.240 0.150 17893 34 1 1 . 1 1 8 8 LEU CB C 8 42.028 42.028 42.005 0.023 17893 35 1 1 . 1 1 8 8 LEU H H 8 7.667 7.667 7.475 0.192 17893 36 1 1 . 1 1 9 9 ILE N N 9 119.134 119.134 119.024 0.110 17893 37 1 1 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.562 0.252 17893 38 1 1 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.466 -2.610 17893 39 1 1 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.608 -1.146 17893 40 1 1 . 1 1 9 9 ILE H H 9 8.226 8.226 8.829 -0.603 17893 41 1 1 . 1 1 10 10 ARG N N 10 120.162 120.162 120.002 0.160 17893 42 1 1 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.833 0.068 17893 43 1 1 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.163 0.564 17893 44 1 1 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.151 -1.652 17893 45 1 1 . 1 1 10 10 ARG H H 10 9.260 9.260 8.771 0.489 17893 46 1 1 . 1 1 11 11 GLU N N 11 115.948 115.948 117.847 -1.899 17893 47 1 1 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.139 0.034 17893 48 1 1 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.826 0.560 17893 49 1 1 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.079 -0.165 17893 50 1 1 . 1 1 11 11 GLU H H 11 8.701 8.701 7.758 0.943 17893 51 1 1 . 1 1 12 12 LYS N N 12 122.900 122.900 120.093 2.807 17893 52 1 1 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.044 0.178 17893 53 1 1 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.326 0.090 17893 54 1 1 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.617 -0.619 17893 55 1 1 . 1 1 12 12 LYS H H 12 8.254 8.254 7.840 0.414 17893 56 1 1 . 1 1 13 13 LYS N N 13 116.385 116.385 114.788 1.597 17893 57 1 1 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.313 -0.016 17893 58 1 1 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.830 -0.798 17893 59 1 1 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.372 -0.823 17893 60 1 1 . 1 1 13 13 LYS H H 13 7.809 7.809 7.785 0.024 17893 61 1 1 . 1 1 14 14 LYS N N 14 115.317 115.317 115.581 -0.264 17893 62 1 1 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.935 0.047 17893 63 1 1 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.936 -0.048 17893 64 1 1 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.547 -1.261 17893 65 1 1 . 1 1 14 14 LYS H H 14 8.069 8.069 7.852 0.217 17893 66 1 1 . 1 1 15 15 ILE N N 15 118.431 118.431 120.612 -2.181 17893 67 1 1 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.179 0.444 17893 68 1 1 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.510 -0.311 17893 69 1 1 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.610 2.286 17893 70 1 1 . 1 1 15 15 ILE H H 15 7.569 7.569 8.305 -0.736 17893 71 1 1 . 1 1 16 16 SER N N 16 125.034 125.034 122.062 2.972 17893 72 1 1 . 1 1 16 16 SER HA H 16 4.585 4.585 4.688 -0.103 17893 73 1 1 . 1 1 16 16 SER CA C 16 57.004 57.004 57.418 -0.414 17893 74 1 1 . 1 1 16 16 SER CB C 16 64.914 64.914 65.359 -0.445 17893 75 1 1 . 1 1 16 16 SER H H 16 9.440 9.440 8.622 0.818 17893 76 1 1 . 1 1 17 17 GLN N N 17 120.228 120.228 122.967 -2.739 17893 77 1 1 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.969 -0.182 17893 78 1 1 . 1 1 17 17 GLN CA C 17 61.516 61.516 60.124 1.392 17893 79 1 1 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.474 0.577 17893 80 1 1 . 1 1 17 17 GLN H H 17 9.527 9.527 8.971 0.556 17893 81 1 1 . 1 1 18 18 SER N N 18 112.979 112.979 114.664 -1.685 17893 82 1 1 . 1 1 18 18 SER HA H 18 4.531 4.531 4.096 0.435 17893 83 1 1 . 1 1 18 18 SER CA C 18 62.872 62.872 61.235 1.637 17893 84 1 1 . 1 1 18 18 SER CB C 18 65.338 65.338 62.263 3.075 17893 85 1 1 . 1 1 18 18 SER H H 18 8.949 8.949 8.495 0.454 17893 86 1 1 . 1 1 19 19 GLU N N 19 124.147 124.147 123.355 0.792 17893 87 1 1 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.055 0.052 17893 88 1 1 . 1 1 19 19 GLU CA C 19 58.613 58.613 59.123 -0.511 17893 89 1 1 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.453 0.086 17893 90 1 1 . 1 1 19 19 GLU H H 19 8.331 8.331 8.517 -0.186 17893 91 1 1 . 1 1 20 20 LEU N N 20 119.943 119.943 120.841 -0.898 17893 92 1 1 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.936 0.218 17893 93 1 1 . 1 1 20 20 LEU CA C 20 57.574 57.574 58.096 -0.522 17893 94 1 1 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.648 -0.643 17893 95 1 1 . 1 1 20 20 LEU H H 20 8.314 8.314 8.362 -0.048 17893 96 1 1 . 1 1 21 21 ALA N N 21 119.877 119.877 122.000 -2.123 17893 97 1 1 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.898 -0.174 17893 98 1 1 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.242 0.212 17893 99 1 1 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.041 -1.180 17893 100 1 1 . 1 1 21 21 ALA H H 21 8.588 8.588 8.736 -0.148 17893 101 1 1 . 1 1 22 22 ALA N N 22 117.330 117.330 121.646 -4.316 17893 102 1 1 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.978 0.286 17893 103 1 1 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.763 -0.154 17893 104 1 1 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.566 -0.910 17893 105 1 1 . 1 1 22 22 ALA H H 22 7.813 7.813 8.397 -0.584 17893 106 1 1 . 1 1 23 23 LEU N N 23 118.586 118.586 118.086 0.500 17893 107 1 1 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.721 0.240 17893 108 1 1 . 1 1 23 23 LEU CA C 23 57.100 57.100 56.964 0.136 17893 109 1 1 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.711 -0.287 17893 110 1 1 . 1 1 23 23 LEU H H 23 7.538 7.538 7.910 -0.372 17893 111 1 1 . 1 1 24 24 LEU N N 24 114.488 114.488 114.918 -0.430 17893 112 1 1 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.119 0.145 17893 113 1 1 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.022 -0.228 17893 114 1 1 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.035 1.398 17893 115 1 1 . 1 1 24 24 LEU H H 24 7.449 7.449 7.814 -0.365 17893 116 1 1 . 1 1 25 25 GLU N N 25 114.895 114.895 115.759 -0.864 17893 117 1 1 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.010 -0.044 17893 118 1 1 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.201 -0.053 17893 119 1 1 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.173 -0.180 17893 120 1 1 . 1 1 25 25 GLU H H 25 8.029 8.029 7.323 0.706 17893 121 1 1 . 1 1 26 26 VAL N N 26 109.738 109.738 111.608 -1.870 17893 122 1 1 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.709 0.181 17893 123 1 1 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.066 -0.786 17893 124 1 1 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.372 0.923 17893 125 1 1 . 1 1 26 26 VAL H H 26 7.989 7.989 8.007 -0.018 17893 126 1 1 . 1 1 27 27 SER N N 27 114.381 114.381 115.662 -1.281 17893 127 1 1 . 1 1 27 27 SER HA H 27 4.644 4.644 4.412 0.232 17893 128 1 1 . 1 1 27 27 SER CA C 27 56.445 56.445 57.798 -1.353 17893 129 1 1 . 1 1 27 27 SER CB C 27 62.251 62.251 64.529 -2.278 17893 130 1 1 . 1 1 27 27 SER H H 27 8.618 8.618 8.582 0.036 17893 131 1 1 . 1 1 28 28 ARG N N 28 115.323 115.323 128.795 -13.472 17893 132 1 1 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.992 -0.244 17893 133 1 1 . 1 1 28 28 ARG CA C 28 59.919 59.919 59.976 -0.057 17893 134 1 1 . 1 1 28 28 ARG CB C 28 29.050 29.050 30.252 -1.202 17893 135 1 1 . 1 1 28 28 ARG H H 28 8.242 8.242 8.962 -0.720 17893 136 1 1 . 1 1 29 29 GLN N N 29 117.343 117.343 116.520 0.823 17893 137 1 1 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.058 0.116 17893 138 1 1 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.720 0.365 17893 139 1 1 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.637 -0.069 17893 140 1 1 . 1 1 29 29 GLN H H 29 8.827 8.827 8.492 0.335 17893 141 1 1 . 1 1 30 30 THR N N 30 119.996 119.996 116.923 3.073 17893 142 1 1 . 1 1 30 30 THR HA H 30 4.434 4.434 4.243 0.191 17893 143 1 1 . 1 1 30 30 THR CA C 30 67.621 67.621 65.724 1.897 17893 144 1 1 . 1 1 30 30 THR CB C 30 66.513 66.513 68.259 -1.746 17893 145 1 1 . 1 1 30 30 THR H H 30 8.132 8.132 7.934 0.198 17893 146 1 1 . 1 1 31 31 ILE N N 31 118.828 118.828 122.283 -3.455 17893 147 1 1 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.801 -0.015 17893 148 1 1 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.260 -2.231 17893 149 1 1 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.710 -1.633 17893 150 1 1 . 1 1 31 31 ILE H H 31 7.163 7.163 7.723 -0.560 17893 151 1 1 . 1 1 32 32 ASN N N 32 118.098 118.098 118.498 -0.400 17893 152 1 1 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.408 -0.053 17893 153 1 1 . 1 1 32 32 ASN CA C 32 57.254 57.254 55.951 1.303 17893 154 1 1 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.467 0.781 17893 155 1 1 . 1 1 32 32 ASN H H 32 8.656 8.656 8.909 -0.253 17893 156 1 1 . 1 1 33 33 GLY N N 33 124.952 124.952 107.393 17.559 17893 157 1 1 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.138 1.002 17893 158 1 1 . 1 1 33 33 GLY H H 33 8.643 8.643 8.445 0.198 17893 159 1 1 . 1 1 34 34 ILE N N 34 122.233 122.233 122.549 -0.316 17893 160 1 1 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.197 0.107 17893 161 1 1 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.218 0.586 17893 162 1 1 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.565 -0.279 17893 163 1 1 . 1 1 34 34 ILE H H 34 8.203 8.203 7.477 0.726 17893 164 1 1 . 1 1 35 35 GLU N N 35 120.686 120.686 115.764 4.922 17893 165 1 1 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.318 -0.104 17893 166 1 1 . 1 1 35 35 GLU CA C 35 59.692 59.692 56.634 3.058 17893 167 1 1 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.408 -0.556 17893 168 1 1 . 1 1 35 35 GLU H H 35 8.575 8.575 8.451 0.124 17893 169 1 1 . 1 1 36 36 LYS N N 36 116.029 116.029 120.847 -4.818 17893 170 1 1 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.478 0.043 17893 171 1 1 . 1 1 36 36 LYS CA C 36 55.507 55.507 54.883 0.624 17893 172 1 1 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.576 -1.637 17893 173 1 1 . 1 1 36 36 LYS H H 36 8.107 8.107 7.394 0.713 17893 174 1 1 . 1 1 37 37 ASN N N 37 114.692 114.692 116.807 -2.115 17893 175 1 1 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.654 0.095 17893 176 1 1 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.340 1.448 17893 177 1 1 . 1 1 37 37 ASN CB C 37 36.949 36.949 38.375 -1.426 17893 178 1 1 . 1 1 37 37 ASN H H 37 8.240 8.240 8.536 -0.296 17893 179 1 1 . 1 1 38 38 LYS N N 38 115.098 115.098 120.396 -5.298 17893 180 1 1 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.053 0.383 17893 181 1 1 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.593 -2.415 17893 182 1 1 . 1 1 38 38 LYS CB C 38 33.236 33.236 32.803 0.433 17893 183 1 1 . 1 1 38 38 LYS H H 38 8.727 8.727 7.900 0.827 17893 184 1 1 . 1 1 39 39 TYR N N 39 117.011 117.011 113.293 3.718 17893 185 1 1 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.825 -0.196 17893 186 1 1 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.480 0.079 17893 187 1 1 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.902 1.001 17893 188 1 1 . 1 1 39 39 TYR H H 39 7.087 7.087 6.922 0.165 17893 189 1 1 . 1 1 40 40 ASN N N 40 123.595 123.595 120.162 3.433 17893 190 1 1 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.893 0.360 17893 191 1 1 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.367 -1.595 17893 192 1 1 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.043 -0.567 17893 193 1 1 . 1 1 40 40 ASN H H 40 8.842 8.842 8.508 0.334 17893 194 1 1 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.502 -0.693 17893 195 1 1 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.608 -0.079 17893 196 1 1 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.184 -0.623 17893 197 1 1 . 1 1 42 42 SER N N 42 125.580 125.580 115.531 10.049 17893 198 1 1 . 1 1 42 42 SER HA H 42 4.581 4.581 4.273 0.308 17893 199 1 1 . 1 1 42 42 SER CA C 42 57.380 57.380 57.880 -0.500 17893 200 1 1 . 1 1 42 42 SER CB C 42 64.562 64.562 63.916 0.646 17893 201 1 1 . 1 1 42 42 SER H H 42 8.033 8.033 8.148 -0.115 17893 202 1 1 . 1 1 43 43 LEU N N 43 120.759 120.759 125.009 -4.250 17893 203 1 1 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.989 -0.075 17893 204 1 1 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.524 -0.179 17893 205 1 1 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.389 -0.533 17893 206 1 1 . 1 1 43 43 LEU H H 43 9.289 9.289 8.755 0.534 17893 207 1 1 . 1 1 44 44 GLN N N 44 115.948 115.948 118.881 -2.933 17893 208 1 1 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.106 -0.379 17893 209 1 1 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.107 1.029 17893 210 1 1 . 1 1 44 44 GLN CB C 44 28.250 28.250 27.916 0.334 17893 211 1 1 . 1 1 44 44 GLN H H 44 8.906 8.906 8.661 0.245 17893 212 1 1 . 1 1 45 45 LEU N N 45 119.419 119.419 119.972 -0.553 17893 213 1 1 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.045 -0.120 17893 214 1 1 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.230 -2.627 17893 215 1 1 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.281 -0.654 17893 216 1 1 . 1 1 45 45 LEU H H 45 8.078 8.078 7.912 0.166 17893 217 1 1 . 1 1 46 46 ALA N N 46 120.544 120.544 122.423 -1.879 17893 218 1 1 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.930 0.118 17893 219 1 1 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.323 0.421 17893 220 1 1 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.947 1.786 17893 221 1 1 . 1 1 46 46 ALA H H 46 8.518 8.518 8.898 -0.380 17893 222 1 1 . 1 1 47 47 LEU N N 47 116.461 116.461 118.797 -2.336 17893 223 1 1 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.876 0.339 17893 224 1 1 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.102 -0.601 17893 225 1 1 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.596 -0.510 17893 226 1 1 . 1 1 47 47 LEU H H 47 8.676 8.676 8.526 0.150 17893 227 1 1 . 1 1 48 48 LYS N N 48 120.958 120.958 120.223 0.735 17893 228 1 1 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.062 -0.462 17893 229 1 1 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.024 -0.095 17893 230 1 1 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.473 -0.205 17893 231 1 1 . 1 1 48 48 LYS H H 48 8.036 8.036 8.157 -0.121 17893 232 1 1 . 1 1 49 49 ILE N N 49 120.407 120.407 120.487 -0.080 17893 233 1 1 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.824 -0.225 17893 234 1 1 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.753 1.449 17893 235 1 1 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.961 -0.308 17893 236 1 1 . 1 1 49 49 ILE H H 49 8.779 8.779 8.609 0.170 17893 237 1 1 . 1 1 50 50 ALA N N 50 120.480 120.480 123.098 -2.618 17893 238 1 1 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.104 -0.025 17893 239 1 1 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.346 0.277 17893 240 1 1 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.188 -0.183 17893 241 1 1 . 1 1 50 50 ALA H H 50 8.173 8.173 8.637 -0.464 17893 242 1 1 . 1 1 51 51 TYR N N 51 117.118 117.118 120.514 -3.396 17893 243 1 1 . 1 1 51 51 TYR HA H 51 4.365 4.365 4.007 0.358 17893 244 1 1 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.213 -0.780 17893 245 1 1 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.472 -0.249 17893 246 1 1 . 1 1 51 51 TYR H H 51 8.169 8.169 8.549 -0.380 17893 247 1 1 . 1 1 52 52 TYR N N 52 118.548 118.548 116.535 2.013 17893 248 1 1 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.138 0.183 17893 249 1 1 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.759 1.210 17893 250 1 1 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.436 -0.958 17893 251 1 1 . 1 1 52 52 TYR H H 52 9.062 9.062 8.462 0.600 17893 252 1 1 . 1 1 53 53 LEU N N 53 115.380 115.380 116.496 -1.116 17893 253 1 1 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.118 0.419 17893 254 1 1 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.112 -1.968 17893 255 1 1 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.243 -2.147 17893 256 1 1 . 1 1 53 53 LEU H H 53 8.394 8.394 8.412 -0.018 17893 257 1 1 . 1 1 54 54 ASN N N 54 122.105 122.105 115.838 6.267 17893 258 1 1 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.306 0.150 17893 259 1 1 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.018 -0.227 17893 260 1 1 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.083 0.675 17893 261 1 1 . 1 1 54 54 ASN H H 54 8.091 8.091 7.992 0.099 17893 262 1 1 . 1 1 55 55 THR N N 55 114.964 114.964 115.541 -0.577 17893 263 1 1 . 1 1 55 55 THR HA H 55 4.947 4.947 4.707 0.240 17893 264 1 1 . 1 1 55 55 THR CA C 55 60.062 60.062 59.978 0.084 17893 265 1 1 . 1 1 55 55 THR CB C 55 74.945 74.945 71.302 3.643 17893 266 1 1 . 1 1 55 55 THR H H 55 8.248 8.248 8.254 -0.006 17893 267 1 1 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.554 0.056 17893 268 1 1 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.597 0.245 17893 269 1 1 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.514 -0.568 17893 270 1 1 . 1 1 57 57 LEU N N 57 127.597 127.597 125.153 2.444 17893 271 1 1 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.137 -0.066 17893 272 1 1 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.852 0.870 17893 273 1 1 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.123 -0.630 17893 274 1 1 . 1 1 57 57 LEU H H 57 9.958 9.958 8.631 1.327 17893 275 1 1 . 1 1 58 58 GLU N N 58 123.260 123.260 116.760 6.500 17893 276 1 1 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.357 0.529 17893 277 1 1 . 1 1 58 58 GLU CA C 58 58.517 58.517 58.927 -0.410 17893 278 1 1 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.191 -0.133 17893 279 1 1 . 1 1 58 58 GLU H H 58 9.353 9.353 8.587 0.766 17893 280 1 1 . 1 1 59 59 ASP N N 59 117.681 117.681 117.994 -0.313 17893 281 1 1 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.515 0.139 17893 282 1 1 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.241 -0.618 17893 283 1 1 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.943 -0.952 17893 284 1 1 . 1 1 59 59 ASP H H 59 8.012 8.012 7.749 0.263 17893 285 1 1 . 1 1 60 60 ILE N N 60 119.519 119.519 118.040 1.479 17893 286 1 1 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.667 -0.124 17893 287 1 1 . 1 1 60 60 ILE CA C 60 63.906 63.906 64.094 -0.188 17893 288 1 1 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.025 0.391 17893 289 1 1 . 1 1 60 60 ILE H H 60 8.210 8.210 7.281 0.929 17893 290 1 1 . 1 1 61 61 PHE N N 61 116.030 116.030 118.159 -2.129 17893 291 1 1 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.512 -0.066 17893 292 1 1 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.814 0.007 17893 293 1 1 . 1 1 61 61 PHE CB C 61 41.965 41.965 40.290 1.675 17893 294 1 1 . 1 1 61 61 PHE H H 61 8.530 8.530 8.806 -0.276 17893 295 1 1 . 1 1 62 62 GLN N N 62 116.829 116.829 121.831 -5.002 17893 296 1 1 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.884 0.173 17893 297 1 1 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.620 0.369 17893 298 1 1 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.526 0.302 17893 299 1 1 . 1 1 62 62 GLN H H 62 8.737 8.737 8.849 -0.112 17893 300 1 1 . 1 1 63 63 TRP N N 63 125.623 125.623 125.360 0.263 17893 301 1 1 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.163 0.044 17893 302 1 1 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.683 -0.152 17893 303 1 1 . 1 1 63 63 TRP CB C 63 30.704 30.704 31.116 -0.412 17893 304 1 1 . 1 1 63 63 TRP H H 63 9.464 9.464 8.756 0.708 17893 305 1 1 . 1 1 64 64 GLN N N 64 127.029 127.029 122.822 4.207 17893 306 1 1 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.023 0.175 17893 307 1 1 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.186 -0.684 17893 308 1 1 . 1 1 64 64 GLN CB C 64 30.673 30.673 30.856 -0.183 17893 309 1 1 . 1 1 64 64 GLN H H 64 7.977 7.977 8.523 -0.546 17893 310 1 1 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.536 0.144 17893 311 1 1 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.021 -1.366 17893 312 1 1 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.362 -0.862 17893 313 1 2 . 1 1 2 2 ILE N N 2 123.389 123.389 121.134 2.255 17893 314 1 2 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.164 -0.043 17893 315 1 2 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.357 0.816 17893 316 1 2 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.389 -0.257 17893 317 1 2 . 1 1 2 2 ILE H H 2 9.112 9.112 7.750 1.362 17893 318 1 2 . 1 1 3 3 ILE N N 3 108.863 108.863 128.522 -19.659 17893 319 1 2 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.197 0.236 17893 320 1 2 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.221 -0.068 17893 321 1 2 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.787 -1.132 17893 322 1 2 . 1 1 3 3 ILE H H 3 9.418 9.418 9.174 0.244 17893 323 1 2 . 1 1 4 4 ASN N N 4 123.919 123.919 125.906 -1.987 17893 324 1 2 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.406 1.226 17893 325 1 2 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.423 -1.045 17893 326 1 2 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.709 2.328 17893 327 1 2 . 1 1 4 4 ASN H H 4 9.056 9.056 8.881 0.175 17893 328 1 2 . 1 1 5 5 ASN N N 5 120.944 120.944 124.277 -3.333 17893 329 1 2 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.845 0.598 17893 330 1 2 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.802 -1.387 17893 331 1 2 . 1 1 5 5 ASN CB C 5 39.813 39.813 39.753 0.060 17893 332 1 2 . 1 1 5 5 ASN H H 5 9.383 9.383 8.697 0.686 17893 333 1 2 . 1 1 6 6 LEU N N 6 120.594 120.594 123.071 -2.477 17893 334 1 2 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.906 -0.139 17893 335 1 2 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.292 0.407 17893 336 1 2 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.632 -0.827 17893 337 1 2 . 1 1 6 6 LEU H H 6 8.531 8.531 9.144 -0.613 17893 338 1 2 . 1 1 7 7 LYS N N 7 118.212 118.212 118.085 0.127 17893 339 1 2 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.012 -0.079 17893 340 1 2 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.520 0.743 17893 341 1 2 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.758 0.545 17893 342 1 2 . 1 1 7 7 LYS H H 7 8.933 8.933 7.745 1.188 17893 343 1 2 . 1 1 8 8 LEU N N 8 116.414 116.414 120.827 -4.413 17893 344 1 2 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.239 -0.066 17893 345 1 2 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.474 -0.084 17893 346 1 2 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.928 0.100 17893 347 1 2 . 1 1 8 8 LEU H H 8 7.667 7.667 7.782 -0.115 17893 348 1 2 . 1 1 9 9 ILE N N 9 119.134 119.134 118.651 0.483 17893 349 1 2 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.557 0.257 17893 350 1 2 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.461 -2.605 17893 351 1 2 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.516 -1.054 17893 352 1 2 . 1 1 9 9 ILE H H 9 8.226 8.226 8.666 -0.440 17893 353 1 2 . 1 1 10 10 ARG N N 10 120.162 120.162 120.425 -0.263 17893 354 1 2 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.898 0.003 17893 355 1 2 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.116 0.611 17893 356 1 2 . 1 1 10 10 ARG CB C 10 28.499 28.499 29.989 -1.490 17893 357 1 2 . 1 1 10 10 ARG H H 10 9.260 9.260 8.167 1.093 17893 358 1 2 . 1 1 11 11 GLU N N 11 115.948 115.948 119.414 -3.466 17893 359 1 2 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.007 0.166 17893 360 1 2 . 1 1 11 11 GLU CA C 11 59.386 59.386 59.556 -0.170 17893 361 1 2 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.409 -0.495 17893 362 1 2 . 1 1 11 11 GLU H H 11 8.701 8.701 8.911 -0.210 17893 363 1 2 . 1 1 12 12 LYS N N 12 122.900 122.900 119.662 3.238 17893 364 1 2 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.001 0.221 17893 365 1 2 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.496 -0.080 17893 366 1 2 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.598 -0.600 17893 367 1 2 . 1 1 12 12 LYS H H 12 8.254 8.254 8.457 -0.204 17893 368 1 2 . 1 1 13 13 LYS N N 13 116.385 116.385 115.086 1.299 17893 369 1 2 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.295 0.002 17893 370 1 2 . 1 1 13 13 LYS CA C 13 55.031 55.031 56.086 -1.055 17893 371 1 2 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.636 -1.087 17893 372 1 2 . 1 1 13 13 LYS H H 13 7.809 7.809 7.794 0.015 17893 373 1 2 . 1 1 14 14 LYS N N 14 115.317 115.317 116.002 -0.685 17893 374 1 2 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.936 0.046 17893 375 1 2 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.807 0.081 17893 376 1 2 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.607 -1.321 17893 377 1 2 . 1 1 14 14 LYS H H 14 8.069 8.069 7.346 0.723 17893 378 1 2 . 1 1 15 15 ILE N N 15 118.431 118.431 119.656 -1.225 17893 379 1 2 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.098 0.525 17893 380 1 2 . 1 1 15 15 ILE CA C 15 59.199 59.199 60.399 -1.200 17893 381 1 2 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.765 2.131 17893 382 1 2 . 1 1 15 15 ILE H H 15 7.569 7.569 8.074 -0.505 17893 383 1 2 . 1 1 16 16 SER N N 16 125.034 125.034 123.234 1.800 17893 384 1 2 . 1 1 16 16 SER HA H 16 4.585 4.585 4.650 -0.065 17893 385 1 2 . 1 1 16 16 SER CA C 16 57.004 57.004 56.825 0.179 17893 386 1 2 . 1 1 16 16 SER CB C 16 64.914 64.914 64.430 0.484 17893 387 1 2 . 1 1 16 16 SER H H 16 9.440 9.440 9.721 -0.281 17893 388 1 2 . 1 1 17 17 GLN N N 17 120.228 120.228 121.336 -1.108 17893 389 1 2 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.038 -0.251 17893 390 1 2 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.444 2.072 17893 391 1 2 . 1 1 17 17 GLN CB C 17 29.051 29.051 27.778 1.273 17893 392 1 2 . 1 1 17 17 GLN H H 17 9.527 9.527 8.865 0.662 17893 393 1 2 . 1 1 18 18 SER N N 18 112.979 112.979 115.277 -2.298 17893 394 1 2 . 1 1 18 18 SER HA H 18 4.531 4.531 4.023 0.508 17893 395 1 2 . 1 1 18 18 SER CA C 18 62.872 62.872 62.036 0.836 17893 396 1 2 . 1 1 18 18 SER CB C 18 65.338 65.338 62.792 2.546 17893 397 1 2 . 1 1 18 18 SER H H 18 8.949 8.949 8.769 0.180 17893 398 1 2 . 1 1 19 19 GLU N N 19 124.147 124.147 121.666 2.481 17893 399 1 2 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.053 0.054 17893 400 1 2 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.544 0.069 17893 401 1 2 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.013 0.526 17893 402 1 2 . 1 1 19 19 GLU H H 19 8.331 8.331 8.042 0.289 17893 403 1 2 . 1 1 20 20 LEU N N 20 119.943 119.943 121.892 -1.949 17893 404 1 2 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.906 0.248 17893 405 1 2 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.630 -0.056 17893 406 1 2 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.422 -0.417 17893 407 1 2 . 1 1 20 20 LEU H H 20 8.314 8.314 7.548 0.766 17893 408 1 2 . 1 1 21 21 ALA N N 21 119.877 119.877 121.688 -1.811 17893 409 1 2 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.912 -0.188 17893 410 1 2 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.211 0.243 17893 411 1 2 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.083 -1.222 17893 412 1 2 . 1 1 21 21 ALA H H 21 8.588 8.588 8.746 -0.158 17893 413 1 2 . 1 1 22 22 ALA N N 22 117.330 117.330 121.663 -4.333 17893 414 1 2 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.994 0.270 17893 415 1 2 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.746 -0.137 17893 416 1 2 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.494 -0.838 17893 417 1 2 . 1 1 22 22 ALA H H 22 7.813 7.813 8.083 -0.270 17893 418 1 2 . 1 1 23 23 LEU N N 23 118.586 118.586 119.646 -1.060 17893 419 1 2 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.667 0.294 17893 420 1 2 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.334 -0.234 17893 421 1 2 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.270 0.154 17893 422 1 2 . 1 1 23 23 LEU H H 23 7.538 7.538 8.466 -0.928 17893 423 1 2 . 1 1 24 24 LEU N N 24 114.488 114.488 116.945 -2.457 17893 424 1 2 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.318 -0.054 17893 425 1 2 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.535 -0.741 17893 426 1 2 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.614 1.819 17893 427 1 2 . 1 1 24 24 LEU H H 24 7.449 7.449 8.220 -0.771 17893 428 1 2 . 1 1 25 25 GLU N N 25 114.895 114.895 114.953 -0.058 17893 429 1 2 . 1 1 25 25 GLU HA H 25 3.966 3.966 3.946 0.020 17893 430 1 2 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.566 -0.418 17893 431 1 2 . 1 1 25 25 GLU CB C 25 26.993 26.993 26.984 0.009 17893 432 1 2 . 1 1 25 25 GLU H H 25 8.029 8.029 7.815 0.214 17893 433 1 2 . 1 1 26 26 VAL N N 26 109.738 109.738 111.739 -2.001 17893 434 1 2 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.622 0.268 17893 435 1 2 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.520 -1.239 17893 436 1 2 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.042 0.253 17893 437 1 2 . 1 1 26 26 VAL H H 26 7.989 7.989 7.855 0.134 17893 438 1 2 . 1 1 27 27 SER N N 27 114.381 114.381 115.767 -1.386 17893 439 1 2 . 1 1 27 27 SER HA H 27 4.644 4.644 4.412 0.232 17893 440 1 2 . 1 1 27 27 SER CA C 27 56.445 56.445 58.273 -1.828 17893 441 1 2 . 1 1 27 27 SER CB C 27 62.251 62.251 64.002 -1.751 17893 442 1 2 . 1 1 27 27 SER H H 27 8.618 8.618 8.409 0.209 17893 443 1 2 . 1 1 28 28 ARG N N 28 115.323 115.323 123.577 -8.254 17893 444 1 2 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.949 -0.201 17893 445 1 2 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.266 -0.347 17893 446 1 2 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.853 -0.803 17893 447 1 2 . 1 1 28 28 ARG H H 28 8.242 8.242 9.000 -0.758 17893 448 1 2 . 1 1 29 29 GLN N N 29 117.343 117.343 115.734 1.609 17893 449 1 2 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.114 0.060 17893 450 1 2 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.285 -0.201 17893 451 1 2 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.387 0.181 17893 452 1 2 . 1 1 29 29 GLN H H 29 8.827 8.827 9.013 -0.186 17893 453 1 2 . 1 1 30 30 THR N N 30 119.996 119.996 117.230 2.766 17893 454 1 2 . 1 1 30 30 THR HA H 30 4.434 4.434 4.302 0.132 17893 455 1 2 . 1 1 30 30 THR CA C 30 67.621 67.621 65.524 2.097 17893 456 1 2 . 1 1 30 30 THR CB C 30 66.513 66.513 68.549 -2.036 17893 457 1 2 . 1 1 30 30 THR H H 30 8.132 8.132 7.595 0.537 17893 458 1 2 . 1 1 31 31 ILE N N 31 118.828 118.828 122.181 -3.353 17893 459 1 2 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.813 -0.027 17893 460 1 2 . 1 1 31 31 ILE CA C 31 61.029 61.029 62.916 -1.887 17893 461 1 2 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.926 -1.849 17893 462 1 2 . 1 1 31 31 ILE H H 31 7.163 7.163 7.481 -0.318 17893 463 1 2 . 1 1 32 32 ASN N N 32 118.098 118.098 119.029 -0.931 17893 464 1 2 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.595 -0.240 17893 465 1 2 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.374 0.880 17893 466 1 2 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.349 0.899 17893 467 1 2 . 1 1 32 32 ASN H H 32 8.656 8.656 8.935 -0.279 17893 468 1 2 . 1 1 33 33 GLY N N 33 124.952 124.952 108.411 16.541 17893 469 1 2 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.542 0.598 17893 470 1 2 . 1 1 33 33 GLY H H 33 8.643 8.643 8.590 0.053 17893 471 1 2 . 1 1 34 34 ILE N N 34 122.233 122.233 122.363 -0.130 17893 472 1 2 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.085 0.219 17893 473 1 2 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.315 0.489 17893 474 1 2 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.169 0.117 17893 475 1 2 . 1 1 34 34 ILE H H 34 8.203 8.203 7.110 1.093 17893 476 1 2 . 1 1 35 35 GLU N N 35 120.686 120.686 118.667 2.019 17893 477 1 2 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.078 0.136 17893 478 1 2 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.340 1.352 17893 479 1 2 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.479 -0.627 17893 480 1 2 . 1 1 35 35 GLU H H 35 8.575 8.575 8.099 0.476 17893 481 1 2 . 1 1 36 36 LYS N N 36 116.029 116.029 118.446 -2.417 17893 482 1 2 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.133 0.388 17893 483 1 2 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.252 -2.745 17893 484 1 2 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.189 -1.250 17893 485 1 2 . 1 1 36 36 LYS H H 36 8.107 8.107 8.182 -0.075 17893 486 1 2 . 1 1 37 37 ASN N N 37 114.692 114.692 108.320 6.372 17893 487 1 2 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.573 0.176 17893 488 1 2 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.752 1.036 17893 489 1 2 . 1 1 37 37 ASN CB C 37 36.949 36.949 37.367 -0.418 17893 490 1 2 . 1 1 37 37 ASN H H 37 8.240 8.240 8.035 0.205 17893 491 1 2 . 1 1 38 38 LYS N N 38 115.098 115.098 119.698 -4.600 17893 492 1 2 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.081 0.355 17893 493 1 2 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.890 -2.712 17893 494 1 2 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.063 0.173 17893 495 1 2 . 1 1 38 38 LYS H H 38 8.727 8.727 8.213 0.514 17893 496 1 2 . 1 1 39 39 TYR N N 39 117.011 117.011 111.695 5.316 17893 497 1 2 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.738 -0.109 17893 498 1 2 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.895 -0.336 17893 499 1 2 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.846 1.057 17893 500 1 2 . 1 1 39 39 TYR H H 39 7.087 7.087 7.160 -0.073 17893 501 1 2 . 1 1 40 40 ASN N N 40 123.595 123.595 119.442 4.153 17893 502 1 2 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.953 0.300 17893 503 1 2 . 1 1 40 40 ASN CA C 40 49.772 49.772 50.994 -1.222 17893 504 1 2 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.452 -0.976 17893 505 1 2 . 1 1 40 40 ASN H H 40 8.842 8.842 8.544 0.298 17893 506 1 2 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.580 -0.771 17893 507 1 2 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.575 -0.046 17893 508 1 2 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.238 -0.677 17893 509 1 2 . 1 1 42 42 SER N N 42 125.580 125.580 115.581 9.999 17893 510 1 2 . 1 1 42 42 SER HA H 42 4.581 4.581 4.261 0.320 17893 511 1 2 . 1 1 42 42 SER CA C 42 57.380 57.380 57.942 -0.562 17893 512 1 2 . 1 1 42 42 SER CB C 42 64.562 64.562 63.901 0.661 17893 513 1 2 . 1 1 42 42 SER H H 42 8.033 8.033 8.169 -0.136 17893 514 1 2 . 1 1 43 43 LEU N N 43 120.759 120.759 124.711 -3.952 17893 515 1 2 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.996 -0.082 17893 516 1 2 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.485 -0.140 17893 517 1 2 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.380 -0.525 17893 518 1 2 . 1 1 43 43 LEU H H 43 9.289 9.289 8.746 0.543 17893 519 1 2 . 1 1 44 44 GLN N N 44 115.948 115.948 118.777 -2.829 17893 520 1 2 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.110 -0.383 17893 521 1 2 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.067 1.069 17893 522 1 2 . 1 1 44 44 GLN CB C 44 28.250 28.250 27.898 0.352 17893 523 1 2 . 1 1 44 44 GLN H H 44 8.906 8.906 8.680 0.226 17893 524 1 2 . 1 1 45 45 LEU N N 45 119.419 119.419 120.087 -0.668 17893 525 1 2 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.019 -0.094 17893 526 1 2 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.458 -2.854 17893 527 1 2 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.357 -0.730 17893 528 1 2 . 1 1 45 45 LEU H H 45 8.078 8.078 7.969 0.109 17893 529 1 2 . 1 1 46 46 ALA N N 46 120.544 120.544 122.406 -1.862 17893 530 1 2 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.978 0.070 17893 531 1 2 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.320 0.424 17893 532 1 2 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.998 1.735 17893 533 1 2 . 1 1 46 46 ALA H H 46 8.518 8.518 8.851 -0.333 17893 534 1 2 . 1 1 47 47 LEU N N 47 116.461 116.461 118.779 -2.318 17893 535 1 2 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.849 0.366 17893 536 1 2 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.121 -0.620 17893 537 1 2 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.572 -0.486 17893 538 1 2 . 1 1 47 47 LEU H H 47 8.676 8.676 8.220 0.456 17893 539 1 2 . 1 1 48 48 LYS N N 48 120.958 120.958 120.088 0.870 17893 540 1 2 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.928 -0.328 17893 541 1 2 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.906 0.023 17893 542 1 2 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.412 -0.144 17893 543 1 2 . 1 1 48 48 LYS H H 48 8.036 8.036 7.877 0.159 17893 544 1 2 . 1 1 49 49 ILE N N 49 120.407 120.407 120.540 -0.133 17893 545 1 2 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.849 -0.250 17893 546 1 2 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.795 1.407 17893 547 1 2 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.906 -0.253 17893 548 1 2 . 1 1 49 49 ILE H H 49 8.779 8.779 8.523 0.256 17893 549 1 2 . 1 1 50 50 ALA N N 50 120.480 120.480 123.939 -3.459 17893 550 1 2 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.148 -0.069 17893 551 1 2 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.240 0.383 17893 552 1 2 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.345 -0.340 17893 553 1 2 . 1 1 50 50 ALA H H 50 8.173 8.173 8.559 -0.386 17893 554 1 2 . 1 1 51 51 TYR N N 51 117.118 117.118 120.042 -2.924 17893 555 1 2 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.990 0.375 17893 556 1 2 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.135 -0.702 17893 557 1 2 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.424 -0.201 17893 558 1 2 . 1 1 51 51 TYR H H 51 8.169 8.169 8.339 -0.171 17893 559 1 2 . 1 1 52 52 TYR N N 52 118.548 118.548 116.712 1.836 17893 560 1 2 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.186 0.135 17893 561 1 2 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.542 1.427 17893 562 1 2 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.297 -0.819 17893 563 1 2 . 1 1 52 52 TYR H H 52 9.062 9.062 8.119 0.943 17893 564 1 2 . 1 1 53 53 LEU N N 53 115.380 115.380 116.685 -1.305 17893 565 1 2 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.063 0.474 17893 566 1 2 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.481 -2.337 17893 567 1 2 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.154 -2.058 17893 568 1 2 . 1 1 53 53 LEU H H 53 8.394 8.394 8.718 -0.324 17893 569 1 2 . 1 1 54 54 ASN N N 54 122.105 122.105 113.726 8.379 17893 570 1 2 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.357 0.099 17893 571 1 2 . 1 1 54 54 ASN CA C 54 53.791 53.791 53.519 0.272 17893 572 1 2 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.756 0.002 17893 573 1 2 . 1 1 54 54 ASN H H 54 8.091 8.091 8.207 -0.116 17893 574 1 2 . 1 1 55 55 THR N N 55 114.964 114.964 115.027 -0.063 17893 575 1 2 . 1 1 55 55 THR HA H 55 4.947 4.947 4.803 0.144 17893 576 1 2 . 1 1 55 55 THR CA C 55 60.062 60.062 60.216 -0.154 17893 577 1 2 . 1 1 55 55 THR CB C 55 74.945 74.945 70.844 4.101 17893 578 1 2 . 1 1 55 55 THR H H 55 8.248 8.248 7.918 0.330 17893 579 1 2 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.634 -0.024 17893 580 1 2 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.664 0.178 17893 581 1 2 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.941 -0.995 17893 582 1 2 . 1 1 57 57 LEU N N 57 127.597 127.597 124.724 2.873 17893 583 1 2 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.086 -0.015 17893 584 1 2 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.825 0.897 17893 585 1 2 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.090 -0.597 17893 586 1 2 . 1 1 57 57 LEU H H 57 9.958 9.958 8.614 1.344 17893 587 1 2 . 1 1 58 58 GLU N N 58 123.260 123.260 118.909 4.351 17893 588 1 2 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.318 0.568 17893 589 1 2 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.089 -0.572 17893 590 1 2 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.081 -0.023 17893 591 1 2 . 1 1 58 58 GLU H H 58 9.353 9.353 8.820 0.533 17893 592 1 2 . 1 1 59 59 ASP N N 59 117.681 117.681 118.709 -1.028 17893 593 1 2 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.455 0.199 17893 594 1 2 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.696 -1.073 17893 595 1 2 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.973 -0.982 17893 596 1 2 . 1 1 59 59 ASP H H 59 8.012 8.012 7.820 0.192 17893 597 1 2 . 1 1 60 60 ILE N N 60 119.519 119.519 116.021 3.498 17893 598 1 2 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.898 -0.355 17893 599 1 2 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.596 0.310 17893 600 1 2 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.989 0.427 17893 601 1 2 . 1 1 60 60 ILE H H 60 8.210 8.210 7.139 1.071 17893 602 1 2 . 1 1 61 61 PHE N N 61 116.030 116.030 118.111 -2.081 17893 603 1 2 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.606 -0.160 17893 604 1 2 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.924 -0.103 17893 605 1 2 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.558 0.407 17893 606 1 2 . 1 1 61 61 PHE H H 61 8.530 8.530 8.677 -0.147 17893 607 1 2 . 1 1 62 62 GLN N N 62 116.829 116.829 120.684 -3.855 17893 608 1 2 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.915 0.142 17893 609 1 2 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.702 0.287 17893 610 1 2 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.257 -0.429 17893 611 1 2 . 1 1 62 62 GLN H H 62 8.737 8.737 8.773 -0.036 17893 612 1 2 . 1 1 63 63 TRP N N 63 125.623 125.623 125.741 -0.118 17893 613 1 2 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.440 -0.233 17893 614 1 2 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.463 0.068 17893 615 1 2 . 1 1 63 63 TRP CB C 63 30.704 30.704 31.147 -0.443 17893 616 1 2 . 1 1 63 63 TRP H H 63 9.464 9.464 8.802 0.662 17893 617 1 2 . 1 1 64 64 GLN N N 64 127.029 127.029 122.707 4.322 17893 618 1 2 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.033 0.165 17893 619 1 2 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.210 -0.708 17893 620 1 2 . 1 1 64 64 GLN CB C 64 30.673 30.673 30.020 0.653 17893 621 1 2 . 1 1 64 64 GLN H H 64 7.977 7.977 8.783 -0.806 17893 622 1 2 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.393 0.287 17893 623 1 2 . 1 1 65 65 PRO CA C 65 61.655 61.655 64.970 -3.315 17893 624 1 2 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.341 -0.841 17893 625 1 3 . 1 1 2 2 ILE N N 2 123.389 123.389 120.958 2.431 17893 626 1 3 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.072 0.049 17893 627 1 3 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.625 0.548 17893 628 1 3 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.754 0.378 17893 629 1 3 . 1 1 2 2 ILE H H 2 9.112 9.112 7.887 1.225 17893 630 1 3 . 1 1 3 3 ILE N N 3 108.863 108.863 129.148 -20.285 17893 631 1 3 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.177 0.256 17893 632 1 3 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.534 -0.380 17893 633 1 3 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.572 -0.917 17893 634 1 3 . 1 1 3 3 ILE H H 3 9.418 9.418 9.127 0.291 17893 635 1 3 . 1 1 4 4 ASN N N 4 123.919 123.919 126.093 -2.174 17893 636 1 3 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.699 0.933 17893 637 1 3 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.260 -0.882 17893 638 1 3 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.163 1.874 17893 639 1 3 . 1 1 4 4 ASN H H 4 9.056 9.056 8.862 0.194 17893 640 1 3 . 1 1 5 5 ASN N N 5 120.944 120.944 125.386 -4.442 17893 641 1 3 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.780 0.663 17893 642 1 3 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.889 -1.474 17893 643 1 3 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.274 1.539 17893 644 1 3 . 1 1 5 5 ASN H H 5 9.383 9.383 9.060 0.323 17893 645 1 3 . 1 1 6 6 LEU N N 6 120.594 120.594 123.258 -2.664 17893 646 1 3 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.892 -0.125 17893 647 1 3 . 1 1 6 6 LEU CA C 6 59.699 59.699 58.910 0.789 17893 648 1 3 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.709 -0.904 17893 649 1 3 . 1 1 6 6 LEU H H 6 8.531 8.531 9.164 -0.633 17893 650 1 3 . 1 1 7 7 LYS N N 7 118.212 118.212 118.109 0.103 17893 651 1 3 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.990 -0.057 17893 652 1 3 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.227 1.036 17893 653 1 3 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.462 0.841 17893 654 1 3 . 1 1 7 7 LYS H H 7 8.933 8.933 7.745 1.188 17893 655 1 3 . 1 1 8 8 LEU N N 8 116.414 116.414 120.671 -4.257 17893 656 1 3 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.076 0.097 17893 657 1 3 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.232 0.158 17893 658 1 3 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.993 0.035 17893 659 1 3 . 1 1 8 8 LEU H H 8 7.667 7.667 7.397 0.270 17893 660 1 3 . 1 1 9 9 ILE N N 9 119.134 119.134 119.071 0.063 17893 661 1 3 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.549 0.265 17893 662 1 3 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.424 -2.568 17893 663 1 3 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.578 -1.116 17893 664 1 3 . 1 1 9 9 ILE H H 9 8.226 8.226 8.731 -0.505 17893 665 1 3 . 1 1 10 10 ARG N N 10 120.162 120.162 119.720 0.442 17893 666 1 3 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.815 0.086 17893 667 1 3 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.161 0.566 17893 668 1 3 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.163 -1.664 17893 669 1 3 . 1 1 10 10 ARG H H 10 9.260 9.260 8.773 0.487 17893 670 1 3 . 1 1 11 11 GLU N N 11 115.948 115.948 117.785 -1.837 17893 671 1 3 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.161 0.012 17893 672 1 3 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.839 0.547 17893 673 1 3 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.044 -0.130 17893 674 1 3 . 1 1 11 11 GLU H H 11 8.701 8.701 7.846 0.855 17893 675 1 3 . 1 1 12 12 LYS N N 12 122.900 122.900 119.768 3.132 17893 676 1 3 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.035 0.187 17893 677 1 3 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.061 0.355 17893 678 1 3 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.594 -0.596 17893 679 1 3 . 1 1 12 12 LYS H H 12 8.254 8.254 7.962 0.292 17893 680 1 3 . 1 1 13 13 LYS N N 13 116.385 116.385 114.365 2.020 17893 681 1 3 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.407 -0.110 17893 682 1 3 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.403 -0.372 17893 683 1 3 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.705 -1.156 17893 684 1 3 . 1 1 13 13 LYS H H 13 7.809 7.809 7.625 0.184 17893 685 1 3 . 1 1 14 14 LYS N N 14 115.317 115.317 116.316 -0.999 17893 686 1 3 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.935 0.047 17893 687 1 3 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.740 0.148 17893 688 1 3 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.440 -1.154 17893 689 1 3 . 1 1 14 14 LYS H H 14 8.069 8.069 8.029 0.040 17893 690 1 3 . 1 1 15 15 ILE N N 15 118.431 118.431 120.626 -2.195 17893 691 1 3 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.119 0.504 17893 692 1 3 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.843 -0.644 17893 693 1 3 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.865 2.031 17893 694 1 3 . 1 1 15 15 ILE H H 15 7.569 7.569 8.809 -1.240 17893 695 1 3 . 1 1 16 16 SER N N 16 125.034 125.034 120.184 4.850 17893 696 1 3 . 1 1 16 16 SER HA H 16 4.585 4.585 4.655 -0.070 17893 697 1 3 . 1 1 16 16 SER CA C 16 57.004 57.004 56.692 0.312 17893 698 1 3 . 1 1 16 16 SER CB C 16 64.914 64.914 65.121 -0.207 17893 699 1 3 . 1 1 16 16 SER H H 16 9.440 9.440 8.452 0.988 17893 700 1 3 . 1 1 17 17 GLN N N 17 120.228 120.228 123.944 -3.716 17893 701 1 3 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.065 -0.278 17893 702 1 3 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.995 1.521 17893 703 1 3 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.829 0.222 17893 704 1 3 . 1 1 17 17 GLN H H 17 9.527 9.527 8.927 0.600 17893 705 1 3 . 1 1 18 18 SER N N 18 112.979 112.979 114.122 -1.143 17893 706 1 3 . 1 1 18 18 SER HA H 18 4.531 4.531 4.108 0.423 17893 707 1 3 . 1 1 18 18 SER CA C 18 62.872 62.872 62.309 0.563 17893 708 1 3 . 1 1 18 18 SER CB C 18 65.338 65.338 62.268 3.070 17893 709 1 3 . 1 1 18 18 SER H H 18 8.949 8.949 8.343 0.606 17893 710 1 3 . 1 1 19 19 GLU N N 19 124.147 124.147 122.649 1.498 17893 711 1 3 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.057 0.050 17893 712 1 3 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.352 0.261 17893 713 1 3 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.636 0.903 17893 714 1 3 . 1 1 19 19 GLU H H 19 8.331 8.331 8.062 0.269 17893 715 1 3 . 1 1 20 20 LEU N N 20 119.943 119.943 122.013 -2.070 17893 716 1 3 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.999 0.155 17893 717 1 3 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.678 -0.104 17893 718 1 3 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.365 -0.360 17893 719 1 3 . 1 1 20 20 LEU H H 20 8.314 8.314 7.895 0.419 17893 720 1 3 . 1 1 21 21 ALA N N 21 119.877 119.877 122.058 -2.181 17893 721 1 3 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.918 -0.194 17893 722 1 3 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.291 0.163 17893 723 1 3 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.029 -1.168 17893 724 1 3 . 1 1 21 21 ALA H H 21 8.588 8.588 8.823 -0.235 17893 725 1 3 . 1 1 22 22 ALA N N 22 117.330 117.330 121.942 -4.612 17893 726 1 3 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.971 0.293 17893 727 1 3 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.811 -0.202 17893 728 1 3 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.520 -0.864 17893 729 1 3 . 1 1 22 22 ALA H H 22 7.813 7.813 8.333 -0.520 17893 730 1 3 . 1 1 23 23 LEU N N 23 118.586 118.586 118.330 0.256 17893 731 1 3 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.557 0.404 17893 732 1 3 . 1 1 23 23 LEU CA C 23 57.100 57.100 56.989 0.111 17893 733 1 3 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.667 -0.243 17893 734 1 3 . 1 1 23 23 LEU H H 23 7.538 7.538 8.198 -0.660 17893 735 1 3 . 1 1 24 24 LEU N N 24 114.488 114.488 114.591 -0.103 17893 736 1 3 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.214 0.050 17893 737 1 3 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.008 -0.214 17893 738 1 3 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.699 1.734 17893 739 1 3 . 1 1 24 24 LEU H H 24 7.449 7.449 7.896 -0.447 17893 740 1 3 . 1 1 25 25 GLU N N 25 114.895 114.895 115.239 -0.344 17893 741 1 3 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.059 -0.093 17893 742 1 3 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.144 0.004 17893 743 1 3 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.353 -0.360 17893 744 1 3 . 1 1 25 25 GLU H H 25 8.029 8.029 7.475 0.554 17893 745 1 3 . 1 1 26 26 VAL N N 26 109.738 109.738 112.488 -2.750 17893 746 1 3 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.633 0.257 17893 747 1 3 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.395 -1.114 17893 748 1 3 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.416 -0.121 17893 749 1 3 . 1 1 26 26 VAL H H 26 7.989 7.989 8.085 -0.096 17893 750 1 3 . 1 1 27 27 SER N N 27 114.381 114.381 116.176 -1.795 17893 751 1 3 . 1 1 27 27 SER HA H 27 4.644 4.644 4.528 0.116 17893 752 1 3 . 1 1 27 27 SER CA C 27 56.445 56.445 58.058 -1.613 17893 753 1 3 . 1 1 27 27 SER CB C 27 62.251 62.251 64.650 -2.399 17893 754 1 3 . 1 1 27 27 SER H H 27 8.618 8.618 8.596 0.022 17893 755 1 3 . 1 1 28 28 ARG N N 28 115.323 115.323 121.988 -6.665 17893 756 1 3 . 1 1 28 28 ARG HA H 28 3.748 3.748 4.008 -0.260 17893 757 1 3 . 1 1 28 28 ARG CA C 28 59.919 59.919 59.948 -0.029 17893 758 1 3 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.992 -0.942 17893 759 1 3 . 1 1 28 28 ARG H H 28 8.242 8.242 8.914 -0.672 17893 760 1 3 . 1 1 29 29 GLN N N 29 117.343 117.343 116.342 1.001 17893 761 1 3 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.069 0.105 17893 762 1 3 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.933 0.152 17893 763 1 3 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.750 -0.182 17893 764 1 3 . 1 1 29 29 GLN H H 29 8.827 8.827 8.825 0.002 17893 765 1 3 . 1 1 30 30 THR N N 30 119.996 119.996 117.190 2.806 17893 766 1 3 . 1 1 30 30 THR HA H 30 4.434 4.434 4.328 0.106 17893 767 1 3 . 1 1 30 30 THR CA C 30 67.621 67.621 66.057 1.564 17893 768 1 3 . 1 1 30 30 THR CB C 30 66.513 66.513 68.553 -2.040 17893 769 1 3 . 1 1 30 30 THR H H 30 8.132 8.132 7.767 0.365 17893 770 1 3 . 1 1 31 31 ILE N N 31 118.828 118.828 122.036 -3.208 17893 771 1 3 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.854 -0.068 17893 772 1 3 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.678 -2.649 17893 773 1 3 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.726 -1.649 17893 774 1 3 . 1 1 31 31 ILE H H 31 7.163 7.163 7.359 -0.196 17893 775 1 3 . 1 1 32 32 ASN N N 32 118.098 118.098 118.967 -0.869 17893 776 1 3 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.381 -0.026 17893 777 1 3 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.015 0.239 17893 778 1 3 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.417 0.831 17893 779 1 3 . 1 1 32 32 ASN H H 32 8.656 8.656 8.547 0.109 17893 780 1 3 . 1 1 33 33 GLY N N 33 124.952 124.952 108.755 16.197 17893 781 1 3 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.804 0.336 17893 782 1 3 . 1 1 33 33 GLY H H 33 8.643 8.643 8.663 -0.020 17893 783 1 3 . 1 1 34 34 ILE N N 34 122.233 122.233 122.525 -0.292 17893 784 1 3 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.083 0.221 17893 785 1 3 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.511 0.293 17893 786 1 3 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.179 0.107 17893 787 1 3 . 1 1 34 34 ILE H H 34 8.203 8.203 7.429 0.774 17893 788 1 3 . 1 1 35 35 GLU N N 35 120.686 120.686 118.430 2.256 17893 789 1 3 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.055 0.159 17893 790 1 3 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.851 0.841 17893 791 1 3 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.434 -0.582 17893 792 1 3 . 1 1 35 35 GLU H H 35 8.575 8.575 8.086 0.489 17893 793 1 3 . 1 1 36 36 LYS N N 36 116.029 116.029 118.157 -2.128 17893 794 1 3 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.091 0.430 17893 795 1 3 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.160 -2.653 17893 796 1 3 . 1 1 36 36 LYS CB C 36 31.939 31.939 32.967 -1.028 17893 797 1 3 . 1 1 36 36 LYS H H 36 8.107 8.107 8.152 -0.045 17893 798 1 3 . 1 1 37 37 ASN N N 37 114.692 114.692 109.118 5.574 17893 799 1 3 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.513 0.236 17893 800 1 3 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.718 1.070 17893 801 1 3 . 1 1 37 37 ASN CB C 37 36.949 36.949 36.851 0.098 17893 802 1 3 . 1 1 37 37 ASN H H 37 8.240 8.240 8.269 -0.029 17893 803 1 3 . 1 1 38 38 LYS N N 38 115.098 115.098 120.576 -5.478 17893 804 1 3 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.011 0.425 17893 805 1 3 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.624 -2.446 17893 806 1 3 . 1 1 38 38 LYS CB C 38 33.236 33.236 32.992 0.244 17893 807 1 3 . 1 1 38 38 LYS H H 38 8.727 8.727 8.233 0.494 17893 808 1 3 . 1 1 39 39 TYR N N 39 117.011 117.011 111.926 5.085 17893 809 1 3 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.707 -0.078 17893 810 1 3 . 1 1 39 39 TYR CA C 39 55.559 55.559 54.947 0.612 17893 811 1 3 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.901 1.002 17893 812 1 3 . 1 1 39 39 TYR H H 39 7.087 7.087 7.161 -0.074 17893 813 1 3 . 1 1 40 40 ASN N N 40 123.595 123.595 120.710 2.885 17893 814 1 3 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.843 0.410 17893 815 1 3 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.611 -1.839 17893 816 1 3 . 1 1 40 40 ASN CB C 40 38.476 38.476 38.368 0.108 17893 817 1 3 . 1 1 40 40 ASN H H 40 8.842 8.842 8.532 0.310 17893 818 1 3 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.446 -0.637 17893 819 1 3 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.809 -0.280 17893 820 1 3 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.248 -0.687 17893 821 1 3 . 1 1 42 42 SER N N 42 125.580 125.580 116.178 9.402 17893 822 1 3 . 1 1 42 42 SER HA H 42 4.581 4.581 4.247 0.334 17893 823 1 3 . 1 1 42 42 SER CA C 42 57.380 57.380 57.927 -0.547 17893 824 1 3 . 1 1 42 42 SER CB C 42 64.562 64.562 63.957 0.605 17893 825 1 3 . 1 1 42 42 SER H H 42 8.033 8.033 8.154 -0.121 17893 826 1 3 . 1 1 43 43 LEU N N 43 120.759 120.759 124.819 -4.060 17893 827 1 3 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.995 -0.081 17893 828 1 3 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.546 -0.201 17893 829 1 3 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.355 -0.499 17893 830 1 3 . 1 1 43 43 LEU H H 43 9.289 9.289 8.754 0.535 17893 831 1 3 . 1 1 44 44 GLN N N 44 115.948 115.948 118.946 -2.998 17893 832 1 3 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.114 -0.387 17893 833 1 3 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.142 0.995 17893 834 1 3 . 1 1 44 44 GLN CB C 44 28.250 28.250 27.916 0.334 17893 835 1 3 . 1 1 44 44 GLN H H 44 8.906 8.906 8.669 0.237 17893 836 1 3 . 1 1 45 45 LEU N N 45 119.419 119.419 120.157 -0.738 17893 837 1 3 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.987 -0.062 17893 838 1 3 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.622 -3.018 17893 839 1 3 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.361 -0.734 17893 840 1 3 . 1 1 45 45 LEU H H 45 8.078 8.078 8.020 0.058 17893 841 1 3 . 1 1 46 46 ALA N N 46 120.544 120.544 122.372 -1.828 17893 842 1 3 . 1 1 46 46 ALA HA H 46 4.048 4.048 4.026 0.022 17893 843 1 3 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.364 0.380 17893 844 1 3 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.018 1.715 17893 845 1 3 . 1 1 46 46 ALA H H 46 8.518 8.518 8.950 -0.432 17893 846 1 3 . 1 1 47 47 LEU N N 47 116.461 116.461 119.104 -2.643 17893 847 1 3 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.871 0.344 17893 848 1 3 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.215 -0.715 17893 849 1 3 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.596 -0.510 17893 850 1 3 . 1 1 47 47 LEU H H 47 8.676 8.676 8.485 0.191 17893 851 1 3 . 1 1 48 48 LYS N N 48 120.958 120.958 119.860 1.098 17893 852 1 3 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.056 -0.456 17893 853 1 3 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.218 -0.289 17893 854 1 3 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.456 -0.188 17893 855 1 3 . 1 1 48 48 LYS H H 48 8.036 8.036 8.443 -0.407 17893 856 1 3 . 1 1 49 49 ILE N N 49 120.407 120.407 120.601 -0.194 17893 857 1 3 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.817 -0.218 17893 858 1 3 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.805 1.397 17893 859 1 3 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.948 -0.295 17893 860 1 3 . 1 1 49 49 ILE H H 49 8.779 8.779 8.566 0.213 17893 861 1 3 . 1 1 50 50 ALA N N 50 120.480 120.480 123.682 -3.202 17893 862 1 3 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.127 -0.048 17893 863 1 3 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.156 0.467 17893 864 1 3 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.484 -0.479 17893 865 1 3 . 1 1 50 50 ALA H H 50 8.173 8.173 8.730 -0.557 17893 866 1 3 . 1 1 51 51 TYR N N 51 117.118 117.118 120.430 -3.312 17893 867 1 3 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.977 0.388 17893 868 1 3 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.227 -0.794 17893 869 1 3 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.465 -0.242 17893 870 1 3 . 1 1 51 51 TYR H H 51 8.169 8.169 8.697 -0.528 17893 871 1 3 . 1 1 52 52 TYR N N 52 118.548 118.548 116.060 2.488 17893 872 1 3 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.195 0.126 17893 873 1 3 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.797 1.171 17893 874 1 3 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.587 -1.109 17893 875 1 3 . 1 1 52 52 TYR H H 52 9.062 9.062 8.366 0.696 17893 876 1 3 . 1 1 53 53 LEU N N 53 115.380 115.380 117.022 -1.642 17893 877 1 3 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.058 0.479 17893 878 1 3 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.837 -2.693 17893 879 1 3 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.379 -2.283 17893 880 1 3 . 1 1 53 53 LEU H H 53 8.394 8.394 8.709 -0.315 17893 881 1 3 . 1 1 54 54 ASN N N 54 122.105 122.105 114.965 7.140 17893 882 1 3 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.331 0.125 17893 883 1 3 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.133 -0.341 17893 884 1 3 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.228 0.530 17893 885 1 3 . 1 1 54 54 ASN H H 54 8.091 8.091 8.274 -0.183 17893 886 1 3 . 1 1 55 55 THR N N 55 114.964 114.964 114.751 0.213 17893 887 1 3 . 1 1 55 55 THR HA H 55 4.947 4.947 4.631 0.316 17893 888 1 3 . 1 1 55 55 THR CA C 55 60.062 60.062 60.930 -0.868 17893 889 1 3 . 1 1 55 55 THR CB C 55 74.945 74.945 71.952 2.993 17893 890 1 3 . 1 1 55 55 THR H H 55 8.248 8.248 7.616 0.632 17893 891 1 3 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.573 0.037 17893 892 1 3 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.599 0.243 17893 893 1 3 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.606 -0.660 17893 894 1 3 . 1 1 57 57 LEU N N 57 127.597 127.597 125.341 2.256 17893 895 1 3 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.052 0.019 17893 896 1 3 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.869 0.853 17893 897 1 3 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.089 -0.596 17893 898 1 3 . 1 1 57 57 LEU H H 57 9.958 9.958 8.664 1.294 17893 899 1 3 . 1 1 58 58 GLU N N 58 123.260 123.260 118.378 4.882 17893 900 1 3 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.244 0.642 17893 901 1 3 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.179 -0.662 17893 902 1 3 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.153 -0.095 17893 903 1 3 . 1 1 58 58 GLU H H 58 9.353 9.353 8.683 0.670 17893 904 1 3 . 1 1 59 59 ASP N N 59 117.681 117.681 117.831 -0.150 17893 905 1 3 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.494 0.160 17893 906 1 3 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.382 -0.759 17893 907 1 3 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.160 -1.169 17893 908 1 3 . 1 1 59 59 ASP H H 59 8.012 8.012 7.776 0.236 17893 909 1 3 . 1 1 60 60 ILE N N 60 119.519 119.519 117.457 2.062 17893 910 1 3 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.735 -0.192 17893 911 1 3 . 1 1 60 60 ILE CA C 60 63.906 63.906 64.128 -0.222 17893 912 1 3 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.184 0.232 17893 913 1 3 . 1 1 60 60 ILE H H 60 8.210 8.210 7.335 0.875 17893 914 1 3 . 1 1 61 61 PHE N N 61 116.030 116.030 117.647 -1.617 17893 915 1 3 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.735 -0.289 17893 916 1 3 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.665 0.156 17893 917 1 3 . 1 1 61 61 PHE CB C 61 41.965 41.965 42.042 -0.077 17893 918 1 3 . 1 1 61 61 PHE H H 61 8.530 8.530 8.699 -0.169 17893 919 1 3 . 1 1 62 62 GLN N N 62 116.829 116.829 119.718 -2.889 17893 920 1 3 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.905 0.152 17893 921 1 3 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.706 0.282 17893 922 1 3 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.110 -0.282 17893 923 1 3 . 1 1 62 62 GLN H H 62 8.737 8.737 8.948 -0.211 17893 924 1 3 . 1 1 63 63 TRP N N 63 125.623 125.623 126.124 -0.501 17893 925 1 3 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.317 -0.110 17893 926 1 3 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.810 -0.279 17893 927 1 3 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.721 -0.017 17893 928 1 3 . 1 1 63 63 TRP H H 63 9.464 9.464 8.786 0.678 17893 929 1 3 . 1 1 64 64 GLN N N 64 127.029 127.029 124.923 2.106 17893 930 1 3 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.131 0.067 17893 931 1 3 . 1 1 64 64 GLN CA C 64 51.502 51.502 51.888 -0.386 17893 932 1 3 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.478 1.195 17893 933 1 3 . 1 1 64 64 GLN H H 64 7.977 7.977 8.974 -0.997 17893 934 1 3 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.677 0.003 17893 935 1 3 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.355 -1.700 17893 936 1 3 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.182 -0.682 17893 937 1 4 . 1 1 2 2 ILE N N 2 123.389 123.389 120.786 2.603 17893 938 1 4 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.854 0.267 17893 939 1 4 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.084 1.089 17893 940 1 4 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.195 -0.063 17893 941 1 4 . 1 1 2 2 ILE H H 2 9.112 9.112 7.592 1.520 17893 942 1 4 . 1 1 3 3 ILE N N 3 108.863 108.863 128.662 -19.799 17893 943 1 4 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.231 0.202 17893 944 1 4 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.090 0.064 17893 945 1 4 . 1 1 3 3 ILE CB C 3 38.655 38.655 40.177 -1.522 17893 946 1 4 . 1 1 3 3 ILE H H 3 9.418 9.418 8.993 0.425 17893 947 1 4 . 1 1 4 4 ASN N N 4 123.919 123.919 126.029 -2.110 17893 948 1 4 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.699 0.933 17893 949 1 4 . 1 1 4 4 ASN CA C 4 51.378 51.378 51.877 -0.499 17893 950 1 4 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.847 2.190 17893 951 1 4 . 1 1 4 4 ASN H H 4 9.056 9.056 8.887 0.169 17893 952 1 4 . 1 1 5 5 ASN N N 5 120.944 120.944 125.655 -4.711 17893 953 1 4 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.732 0.711 17893 954 1 4 . 1 1 5 5 ASN CA C 5 51.415 51.415 53.052 -1.637 17893 955 1 4 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.066 1.747 17893 956 1 4 . 1 1 5 5 ASN H H 5 9.383 9.383 9.169 0.214 17893 957 1 4 . 1 1 6 6 LEU N N 6 120.594 120.594 122.937 -2.343 17893 958 1 4 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.880 -0.113 17893 959 1 4 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.131 0.568 17893 960 1 4 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.636 -0.831 17893 961 1 4 . 1 1 6 6 LEU H H 6 8.531 8.531 9.098 -0.567 17893 962 1 4 . 1 1 7 7 LYS N N 7 118.212 118.212 117.809 0.403 17893 963 1 4 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.985 -0.052 17893 964 1 4 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.257 1.006 17893 965 1 4 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.464 0.839 17893 966 1 4 . 1 1 7 7 LYS H H 7 8.933 8.933 7.793 1.140 17893 967 1 4 . 1 1 8 8 LEU N N 8 116.414 116.414 120.513 -4.099 17893 968 1 4 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.066 0.107 17893 969 1 4 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.297 0.093 17893 970 1 4 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.993 0.035 17893 971 1 4 . 1 1 8 8 LEU H H 8 7.667 7.667 7.478 0.189 17893 972 1 4 . 1 1 9 9 ILE N N 9 119.134 119.134 118.786 0.348 17893 973 1 4 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.551 0.263 17893 974 1 4 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.366 -2.510 17893 975 1 4 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.608 -1.146 17893 976 1 4 . 1 1 9 9 ILE H H 9 8.226 8.226 8.734 -0.508 17893 977 1 4 . 1 1 10 10 ARG N N 10 120.162 120.162 119.906 0.256 17893 978 1 4 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.901 0.000 17893 979 1 4 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.200 0.527 17893 980 1 4 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.084 -1.585 17893 981 1 4 . 1 1 10 10 ARG H H 10 9.260 9.260 8.628 0.632 17893 982 1 4 . 1 1 11 11 GLU N N 11 115.948 115.948 117.842 -1.894 17893 983 1 4 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.091 0.082 17893 984 1 4 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.966 0.420 17893 985 1 4 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.308 -0.394 17893 986 1 4 . 1 1 11 11 GLU H H 11 8.701 8.701 7.785 0.916 17893 987 1 4 . 1 1 12 12 LYS N N 12 122.900 122.900 120.191 2.709 17893 988 1 4 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.019 0.203 17893 989 1 4 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.183 0.233 17893 990 1 4 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.528 -0.530 17893 991 1 4 . 1 1 12 12 LYS H H 12 8.254 8.254 7.694 0.560 17893 992 1 4 . 1 1 13 13 LYS N N 13 116.385 116.385 114.261 2.124 17893 993 1 4 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.319 -0.022 17893 994 1 4 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.605 -0.574 17893 995 1 4 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.600 -1.051 17893 996 1 4 . 1 1 13 13 LYS H H 13 7.809 7.809 7.582 0.227 17893 997 1 4 . 1 1 14 14 LYS N N 14 115.317 115.317 117.558 -2.241 17893 998 1 4 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.933 0.049 17893 999 1 4 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.827 0.061 17893 1000 1 4 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.490 -1.204 17893 1001 1 4 . 1 1 14 14 LYS H H 14 8.069 8.069 8.008 0.061 17893 1002 1 4 . 1 1 15 15 ILE N N 15 118.431 118.431 120.748 -2.317 17893 1003 1 4 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.213 0.410 17893 1004 1 4 . 1 1 15 15 ILE CA C 15 59.199 59.199 60.135 -0.936 17893 1005 1 4 . 1 1 15 15 ILE CB C 15 40.896 40.896 40.322 0.574 17893 1006 1 4 . 1 1 15 15 ILE H H 15 7.569 7.569 8.323 -0.754 17893 1007 1 4 . 1 1 16 16 SER N N 16 125.034 125.034 120.810 4.224 17893 1008 1 4 . 1 1 16 16 SER HA H 16 4.585 4.585 4.422 0.163 17893 1009 1 4 . 1 1 16 16 SER CA C 16 57.004 57.004 57.659 -0.655 17893 1010 1 4 . 1 1 16 16 SER CB C 16 64.914 64.914 64.271 0.643 17893 1011 1 4 . 1 1 16 16 SER H H 16 9.440 9.440 8.720 0.720 17893 1012 1 4 . 1 1 17 17 GLN N N 17 120.228 120.228 127.035 -6.807 17893 1013 1 4 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.033 -0.246 17893 1014 1 4 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.123 2.393 17893 1015 1 4 . 1 1 17 17 GLN CB C 17 29.051 29.051 27.893 1.158 17893 1016 1 4 . 1 1 17 17 GLN H H 17 9.527 9.527 9.083 0.444 17893 1017 1 4 . 1 1 18 18 SER N N 18 112.979 112.979 116.985 -4.006 17893 1018 1 4 . 1 1 18 18 SER HA H 18 4.531 4.531 4.063 0.468 17893 1019 1 4 . 1 1 18 18 SER CA C 18 62.872 62.872 62.493 0.379 17893 1020 1 4 . 1 1 18 18 SER CB C 18 65.338 65.338 62.525 2.813 17893 1021 1 4 . 1 1 18 18 SER H H 18 8.949 8.949 8.420 0.529 17893 1022 1 4 . 1 1 19 19 GLU N N 19 124.147 124.147 121.548 2.599 17893 1023 1 4 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.065 0.042 17893 1024 1 4 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.754 -0.141 17893 1025 1 4 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.395 0.144 17893 1026 1 4 . 1 1 19 19 GLU H H 19 8.331 8.331 7.612 0.719 17893 1027 1 4 . 1 1 20 20 LEU N N 20 119.943 119.943 121.181 -1.238 17893 1028 1 4 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.946 0.208 17893 1029 1 4 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.750 -0.176 17893 1030 1 4 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.482 -0.477 17893 1031 1 4 . 1 1 20 20 LEU H H 20 8.314 8.314 8.186 0.128 17893 1032 1 4 . 1 1 21 21 ALA N N 21 119.877 119.877 121.670 -1.793 17893 1033 1 4 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.954 -0.230 17893 1034 1 4 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.253 0.201 17893 1035 1 4 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.065 -1.204 17893 1036 1 4 . 1 1 21 21 ALA H H 21 8.588 8.588 8.899 -0.311 17893 1037 1 4 . 1 1 22 22 ALA N N 22 117.330 117.330 121.302 -3.972 17893 1038 1 4 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.971 0.293 17893 1039 1 4 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.764 -0.155 17893 1040 1 4 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.468 -0.812 17893 1041 1 4 . 1 1 22 22 ALA H H 22 7.813 7.813 7.508 0.305 17893 1042 1 4 . 1 1 23 23 LEU N N 23 118.586 118.586 118.452 0.134 17893 1043 1 4 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.656 0.305 17893 1044 1 4 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.182 -0.082 17893 1045 1 4 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.155 0.269 17893 1046 1 4 . 1 1 23 23 LEU H H 23 7.538 7.538 8.136 -0.598 17893 1047 1 4 . 1 1 24 24 LEU N N 24 114.488 114.488 115.995 -1.507 17893 1048 1 4 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.463 -0.199 17893 1049 1 4 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.566 -0.772 17893 1050 1 4 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.245 1.188 17893 1051 1 4 . 1 1 24 24 LEU H H 24 7.449 7.449 8.218 -0.769 17893 1052 1 4 . 1 1 25 25 GLU N N 25 114.895 114.895 114.371 0.524 17893 1053 1 4 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.035 -0.069 17893 1054 1 4 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.528 -0.380 17893 1055 1 4 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.008 -0.015 17893 1056 1 4 . 1 1 25 25 GLU H H 25 8.029 8.029 7.775 0.254 17893 1057 1 4 . 1 1 26 26 VAL N N 26 109.738 109.738 112.177 -2.439 17893 1058 1 4 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.638 0.252 17893 1059 1 4 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.583 -1.302 17893 1060 1 4 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.128 0.167 17893 1061 1 4 . 1 1 26 26 VAL H H 26 7.989 7.989 7.965 0.024 17893 1062 1 4 . 1 1 27 27 SER N N 27 114.381 114.381 115.306 -0.925 17893 1063 1 4 . 1 1 27 27 SER HA H 27 4.644 4.644 4.439 0.205 17893 1064 1 4 . 1 1 27 27 SER CA C 27 56.445 56.445 58.290 -1.845 17893 1065 1 4 . 1 1 27 27 SER CB C 27 62.251 62.251 64.012 -1.761 17893 1066 1 4 . 1 1 27 27 SER H H 27 8.618 8.618 8.349 0.269 17893 1067 1 4 . 1 1 28 28 ARG N N 28 115.323 115.323 124.314 -8.991 17893 1068 1 4 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.972 -0.224 17893 1069 1 4 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.004 -0.085 17893 1070 1 4 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.979 -0.929 17893 1071 1 4 . 1 1 28 28 ARG H H 28 8.242 8.242 8.947 -0.705 17893 1072 1 4 . 1 1 29 29 GLN N N 29 117.343 117.343 116.628 0.715 17893 1073 1 4 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.101 0.073 17893 1074 1 4 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.180 -0.095 17893 1075 1 4 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.656 -0.088 17893 1076 1 4 . 1 1 29 29 GLN H H 29 8.827 8.827 8.961 -0.134 17893 1077 1 4 . 1 1 30 30 THR N N 30 119.996 119.996 117.056 2.940 17893 1078 1 4 . 1 1 30 30 THR HA H 30 4.434 4.434 4.295 0.139 17893 1079 1 4 . 1 1 30 30 THR CA C 30 67.621 67.621 65.513 2.108 17893 1080 1 4 . 1 1 30 30 THR CB C 30 66.513 66.513 68.496 -1.984 17893 1081 1 4 . 1 1 30 30 THR H H 30 8.132 8.132 7.446 0.686 17893 1082 1 4 . 1 1 31 31 ILE N N 31 118.828 118.828 123.415 -4.587 17893 1083 1 4 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.821 -0.035 17893 1084 1 4 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.599 -2.570 17893 1085 1 4 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.624 -1.547 17893 1086 1 4 . 1 1 31 31 ILE H H 31 7.163 7.163 7.455 -0.292 17893 1087 1 4 . 1 1 32 32 ASN N N 32 118.098 118.098 119.059 -0.961 17893 1088 1 4 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.673 -0.318 17893 1089 1 4 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.653 0.601 17893 1090 1 4 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.285 0.963 17893 1091 1 4 . 1 1 32 32 ASN H H 32 8.656 8.656 8.693 -0.037 17893 1092 1 4 . 1 1 33 33 GLY N N 33 124.952 124.952 109.055 15.897 17893 1093 1 4 . 1 1 33 33 GLY CA C 33 47.140 47.140 47.098 0.042 17893 1094 1 4 . 1 1 33 33 GLY H H 33 8.643 8.643 8.830 -0.187 17893 1095 1 4 . 1 1 34 34 ILE N N 34 122.233 122.233 122.986 -0.753 17893 1096 1 4 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.755 0.549 17893 1097 1 4 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.384 0.420 17893 1098 1 4 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.102 0.184 17893 1099 1 4 . 1 1 34 34 ILE H H 34 8.203 8.203 7.518 0.685 17893 1100 1 4 . 1 1 35 35 GLU N N 35 120.686 120.686 119.018 1.668 17893 1101 1 4 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.016 0.198 17893 1102 1 4 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.876 0.816 17893 1103 1 4 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.362 -0.510 17893 1104 1 4 . 1 1 35 35 GLU H H 35 8.575 8.575 8.397 0.178 17893 1105 1 4 . 1 1 36 36 LYS N N 36 116.029 116.029 117.201 -1.172 17893 1106 1 4 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.177 0.344 17893 1107 1 4 . 1 1 36 36 LYS CA C 36 55.507 55.507 55.918 -0.411 17893 1108 1 4 . 1 1 36 36 LYS CB C 36 31.939 31.939 31.768 0.171 17893 1109 1 4 . 1 1 36 36 LYS H H 36 8.107 8.107 8.175 -0.068 17893 1110 1 4 . 1 1 37 37 ASN N N 37 114.692 114.692 114.283 0.409 17893 1111 1 4 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.359 0.390 17893 1112 1 4 . 1 1 37 37 ASN CA C 37 54.788 54.788 54.489 0.299 17893 1113 1 4 . 1 1 37 37 ASN CB C 37 36.949 36.949 36.222 0.727 17893 1114 1 4 . 1 1 37 37 ASN H H 37 8.240 8.240 8.036 0.204 17893 1115 1 4 . 1 1 38 38 LYS N N 38 115.098 115.098 119.526 -4.428 17893 1116 1 4 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.055 0.381 17893 1117 1 4 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.678 -2.500 17893 1118 1 4 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.425 -0.188 17893 1119 1 4 . 1 1 38 38 LYS H H 38 8.727 8.727 8.319 0.408 17893 1120 1 4 . 1 1 39 39 TYR N N 39 117.011 117.011 112.803 4.208 17893 1121 1 4 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.782 -0.153 17893 1122 1 4 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.536 0.023 17893 1123 1 4 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.213 0.690 17893 1124 1 4 . 1 1 39 39 TYR H H 39 7.087 7.087 7.037 0.050 17893 1125 1 4 . 1 1 40 40 ASN N N 40 123.595 123.595 120.475 3.120 17893 1126 1 4 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.865 0.388 17893 1127 1 4 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.867 -2.095 17893 1128 1 4 . 1 1 40 40 ASN CB C 40 38.476 38.476 38.945 -0.469 17893 1129 1 4 . 1 1 40 40 ASN H H 40 8.842 8.842 8.554 0.288 17893 1130 1 4 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.578 -0.769 17893 1131 1 4 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.398 0.132 17893 1132 1 4 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.310 -0.749 17893 1133 1 4 . 1 1 42 42 SER N N 42 125.580 125.580 115.322 10.258 17893 1134 1 4 . 1 1 42 42 SER HA H 42 4.581 4.581 4.363 0.218 17893 1135 1 4 . 1 1 42 42 SER CA C 42 57.380 57.380 57.857 -0.477 17893 1136 1 4 . 1 1 42 42 SER CB C 42 64.562 64.562 63.768 0.794 17893 1137 1 4 . 1 1 42 42 SER H H 42 8.033 8.033 8.296 -0.263 17893 1138 1 4 . 1 1 43 43 LEU N N 43 120.759 120.759 125.568 -4.809 17893 1139 1 4 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.018 -0.104 17893 1140 1 4 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.585 -0.240 17893 1141 1 4 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.628 -0.772 17893 1142 1 4 . 1 1 43 43 LEU H H 43 9.289 9.289 8.696 0.593 17893 1143 1 4 . 1 1 44 44 GLN N N 44 115.948 115.948 118.838 -2.890 17893 1144 1 4 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.094 -0.367 17893 1145 1 4 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.124 1.012 17893 1146 1 4 . 1 1 44 44 GLN CB C 44 28.250 28.250 27.967 0.283 17893 1147 1 4 . 1 1 44 44 GLN H H 44 8.906 8.906 8.669 0.237 17893 1148 1 4 . 1 1 45 45 LEU N N 45 119.419 119.419 119.726 -0.307 17893 1149 1 4 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.999 -0.074 17893 1150 1 4 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.504 -2.900 17893 1151 1 4 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.366 -0.739 17893 1152 1 4 . 1 1 45 45 LEU H H 45 8.078 8.078 7.989 0.089 17893 1153 1 4 . 1 1 46 46 ALA N N 46 120.544 120.544 122.343 -1.799 17893 1154 1 4 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.921 0.127 17893 1155 1 4 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.224 0.520 17893 1156 1 4 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.894 1.839 17893 1157 1 4 . 1 1 46 46 ALA H H 46 8.518 8.518 8.770 -0.252 17893 1158 1 4 . 1 1 47 47 LEU N N 47 116.461 116.461 118.764 -2.303 17893 1159 1 4 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.811 0.404 17893 1160 1 4 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.054 -0.553 17893 1161 1 4 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.571 -0.485 17893 1162 1 4 . 1 1 47 47 LEU H H 47 8.676 8.676 8.503 0.173 17893 1163 1 4 . 1 1 48 48 LYS N N 48 120.958 120.958 119.846 1.112 17893 1164 1 4 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.730 -0.130 17893 1165 1 4 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.660 0.269 17893 1166 1 4 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.307 -0.039 17893 1167 1 4 . 1 1 48 48 LYS H H 48 8.036 8.036 7.883 0.153 17893 1168 1 4 . 1 1 49 49 ILE N N 49 120.407 120.407 120.264 0.143 17893 1169 1 4 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.910 -0.311 17893 1170 1 4 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.694 1.509 17893 1171 1 4 . 1 1 49 49 ILE CB C 49 37.653 37.653 38.004 -0.351 17893 1172 1 4 . 1 1 49 49 ILE H H 49 8.779 8.779 8.376 0.403 17893 1173 1 4 . 1 1 50 50 ALA N N 50 120.480 120.480 122.844 -2.364 17893 1174 1 4 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.054 0.025 17893 1175 1 4 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.166 0.457 17893 1176 1 4 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.331 -0.326 17893 1177 1 4 . 1 1 50 50 ALA H H 50 8.173 8.173 8.487 -0.314 17893 1178 1 4 . 1 1 51 51 TYR N N 51 117.118 117.118 120.282 -3.164 17893 1179 1 4 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.956 0.409 17893 1180 1 4 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.108 -0.676 17893 1181 1 4 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.304 -0.081 17893 1182 1 4 . 1 1 51 51 TYR H H 51 8.169 8.169 8.021 0.148 17893 1183 1 4 . 1 1 52 52 TYR N N 52 118.548 118.548 115.894 2.654 17893 1184 1 4 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.097 0.224 17893 1185 1 4 . 1 1 52 52 TYR CA C 52 62.969 62.969 60.718 2.251 17893 1186 1 4 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.055 -0.577 17893 1187 1 4 . 1 1 52 52 TYR H H 52 9.062 9.062 7.477 1.585 17893 1188 1 4 . 1 1 53 53 LEU N N 53 115.380 115.380 116.177 -0.797 17893 1189 1 4 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.042 0.495 17893 1190 1 4 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.508 -2.364 17893 1191 1 4 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.213 -2.117 17893 1192 1 4 . 1 1 53 53 LEU H H 53 8.394 8.394 8.326 0.068 17893 1193 1 4 . 1 1 54 54 ASN N N 54 122.105 122.105 114.640 7.465 17893 1194 1 4 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.347 0.109 17893 1195 1 4 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.233 -0.442 17893 1196 1 4 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.531 0.228 17893 1197 1 4 . 1 1 54 54 ASN H H 54 8.091 8.091 8.189 -0.098 17893 1198 1 4 . 1 1 55 55 THR N N 55 114.964 114.964 114.554 0.410 17893 1199 1 4 . 1 1 55 55 THR HA H 55 4.947 4.947 4.751 0.196 17893 1200 1 4 . 1 1 55 55 THR CA C 55 60.062 60.062 59.225 0.837 17893 1201 1 4 . 1 1 55 55 THR CB C 55 74.945 74.945 70.667 4.278 17893 1202 1 4 . 1 1 55 55 THR H H 55 8.248 8.248 7.674 0.574 17893 1203 1 4 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.551 0.059 17893 1204 1 4 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.751 0.091 17893 1205 1 4 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.524 -0.578 17893 1206 1 4 . 1 1 57 57 LEU N N 57 127.597 127.597 125.311 2.286 17893 1207 1 4 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.062 0.009 17893 1208 1 4 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.687 1.035 17893 1209 1 4 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.042 -0.549 17893 1210 1 4 . 1 1 57 57 LEU H H 57 9.958 9.958 8.656 1.302 17893 1211 1 4 . 1 1 58 58 GLU N N 58 123.260 123.260 118.202 5.058 17893 1212 1 4 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.344 0.542 17893 1213 1 4 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.014 -0.498 17893 1214 1 4 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.116 -0.058 17893 1215 1 4 . 1 1 58 58 GLU H H 58 9.353 9.353 8.668 0.685 17893 1216 1 4 . 1 1 59 59 ASP N N 59 117.681 117.681 118.307 -0.626 17893 1217 1 4 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.465 0.189 17893 1218 1 4 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.692 -1.069 17893 1219 1 4 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.036 -1.045 17893 1220 1 4 . 1 1 59 59 ASP H H 59 8.012 8.012 8.113 -0.101 17893 1221 1 4 . 1 1 60 60 ILE N N 60 119.519 119.519 115.927 3.592 17893 1222 1 4 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.865 -0.322 17893 1223 1 4 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.402 0.504 17893 1224 1 4 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.968 0.448 17893 1225 1 4 . 1 1 60 60 ILE H H 60 8.210 8.210 7.132 1.078 17893 1226 1 4 . 1 1 61 61 PHE N N 61 116.030 116.030 118.863 -2.833 17893 1227 1 4 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.672 -0.226 17893 1228 1 4 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.772 0.049 17893 1229 1 4 . 1 1 61 61 PHE CB C 61 41.965 41.965 40.319 1.646 17893 1230 1 4 . 1 1 61 61 PHE H H 61 8.530 8.530 8.838 -0.308 17893 1231 1 4 . 1 1 62 62 GLN N N 62 116.829 116.829 121.409 -4.580 17893 1232 1 4 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.879 0.178 17893 1233 1 4 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.739 0.250 17893 1234 1 4 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.522 0.306 17893 1235 1 4 . 1 1 62 62 GLN H H 62 8.737 8.737 8.975 -0.238 17893 1236 1 4 . 1 1 63 63 TRP N N 63 125.623 125.623 127.938 -2.315 17893 1237 1 4 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.056 0.151 17893 1238 1 4 . 1 1 63 63 TRP CA C 63 56.531 56.531 57.121 -0.590 17893 1239 1 4 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.640 0.065 17893 1240 1 4 . 1 1 63 63 TRP H H 63 9.464 9.464 8.858 0.606 17893 1241 1 4 . 1 1 64 64 GLN N N 64 127.029 127.029 126.247 0.782 17893 1242 1 4 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.034 0.164 17893 1243 1 4 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.112 -0.610 17893 1244 1 4 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.807 0.866 17893 1245 1 4 . 1 1 64 64 GLN H H 64 7.977 7.977 8.565 -0.588 17893 1246 1 4 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.491 0.189 17893 1247 1 4 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.102 -1.447 17893 1248 1 4 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.391 -0.891 17893 1249 1 5 . 1 1 2 2 ILE N N 2 123.389 123.389 120.518 2.871 17893 1250 1 5 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.159 -0.038 17893 1251 1 5 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.034 1.139 17893 1252 1 5 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.223 -0.091 17893 1253 1 5 . 1 1 2 2 ILE H H 2 9.112 9.112 7.700 1.412 17893 1254 1 5 . 1 1 3 3 ILE N N 3 108.863 108.863 127.455 -18.592 17893 1255 1 5 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.237 0.196 17893 1256 1 5 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.306 -0.152 17893 1257 1 5 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.859 -1.204 17893 1258 1 5 . 1 1 3 3 ILE H H 3 9.418 9.418 9.134 0.284 17893 1259 1 5 . 1 1 4 4 ASN N N 4 123.919 123.919 125.776 -1.857 17893 1260 1 5 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.672 0.960 17893 1261 1 5 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.348 -0.970 17893 1262 1 5 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.877 2.160 17893 1263 1 5 . 1 1 4 4 ASN H H 4 9.056 9.056 8.875 0.181 17893 1264 1 5 . 1 1 5 5 ASN N N 5 120.944 120.944 123.558 -2.614 17893 1265 1 5 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.770 0.673 17893 1266 1 5 . 1 1 5 5 ASN CA C 5 51.415 51.415 53.331 -1.916 17893 1267 1 5 . 1 1 5 5 ASN CB C 5 39.813 39.813 39.647 0.167 17893 1268 1 5 . 1 1 5 5 ASN H H 5 9.383 9.383 8.966 0.417 17893 1269 1 5 . 1 1 6 6 LEU N N 6 120.594 120.594 122.590 -1.996 17893 1270 1 5 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.808 -0.042 17893 1271 1 5 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.754 -0.055 17893 1272 1 5 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.793 -0.988 17893 1273 1 5 . 1 1 6 6 LEU H H 6 8.531 8.531 9.265 -0.734 17893 1274 1 5 . 1 1 7 7 LYS N N 7 118.212 118.212 117.578 0.634 17893 1275 1 5 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.000 -0.067 17893 1276 1 5 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.159 1.104 17893 1277 1 5 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.438 0.865 17893 1278 1 5 . 1 1 7 7 LYS H H 7 8.933 8.933 7.928 1.004 17893 1279 1 5 . 1 1 8 8 LEU N N 8 116.414 116.414 120.656 -4.242 17893 1280 1 5 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.016 0.157 17893 1281 1 5 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.291 0.099 17893 1282 1 5 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.837 0.191 17893 1283 1 5 . 1 1 8 8 LEU H H 8 7.667 7.667 7.569 0.098 17893 1284 1 5 . 1 1 9 9 ILE N N 9 119.134 119.134 118.674 0.460 17893 1285 1 5 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.531 0.283 17893 1286 1 5 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.400 -2.543 17893 1287 1 5 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.775 -1.312 17893 1288 1 5 . 1 1 9 9 ILE H H 9 8.226 8.226 8.597 -0.371 17893 1289 1 5 . 1 1 10 10 ARG N N 10 120.162 120.162 120.088 0.074 17893 1290 1 5 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.900 0.001 17893 1291 1 5 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.847 0.880 17893 1292 1 5 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.107 -1.608 17893 1293 1 5 . 1 1 10 10 ARG H H 10 9.260 9.260 8.723 0.537 17893 1294 1 5 . 1 1 11 11 GLU N N 11 115.948 115.948 118.232 -2.284 17893 1295 1 5 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.151 0.022 17893 1296 1 5 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.572 0.814 17893 1297 1 5 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.064 -0.150 17893 1298 1 5 . 1 1 11 11 GLU H H 11 8.701 8.701 8.210 0.491 17893 1299 1 5 . 1 1 12 12 LYS N N 12 122.900 122.900 118.829 4.071 17893 1300 1 5 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.091 0.131 17893 1301 1 5 . 1 1 12 12 LYS CA C 12 59.416 59.416 58.498 0.918 17893 1302 1 5 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.792 -0.794 17893 1303 1 5 . 1 1 12 12 LYS H H 12 8.254 8.254 7.759 0.495 17893 1304 1 5 . 1 1 13 13 LYS N N 13 116.385 116.385 115.174 1.211 17893 1305 1 5 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.390 -0.093 17893 1306 1 5 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.666 -0.636 17893 1307 1 5 . 1 1 13 13 LYS CB C 13 31.549 31.549 33.206 -1.657 17893 1308 1 5 . 1 1 13 13 LYS H H 13 7.809 7.809 7.550 0.259 17893 1309 1 5 . 1 1 14 14 LYS N N 14 115.317 115.317 117.167 -1.850 17893 1310 1 5 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.923 0.059 17893 1311 1 5 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.806 0.082 17893 1312 1 5 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.982 -1.696 17893 1313 1 5 . 1 1 14 14 LYS H H 14 8.069 8.069 7.997 0.072 17893 1314 1 5 . 1 1 15 15 ILE N N 15 118.431 118.431 120.589 -2.158 17893 1315 1 5 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.122 0.501 17893 1316 1 5 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.507 -0.308 17893 1317 1 5 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.381 2.515 17893 1318 1 5 . 1 1 15 15 ILE H H 15 7.569 7.569 7.883 -0.314 17893 1319 1 5 . 1 1 16 16 SER N N 16 125.034 125.034 122.944 2.090 17893 1320 1 5 . 1 1 16 16 SER HA H 16 4.585 4.585 4.432 0.153 17893 1321 1 5 . 1 1 16 16 SER CA C 16 57.004 57.004 57.939 -0.935 17893 1322 1 5 . 1 1 16 16 SER CB C 16 64.914 64.914 64.012 0.902 17893 1323 1 5 . 1 1 16 16 SER H H 16 9.440 9.440 8.625 0.815 17893 1324 1 5 . 1 1 17 17 GLN N N 17 120.228 120.228 125.161 -4.933 17893 1325 1 5 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.004 -0.217 17893 1326 1 5 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.365 2.151 17893 1327 1 5 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.771 0.280 17893 1328 1 5 . 1 1 17 17 GLN H H 17 9.527 9.527 9.020 0.507 17893 1329 1 5 . 1 1 18 18 SER N N 18 112.979 112.979 115.070 -2.091 17893 1330 1 5 . 1 1 18 18 SER HA H 18 4.531 4.531 4.055 0.476 17893 1331 1 5 . 1 1 18 18 SER CA C 18 62.872 62.872 62.394 0.478 17893 1332 1 5 . 1 1 18 18 SER CB C 18 65.338 65.338 62.598 2.740 17893 1333 1 5 . 1 1 18 18 SER H H 18 8.949 8.949 8.119 0.830 17893 1334 1 5 . 1 1 19 19 GLU N N 19 124.147 124.147 121.624 2.523 17893 1335 1 5 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.075 0.032 17893 1336 1 5 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.457 0.156 17893 1337 1 5 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.081 0.458 17893 1338 1 5 . 1 1 19 19 GLU H H 19 8.331 8.331 7.570 0.761 17893 1339 1 5 . 1 1 20 20 LEU N N 20 119.943 119.943 121.644 -1.701 17893 1340 1 5 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.896 0.258 17893 1341 1 5 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.743 -0.169 17893 1342 1 5 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.403 -0.398 17893 1343 1 5 . 1 1 20 20 LEU H H 20 8.314 8.314 8.126 0.188 17893 1344 1 5 . 1 1 21 21 ALA N N 21 119.877 119.877 121.428 -1.551 17893 1345 1 5 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.929 -0.205 17893 1346 1 5 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.219 0.235 17893 1347 1 5 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.008 -1.147 17893 1348 1 5 . 1 1 21 21 ALA H H 21 8.588 8.588 8.971 -0.383 17893 1349 1 5 . 1 1 22 22 ALA N N 22 117.330 117.330 121.700 -4.370 17893 1350 1 5 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.966 0.298 17893 1351 1 5 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.778 -0.169 17893 1352 1 5 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.476 -0.820 17893 1353 1 5 . 1 1 22 22 ALA H H 22 7.813 7.813 7.609 0.204 17893 1354 1 5 . 1 1 23 23 LEU N N 23 118.586 118.586 118.670 -0.084 17893 1355 1 5 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.663 0.298 17893 1356 1 5 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.287 -0.187 17893 1357 1 5 . 1 1 23 23 LEU CB C 23 41.424 41.424 40.937 0.487 17893 1358 1 5 . 1 1 23 23 LEU H H 23 7.538 7.538 8.391 -0.853 17893 1359 1 5 . 1 1 24 24 LEU N N 24 114.488 114.488 118.006 -3.518 17893 1360 1 5 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.257 0.007 17893 1361 1 5 . 1 1 24 24 LEU CA C 24 54.794 54.794 56.462 -1.668 17893 1362 1 5 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.197 1.236 17893 1363 1 5 . 1 1 24 24 LEU H H 24 7.449 7.449 8.133 -0.684 17893 1364 1 5 . 1 1 25 25 GLU N N 25 114.895 114.895 114.430 0.465 17893 1365 1 5 . 1 1 25 25 GLU HA H 25 3.966 3.966 3.991 -0.025 17893 1366 1 5 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.423 -0.275 17893 1367 1 5 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.382 -0.389 17893 1368 1 5 . 1 1 25 25 GLU H H 25 8.029 8.029 8.011 0.018 17893 1369 1 5 . 1 1 26 26 VAL N N 26 109.738 109.738 112.164 -2.426 17893 1370 1 5 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.563 0.327 17893 1371 1 5 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.119 -0.838 17893 1372 1 5 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.659 0.636 17893 1373 1 5 . 1 1 26 26 VAL H H 26 7.989 7.989 7.982 0.007 17893 1374 1 5 . 1 1 27 27 SER N N 27 114.381 114.381 115.205 -0.824 17893 1375 1 5 . 1 1 27 27 SER HA H 27 4.644 4.644 4.492 0.152 17893 1376 1 5 . 1 1 27 27 SER CA C 27 56.445 56.445 57.318 -0.873 17893 1377 1 5 . 1 1 27 27 SER CB C 27 62.251 62.251 64.927 -2.676 17893 1378 1 5 . 1 1 27 27 SER H H 27 8.618 8.618 8.571 0.047 17893 1379 1 5 . 1 1 28 28 ARG N N 28 115.323 115.323 124.247 -8.924 17893 1380 1 5 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.999 -0.251 17893 1381 1 5 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.063 -0.144 17893 1382 1 5 . 1 1 28 28 ARG CB C 28 29.050 29.050 30.239 -1.189 17893 1383 1 5 . 1 1 28 28 ARG H H 28 8.242 8.242 8.871 -0.629 17893 1384 1 5 . 1 1 29 29 GLN N N 29 117.343 117.343 117.902 -0.559 17893 1385 1 5 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.051 0.123 17893 1386 1 5 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.046 0.039 17893 1387 1 5 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.721 -0.153 17893 1388 1 5 . 1 1 29 29 GLN H H 29 8.827 8.827 7.964 0.863 17893 1389 1 5 . 1 1 30 30 THR N N 30 119.996 119.996 118.108 1.888 17893 1390 1 5 . 1 1 30 30 THR HA H 30 4.434 4.434 4.271 0.163 17893 1391 1 5 . 1 1 30 30 THR CA C 30 67.621 67.621 66.596 1.025 17893 1392 1 5 . 1 1 30 30 THR CB C 30 66.513 66.513 68.594 -2.081 17893 1393 1 5 . 1 1 30 30 THR H H 30 8.132 8.132 7.628 0.504 17893 1394 1 5 . 1 1 31 31 ILE N N 31 118.828 118.828 121.635 -2.807 17893 1395 1 5 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.715 0.071 17893 1396 1 5 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.822 -2.793 17893 1397 1 5 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.817 -1.740 17893 1398 1 5 . 1 1 31 31 ILE H H 31 7.163 7.163 7.641 -0.478 17893 1399 1 5 . 1 1 32 32 ASN N N 32 118.098 118.098 118.817 -0.719 17893 1400 1 5 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.587 -0.232 17893 1401 1 5 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.277 -0.023 17893 1402 1 5 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.448 0.800 17893 1403 1 5 . 1 1 32 32 ASN H H 32 8.656 8.656 9.109 -0.453 17893 1404 1 5 . 1 1 33 33 GLY N N 33 124.952 124.952 108.657 16.295 17893 1405 1 5 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.924 0.216 17893 1406 1 5 . 1 1 33 33 GLY H H 33 8.643 8.643 8.514 0.129 17893 1407 1 5 . 1 1 34 34 ILE N N 34 122.233 122.233 122.683 -0.450 17893 1408 1 5 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.897 0.407 17893 1409 1 5 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.441 0.363 17893 1410 1 5 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.186 0.100 17893 1411 1 5 . 1 1 34 34 ILE H H 34 8.203 8.203 7.238 0.965 17893 1412 1 5 . 1 1 35 35 GLU N N 35 120.686 120.686 118.355 2.331 17893 1413 1 5 . 1 1 35 35 GLU HA H 35 4.214 4.214 3.912 0.302 17893 1414 1 5 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.170 0.522 17893 1415 1 5 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.408 -0.556 17893 1416 1 5 . 1 1 35 35 GLU H H 35 8.575 8.575 8.113 0.462 17893 1417 1 5 . 1 1 36 36 LYS N N 36 116.029 116.029 120.248 -4.219 17893 1418 1 5 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.064 0.457 17893 1419 1 5 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.782 -3.275 17893 1420 1 5 . 1 1 36 36 LYS CB C 36 31.939 31.939 32.891 -0.952 17893 1421 1 5 . 1 1 36 36 LYS H H 36 8.107 8.107 8.216 -0.109 17893 1422 1 5 . 1 1 37 37 ASN N N 37 114.692 114.692 111.097 3.595 17893 1423 1 5 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.745 0.004 17893 1424 1 5 . 1 1 37 37 ASN CA C 37 54.788 54.788 52.942 1.846 17893 1425 1 5 . 1 1 37 37 ASN CB C 37 36.949 36.949 38.899 -1.950 17893 1426 1 5 . 1 1 37 37 ASN H H 37 8.240 8.240 8.092 0.148 17893 1427 1 5 . 1 1 38 38 LYS N N 38 115.098 115.098 121.503 -6.405 17893 1428 1 5 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.099 0.337 17893 1429 1 5 . 1 1 38 38 LYS CA C 38 56.178 56.178 59.105 -2.928 17893 1430 1 5 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.196 0.040 17893 1431 1 5 . 1 1 38 38 LYS H H 38 8.727 8.727 8.348 0.379 17893 1432 1 5 . 1 1 39 39 TYR N N 39 117.011 117.011 111.808 5.203 17893 1433 1 5 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.704 -0.075 17893 1434 1 5 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.852 -0.293 17893 1435 1 5 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.661 1.242 17893 1436 1 5 . 1 1 39 39 TYR H H 39 7.087 7.087 7.121 -0.034 17893 1437 1 5 . 1 1 40 40 ASN N N 40 123.595 123.595 121.022 2.573 17893 1438 1 5 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.839 0.414 17893 1439 1 5 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.840 -2.068 17893 1440 1 5 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.060 -0.584 17893 1441 1 5 . 1 1 40 40 ASN H H 40 8.842 8.842 8.522 0.320 17893 1442 1 5 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.624 -0.815 17893 1443 1 5 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.496 0.033 17893 1444 1 5 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.259 -0.698 17893 1445 1 5 . 1 1 42 42 SER N N 42 125.580 125.580 115.413 10.167 17893 1446 1 5 . 1 1 42 42 SER HA H 42 4.581 4.581 4.290 0.291 17893 1447 1 5 . 1 1 42 42 SER CA C 42 57.380 57.380 57.908 -0.528 17893 1448 1 5 . 1 1 42 42 SER CB C 42 64.562 64.562 63.955 0.607 17893 1449 1 5 . 1 1 42 42 SER H H 42 8.033 8.033 8.204 -0.171 17893 1450 1 5 . 1 1 43 43 LEU N N 43 120.759 120.759 125.142 -4.383 17893 1451 1 5 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.997 -0.083 17893 1452 1 5 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.498 -0.152 17893 1453 1 5 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.411 -0.555 17893 1454 1 5 . 1 1 43 43 LEU H H 43 9.289 9.289 8.761 0.528 17893 1455 1 5 . 1 1 44 44 GLN N N 44 115.948 115.948 118.899 -2.951 17893 1456 1 5 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.110 -0.383 17893 1457 1 5 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.077 1.059 17893 1458 1 5 . 1 1 44 44 GLN CB C 44 28.250 28.250 27.900 0.350 17893 1459 1 5 . 1 1 44 44 GLN H H 44 8.906 8.906 8.670 0.236 17893 1460 1 5 . 1 1 45 45 LEU N N 45 119.419 119.419 119.890 -0.471 17893 1461 1 5 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.059 -0.134 17893 1462 1 5 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.207 -2.603 17893 1463 1 5 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.304 -0.677 17893 1464 1 5 . 1 1 45 45 LEU H H 45 8.078 8.078 7.909 0.169 17893 1465 1 5 . 1 1 46 46 ALA N N 46 120.544 120.544 122.381 -1.837 17893 1466 1 5 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.999 0.049 17893 1467 1 5 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.316 0.428 17893 1468 1 5 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.009 1.724 17893 1469 1 5 . 1 1 46 46 ALA H H 46 8.518 8.518 8.787 -0.269 17893 1470 1 5 . 1 1 47 47 LEU N N 47 116.461 116.461 118.876 -2.415 17893 1471 1 5 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.864 0.351 17893 1472 1 5 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.144 -0.643 17893 1473 1 5 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.573 -0.487 17893 1474 1 5 . 1 1 47 47 LEU H H 47 8.676 8.676 8.420 0.256 17893 1475 1 5 . 1 1 48 48 LYS N N 48 120.958 120.958 120.149 0.809 17893 1476 1 5 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.972 -0.372 17893 1477 1 5 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.935 -0.006 17893 1478 1 5 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.406 -0.138 17893 1479 1 5 . 1 1 48 48 LYS H H 48 8.036 8.036 7.946 0.090 17893 1480 1 5 . 1 1 49 49 ILE N N 49 120.407 120.407 120.600 -0.193 17893 1481 1 5 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.858 -0.259 17893 1482 1 5 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.783 1.419 17893 1483 1 5 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.903 -0.250 17893 1484 1 5 . 1 1 49 49 ILE H H 49 8.779 8.779 8.489 0.290 17893 1485 1 5 . 1 1 50 50 ALA N N 50 120.480 120.480 124.133 -3.653 17893 1486 1 5 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.139 -0.060 17893 1487 1 5 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.272 0.351 17893 1488 1 5 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.327 -0.322 17893 1489 1 5 . 1 1 50 50 ALA H H 50 8.173 8.173 8.743 -0.570 17893 1490 1 5 . 1 1 51 51 TYR N N 51 117.118 117.118 120.093 -2.975 17893 1491 1 5 . 1 1 51 51 TYR HA H 51 4.365 4.365 4.014 0.351 17893 1492 1 5 . 1 1 51 51 TYR CA C 51 61.433 61.433 61.968 -0.535 17893 1493 1 5 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.414 -0.191 17893 1494 1 5 . 1 1 51 51 TYR H H 51 8.169 8.169 8.466 -0.297 17893 1495 1 5 . 1 1 52 52 TYR N N 52 118.548 118.548 116.767 1.781 17893 1496 1 5 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.053 0.268 17893 1497 1 5 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.593 1.375 17893 1498 1 5 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.331 -0.853 17893 1499 1 5 . 1 1 52 52 TYR H H 52 9.062 9.062 8.242 0.820 17893 1500 1 5 . 1 1 53 53 LEU N N 53 115.380 115.380 116.041 -0.661 17893 1501 1 5 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.068 0.469 17893 1502 1 5 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.274 -2.130 17893 1503 1 5 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.139 -2.043 17893 1504 1 5 . 1 1 53 53 LEU H H 53 8.394 8.394 8.709 -0.315 17893 1505 1 5 . 1 1 54 54 ASN N N 54 122.105 122.105 115.075 7.030 17893 1506 1 5 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.324 0.132 17893 1507 1 5 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.114 -0.323 17893 1508 1 5 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.462 0.295 17893 1509 1 5 . 1 1 54 54 ASN H H 54 8.091 8.091 8.082 0.009 17893 1510 1 5 . 1 1 55 55 THR N N 55 114.964 114.964 114.017 0.947 17893 1511 1 5 . 1 1 55 55 THR HA H 55 4.947 4.947 4.790 0.157 17893 1512 1 5 . 1 1 55 55 THR CA C 55 60.062 60.062 59.527 0.535 17893 1513 1 5 . 1 1 55 55 THR CB C 55 74.945 74.945 71.019 3.926 17893 1514 1 5 . 1 1 55 55 THR H H 55 8.248 8.248 8.020 0.228 17893 1515 1 5 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.548 0.062 17893 1516 1 5 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.910 -0.069 17893 1517 1 5 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.576 -0.630 17893 1518 1 5 . 1 1 57 57 LEU N N 57 127.597 127.597 124.938 2.659 17893 1519 1 5 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.103 -0.032 17893 1520 1 5 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.792 0.930 17893 1521 1 5 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.105 -0.612 17893 1522 1 5 . 1 1 57 57 LEU H H 57 9.958 9.958 8.616 1.342 17893 1523 1 5 . 1 1 58 58 GLU N N 58 123.260 123.260 119.035 4.225 17893 1524 1 5 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.333 0.553 17893 1525 1 5 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.083 -0.566 17893 1526 1 5 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.046 0.013 17893 1527 1 5 . 1 1 58 58 GLU H H 58 9.353 9.353 8.816 0.537 17893 1528 1 5 . 1 1 59 59 ASP N N 59 117.681 117.681 119.185 -1.504 17893 1529 1 5 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.430 0.224 17893 1530 1 5 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.424 -0.801 17893 1531 1 5 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.983 -0.993 17893 1532 1 5 . 1 1 59 59 ASP H H 59 8.012 8.012 7.747 0.265 17893 1533 1 5 . 1 1 60 60 ILE N N 60 119.519 119.519 116.215 3.304 17893 1534 1 5 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.757 -0.214 17893 1535 1 5 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.407 0.499 17893 1536 1 5 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.000 0.416 17893 1537 1 5 . 1 1 60 60 ILE H H 60 8.210 8.210 7.145 1.065 17893 1538 1 5 . 1 1 61 61 PHE N N 61 116.030 116.030 117.782 -1.752 17893 1539 1 5 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.656 -0.210 17893 1540 1 5 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.824 -0.003 17893 1541 1 5 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.814 0.151 17893 1542 1 5 . 1 1 61 61 PHE H H 61 8.530 8.530 8.774 -0.244 17893 1543 1 5 . 1 1 62 62 GLN N N 62 116.829 116.829 120.376 -3.547 17893 1544 1 5 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.920 0.137 17893 1545 1 5 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.692 0.297 17893 1546 1 5 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.413 -0.585 17893 1547 1 5 . 1 1 62 62 GLN H H 62 8.737 8.737 8.981 -0.244 17893 1548 1 5 . 1 1 63 63 TRP N N 63 125.623 125.623 125.892 -0.269 17893 1549 1 5 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.136 0.071 17893 1550 1 5 . 1 1 63 63 TRP CA C 63 56.531 56.531 57.072 -0.541 17893 1551 1 5 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.834 -0.130 17893 1552 1 5 . 1 1 63 63 TRP H H 63 9.464 9.464 8.800 0.664 17893 1553 1 5 . 1 1 64 64 GLN N N 64 127.029 127.029 123.692 3.337 17893 1554 1 5 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.035 0.163 17893 1555 1 5 . 1 1 64 64 GLN CA C 64 51.502 51.502 51.970 -0.468 17893 1556 1 5 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.595 1.078 17893 1557 1 5 . 1 1 64 64 GLN H H 64 7.977 7.977 8.361 -0.384 17893 1558 1 5 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.619 0.061 17893 1559 1 5 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.184 -1.529 17893 1560 1 5 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.346 -0.846 17893 1561 1 6 . 1 1 2 2 ILE N N 2 123.389 123.389 121.087 2.302 17893 1562 1 6 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.638 0.483 17893 1563 1 6 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.681 0.492 17893 1564 1 6 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.338 0.794 17893 1565 1 6 . 1 1 2 2 ILE H H 2 9.112 9.112 7.758 1.354 17893 1566 1 6 . 1 1 3 3 ILE N N 3 108.863 108.863 128.967 -20.104 17893 1567 1 6 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.150 0.283 17893 1568 1 6 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.521 -0.367 17893 1569 1 6 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.243 -0.588 17893 1570 1 6 . 1 1 3 3 ILE H H 3 9.418 9.418 9.334 0.084 17893 1571 1 6 . 1 1 4 4 ASN N N 4 123.919 123.919 126.122 -2.203 17893 1572 1 6 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.902 0.730 17893 1573 1 6 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.109 -0.731 17893 1574 1 6 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.937 2.100 17893 1575 1 6 . 1 1 4 4 ASN H H 4 9.056 9.056 8.879 0.177 17893 1576 1 6 . 1 1 5 5 ASN N N 5 120.944 120.944 124.024 -3.080 17893 1577 1 6 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.786 0.657 17893 1578 1 6 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.909 -1.494 17893 1579 1 6 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.669 1.144 17893 1580 1 6 . 1 1 5 5 ASN H H 5 9.383 9.383 9.116 0.267 17893 1581 1 6 . 1 1 6 6 LEU N N 6 120.594 120.594 123.166 -2.572 17893 1582 1 6 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.842 -0.075 17893 1583 1 6 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.165 0.534 17893 1584 1 6 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.540 -0.735 17893 1585 1 6 . 1 1 6 6 LEU H H 6 8.531 8.531 9.198 -0.667 17893 1586 1 6 . 1 1 7 7 LYS N N 7 118.212 118.212 117.653 0.559 17893 1587 1 6 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.011 -0.078 17893 1588 1 6 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.110 1.153 17893 1589 1 6 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.373 0.930 17893 1590 1 6 . 1 1 7 7 LYS H H 7 8.933 8.933 8.162 0.770 17893 1591 1 6 . 1 1 8 8 LEU N N 8 116.414 116.414 120.567 -4.153 17893 1592 1 6 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.043 0.130 17893 1593 1 6 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.262 0.128 17893 1594 1 6 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.911 0.117 17893 1595 1 6 . 1 1 8 8 LEU H H 8 7.667 7.667 7.487 0.180 17893 1596 1 6 . 1 1 9 9 ILE N N 9 119.134 119.134 118.529 0.605 17893 1597 1 6 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.584 0.230 17893 1598 1 6 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.044 -2.188 17893 1599 1 6 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.710 -1.248 17893 1600 1 6 . 1 1 9 9 ILE H H 9 8.226 8.226 8.535 -0.309 17893 1601 1 6 . 1 1 10 10 ARG N N 10 120.162 120.162 119.956 0.206 17893 1602 1 6 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.928 -0.027 17893 1603 1 6 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.894 0.833 17893 1604 1 6 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.140 -1.641 17893 1605 1 6 . 1 1 10 10 ARG H H 10 9.260 9.260 8.886 0.374 17893 1606 1 6 . 1 1 11 11 GLU N N 11 115.948 115.948 118.456 -2.508 17893 1607 1 6 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.157 0.016 17893 1608 1 6 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.568 0.819 17893 1609 1 6 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.014 -0.100 17893 1610 1 6 . 1 1 11 11 GLU H H 11 8.701 8.701 7.862 0.839 17893 1611 1 6 . 1 1 12 12 LYS N N 12 122.900 122.900 118.860 4.040 17893 1612 1 6 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.090 0.132 17893 1613 1 6 . 1 1 12 12 LYS CA C 12 59.416 59.416 58.536 0.880 17893 1614 1 6 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.758 -0.760 17893 1615 1 6 . 1 1 12 12 LYS H H 12 8.254 8.254 7.586 0.668 17893 1616 1 6 . 1 1 13 13 LYS N N 13 116.385 116.385 115.200 1.185 17893 1617 1 6 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.385 -0.088 17893 1618 1 6 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.692 -0.661 17893 1619 1 6 . 1 1 13 13 LYS CB C 13 31.549 31.549 33.188 -1.639 17893 1620 1 6 . 1 1 13 13 LYS H H 13 7.809 7.809 7.562 0.247 17893 1621 1 6 . 1 1 14 14 LYS N N 14 115.317 115.317 117.194 -1.877 17893 1622 1 6 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.927 0.055 17893 1623 1 6 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.691 0.197 17893 1624 1 6 . 1 1 14 14 LYS CB C 14 28.286 28.286 30.115 -1.829 17893 1625 1 6 . 1 1 14 14 LYS H H 14 8.069 8.069 7.935 0.134 17893 1626 1 6 . 1 1 15 15 ILE N N 15 118.431 118.431 121.178 -2.747 17893 1627 1 6 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.122 0.501 17893 1628 1 6 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.410 -0.211 17893 1629 1 6 . 1 1 15 15 ILE CB C 15 40.896 40.896 37.981 2.915 17893 1630 1 6 . 1 1 15 15 ILE H H 15 7.569 7.569 8.066 -0.497 17893 1631 1 6 . 1 1 16 16 SER N N 16 125.034 125.034 122.913 2.121 17893 1632 1 6 . 1 1 16 16 SER HA H 16 4.585 4.585 4.666 -0.081 17893 1633 1 6 . 1 1 16 16 SER CA C 16 57.004 57.004 57.484 -0.480 17893 1634 1 6 . 1 1 16 16 SER CB C 16 64.914 64.914 64.712 0.202 17893 1635 1 6 . 1 1 16 16 SER H H 16 9.440 9.440 9.553 -0.113 17893 1636 1 6 . 1 1 17 17 GLN N N 17 120.228 120.228 122.041 -1.813 17893 1637 1 6 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.052 -0.265 17893 1638 1 6 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.271 2.245 17893 1639 1 6 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.803 0.248 17893 1640 1 6 . 1 1 17 17 GLN H H 17 9.527 9.527 8.998 0.529 17893 1641 1 6 . 1 1 18 18 SER N N 18 112.979 112.979 115.387 -2.408 17893 1642 1 6 . 1 1 18 18 SER HA H 18 4.531 4.531 4.032 0.499 17893 1643 1 6 . 1 1 18 18 SER CA C 18 62.872 62.872 62.203 0.669 17893 1644 1 6 . 1 1 18 18 SER CB C 18 65.338 65.338 62.444 2.894 17893 1645 1 6 . 1 1 18 18 SER H H 18 8.949 8.949 7.943 1.006 17893 1646 1 6 . 1 1 19 19 GLU N N 19 124.147 124.147 121.844 2.303 17893 1647 1 6 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.129 -0.022 17893 1648 1 6 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.187 0.426 17893 1649 1 6 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.954 0.585 17893 1650 1 6 . 1 1 19 19 GLU H H 19 8.331 8.331 7.544 0.787 17893 1651 1 6 . 1 1 20 20 LEU N N 20 119.943 119.943 122.479 -2.536 17893 1652 1 6 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.916 0.238 17893 1653 1 6 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.758 -0.184 17893 1654 1 6 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.356 -0.351 17893 1655 1 6 . 1 1 20 20 LEU H H 20 8.314 8.314 7.946 0.368 17893 1656 1 6 . 1 1 21 21 ALA N N 21 119.877 119.877 121.240 -1.363 17893 1657 1 6 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.934 -0.210 17893 1658 1 6 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.268 0.186 17893 1659 1 6 . 1 1 21 21 ALA CB C 21 16.861 16.861 17.954 -1.093 17893 1660 1 6 . 1 1 21 21 ALA H H 21 8.588 8.588 8.660 -0.072 17893 1661 1 6 . 1 1 22 22 ALA N N 22 117.330 117.330 121.686 -4.356 17893 1662 1 6 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.974 0.290 17893 1663 1 6 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.705 -0.096 17893 1664 1 6 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.483 -0.827 17893 1665 1 6 . 1 1 22 22 ALA H H 22 7.813 7.813 7.429 0.384 17893 1666 1 6 . 1 1 23 23 LEU N N 23 118.586 118.586 118.762 -0.176 17893 1667 1 6 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.632 0.329 17893 1668 1 6 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.288 -0.188 17893 1669 1 6 . 1 1 23 23 LEU CB C 23 41.424 41.424 40.994 0.430 17893 1670 1 6 . 1 1 23 23 LEU H H 23 7.538 7.538 8.523 -0.985 17893 1671 1 6 . 1 1 24 24 LEU N N 24 114.488 114.488 116.853 -2.365 17893 1672 1 6 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.278 -0.014 17893 1673 1 6 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.884 -1.090 17893 1674 1 6 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.734 1.699 17893 1675 1 6 . 1 1 24 24 LEU H H 24 7.449 7.449 8.364 -0.915 17893 1676 1 6 . 1 1 25 25 GLU N N 25 114.895 114.895 115.958 -1.063 17893 1677 1 6 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.026 -0.060 17893 1678 1 6 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.354 -0.206 17893 1679 1 6 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.287 -0.294 17893 1680 1 6 . 1 1 25 25 GLU H H 25 8.029 8.029 7.555 0.474 17893 1681 1 6 . 1 1 26 26 VAL N N 26 109.738 109.738 112.140 -2.402 17893 1682 1 6 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.607 0.283 17893 1683 1 6 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.225 -0.944 17893 1684 1 6 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.556 -0.261 17893 1685 1 6 . 1 1 26 26 VAL H H 26 7.989 7.989 7.982 0.007 17893 1686 1 6 . 1 1 27 27 SER N N 27 114.381 114.381 115.742 -1.361 17893 1687 1 6 . 1 1 27 27 SER HA H 27 4.644 4.644 4.385 0.259 17893 1688 1 6 . 1 1 27 27 SER CA C 27 56.445 56.445 58.566 -2.121 17893 1689 1 6 . 1 1 27 27 SER CB C 27 62.251 62.251 63.946 -1.695 17893 1690 1 6 . 1 1 27 27 SER H H 27 8.618 8.618 8.627 -0.009 17893 1691 1 6 . 1 1 28 28 ARG N N 28 115.323 115.323 123.645 -8.322 17893 1692 1 6 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.916 -0.168 17893 1693 1 6 . 1 1 28 28 ARG CA C 28 59.919 59.919 59.773 0.146 17893 1694 1 6 . 1 1 28 28 ARG CB C 28 29.050 29.050 30.099 -1.049 17893 1695 1 6 . 1 1 28 28 ARG H H 28 8.242 8.242 8.836 -0.594 17893 1696 1 6 . 1 1 29 29 GLN N N 29 117.343 117.343 115.604 1.739 17893 1697 1 6 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.101 0.073 17893 1698 1 6 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.113 -0.028 17893 1699 1 6 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.481 0.087 17893 1700 1 6 . 1 1 29 29 GLN H H 29 8.827 8.827 8.890 -0.063 17893 1701 1 6 . 1 1 30 30 THR N N 30 119.996 119.996 116.876 3.120 17893 1702 1 6 . 1 1 30 30 THR HA H 30 4.434 4.434 4.159 0.275 17893 1703 1 6 . 1 1 30 30 THR CA C 30 67.621 67.621 66.257 1.364 17893 1704 1 6 . 1 1 30 30 THR CB C 30 66.513 66.513 68.512 -1.999 17893 1705 1 6 . 1 1 30 30 THR H H 30 8.132 8.132 7.633 0.499 17893 1706 1 6 . 1 1 31 31 ILE N N 31 118.828 118.828 122.006 -3.178 17893 1707 1 6 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.774 0.012 17893 1708 1 6 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.474 -2.445 17893 1709 1 6 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.768 -1.691 17893 1710 1 6 . 1 1 31 31 ILE H H 31 7.163 7.163 7.643 -0.480 17893 1711 1 6 . 1 1 32 32 ASN N N 32 118.098 118.098 118.631 -0.533 17893 1712 1 6 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.389 -0.034 17893 1713 1 6 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.746 0.508 17893 1714 1 6 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.488 0.760 17893 1715 1 6 . 1 1 32 32 ASN H H 32 8.656 8.656 8.392 0.264 17893 1716 1 6 . 1 1 33 33 GLY N N 33 124.952 124.952 107.067 17.885 17893 1717 1 6 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.278 0.862 17893 1718 1 6 . 1 1 33 33 GLY H H 33 8.643 8.643 8.335 0.308 17893 1719 1 6 . 1 1 34 34 ILE N N 34 122.233 122.233 122.845 -0.612 17893 1720 1 6 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.194 0.110 17893 1721 1 6 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.323 0.481 17893 1722 1 6 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.569 -0.283 17893 1723 1 6 . 1 1 34 34 ILE H H 34 8.203 8.203 7.727 0.476 17893 1724 1 6 . 1 1 35 35 GLU N N 35 120.686 120.686 115.514 5.172 17893 1725 1 6 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.294 -0.080 17893 1726 1 6 . 1 1 35 35 GLU CA C 35 59.692 59.692 56.340 3.352 17893 1727 1 6 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.404 -0.552 17893 1728 1 6 . 1 1 35 35 GLU H H 35 8.575 8.575 8.128 0.447 17893 1729 1 6 . 1 1 36 36 LYS N N 36 116.029 116.029 119.372 -3.343 17893 1730 1 6 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.430 0.091 17893 1731 1 6 . 1 1 36 36 LYS CA C 36 55.507 55.507 54.768 0.739 17893 1732 1 6 . 1 1 36 36 LYS CB C 36 31.939 31.939 35.506 -3.567 17893 1733 1 6 . 1 1 36 36 LYS H H 36 8.107 8.107 7.268 0.839 17893 1734 1 6 . 1 1 37 37 ASN N N 37 114.692 114.692 120.878 -6.186 17893 1735 1 6 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.535 0.214 17893 1736 1 6 . 1 1 37 37 ASN CA C 37 54.788 54.788 54.183 0.605 17893 1737 1 6 . 1 1 37 37 ASN CB C 37 36.949 36.949 36.903 0.046 17893 1738 1 6 . 1 1 37 37 ASN H H 37 8.240 8.240 8.960 -0.720 17893 1739 1 6 . 1 1 38 38 LYS N N 38 115.098 115.098 119.279 -4.181 17893 1740 1 6 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.206 0.230 17893 1741 1 6 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.575 -2.397 17893 1742 1 6 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.174 0.062 17893 1743 1 6 . 1 1 38 38 LYS H H 38 8.727 8.727 8.373 0.354 17893 1744 1 6 . 1 1 39 39 TYR N N 39 117.011 117.011 113.830 3.181 17893 1745 1 6 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.808 -0.179 17893 1746 1 6 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.684 -0.125 17893 1747 1 6 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.186 0.717 17893 1748 1 6 . 1 1 39 39 TYR H H 39 7.087 7.087 7.102 -0.015 17893 1749 1 6 . 1 1 40 40 ASN N N 40 123.595 123.595 119.763 3.832 17893 1750 1 6 . 1 1 40 40 ASN HA H 40 5.253 5.253 5.011 0.242 17893 1751 1 6 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.017 -1.245 17893 1752 1 6 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.791 -1.315 17893 1753 1 6 . 1 1 40 40 ASN H H 40 8.842 8.842 8.540 0.302 17893 1754 1 6 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.541 -0.732 17893 1755 1 6 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.447 0.082 17893 1756 1 6 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.183 -0.622 17893 1757 1 6 . 1 1 42 42 SER N N 42 125.580 125.580 114.429 11.151 17893 1758 1 6 . 1 1 42 42 SER HA H 42 4.581 4.581 4.268 0.313 17893 1759 1 6 . 1 1 42 42 SER CA C 42 57.380 57.380 57.563 -0.183 17893 1760 1 6 . 1 1 42 42 SER CB C 42 64.562 64.562 64.036 0.526 17893 1761 1 6 . 1 1 42 42 SER H H 42 8.033 8.033 8.052 -0.019 17893 1762 1 6 . 1 1 43 43 LEU N N 43 120.759 120.759 123.256 -2.497 17893 1763 1 6 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.999 -0.085 17893 1764 1 6 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.407 -0.062 17893 1765 1 6 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.301 -0.445 17893 1766 1 6 . 1 1 43 43 LEU H H 43 9.289 9.289 8.702 0.587 17893 1767 1 6 . 1 1 44 44 GLN N N 44 115.948 115.948 117.825 -1.877 17893 1768 1 6 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.042 -0.315 17893 1769 1 6 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.317 0.819 17893 1770 1 6 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.237 0.013 17893 1771 1 6 . 1 1 44 44 GLN H H 44 8.906 8.906 8.629 0.277 17893 1772 1 6 . 1 1 45 45 LEU N N 45 119.419 119.419 120.350 -0.931 17893 1773 1 6 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.926 -0.001 17893 1774 1 6 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.697 -3.093 17893 1775 1 6 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.638 -1.011 17893 1776 1 6 . 1 1 45 45 LEU H H 45 8.078 8.078 7.679 0.399 17893 1777 1 6 . 1 1 46 46 ALA N N 46 120.544 120.544 122.334 -1.790 17893 1778 1 6 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.685 0.363 17893 1779 1 6 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.204 0.540 17893 1780 1 6 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.827 1.906 17893 1781 1 6 . 1 1 46 46 ALA H H 46 8.518 8.518 8.753 -0.235 17893 1782 1 6 . 1 1 47 47 LEU N N 47 116.461 116.461 118.862 -2.401 17893 1783 1 6 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.877 0.338 17893 1784 1 6 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.119 -0.618 17893 1785 1 6 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.624 -0.539 17893 1786 1 6 . 1 1 47 47 LEU H H 47 8.676 8.676 8.437 0.239 17893 1787 1 6 . 1 1 48 48 LYS N N 48 120.958 120.958 120.272 0.686 17893 1788 1 6 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.032 -0.432 17893 1789 1 6 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.048 -0.119 17893 1790 1 6 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.408 -0.140 17893 1791 1 6 . 1 1 48 48 LYS H H 48 8.036 8.036 8.367 -0.331 17893 1792 1 6 . 1 1 49 49 ILE N N 49 120.407 120.407 120.434 -0.027 17893 1793 1 6 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.867 -0.268 17893 1794 1 6 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.806 1.396 17893 1795 1 6 . 1 1 49 49 ILE CB C 49 37.653 37.653 38.046 -0.393 17893 1796 1 6 . 1 1 49 49 ILE H H 49 8.779 8.779 8.540 0.239 17893 1797 1 6 . 1 1 50 50 ALA N N 50 120.480 120.480 123.621 -3.141 17893 1798 1 6 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.204 -0.125 17893 1799 1 6 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.083 0.541 17893 1800 1 6 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.457 -0.452 17893 1801 1 6 . 1 1 50 50 ALA H H 50 8.173 8.173 8.672 -0.499 17893 1802 1 6 . 1 1 51 51 TYR N N 51 117.118 117.118 120.546 -3.428 17893 1803 1 6 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.989 0.376 17893 1804 1 6 . 1 1 51 51 TYR CA C 51 61.433 61.433 61.963 -0.530 17893 1805 1 6 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.328 -0.105 17893 1806 1 6 . 1 1 51 51 TYR H H 51 8.169 8.169 8.602 -0.433 17893 1807 1 6 . 1 1 52 52 TYR N N 52 118.548 118.548 115.602 2.946 17893 1808 1 6 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.029 0.292 17893 1809 1 6 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.593 1.377 17893 1810 1 6 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.591 -1.113 17893 1811 1 6 . 1 1 52 52 TYR H H 52 9.062 9.062 8.074 0.988 17893 1812 1 6 . 1 1 53 53 LEU N N 53 115.380 115.380 116.551 -1.171 17893 1813 1 6 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.029 0.508 17893 1814 1 6 . 1 1 53 53 LEU CA C 53 54.144 54.144 57.021 -2.877 17893 1815 1 6 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.235 -2.139 17893 1816 1 6 . 1 1 53 53 LEU H H 53 8.394 8.394 8.463 -0.069 17893 1817 1 6 . 1 1 54 54 ASN N N 54 122.105 122.105 114.998 7.107 17893 1818 1 6 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.396 0.060 17893 1819 1 6 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.230 -0.439 17893 1820 1 6 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.854 -0.096 17893 1821 1 6 . 1 1 54 54 ASN H H 54 8.091 8.091 8.595 -0.504 17893 1822 1 6 . 1 1 55 55 THR N N 55 114.964 114.964 116.526 -1.562 17893 1823 1 6 . 1 1 55 55 THR HA H 55 4.947 4.947 4.798 0.149 17893 1824 1 6 . 1 1 55 55 THR CA C 55 60.062 60.062 60.640 -0.578 17893 1825 1 6 . 1 1 55 55 THR CB C 55 74.945 74.945 70.210 4.735 17893 1826 1 6 . 1 1 55 55 THR H H 55 8.248 8.248 7.572 0.676 17893 1827 1 6 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.538 0.072 17893 1828 1 6 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.731 0.111 17893 1829 1 6 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.611 -0.665 17893 1830 1 6 . 1 1 57 57 LEU N N 57 127.597 127.597 125.248 2.349 17893 1831 1 6 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.128 -0.057 17893 1832 1 6 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.824 0.898 17893 1833 1 6 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.131 -0.638 17893 1834 1 6 . 1 1 57 57 LEU H H 57 9.958 9.958 8.623 1.335 17893 1835 1 6 . 1 1 58 58 GLU N N 58 123.260 123.260 118.982 4.278 17893 1836 1 6 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.322 0.564 17893 1837 1 6 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.137 -0.620 17893 1838 1 6 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.063 -0.005 17893 1839 1 6 . 1 1 58 58 GLU H H 58 9.353 9.353 8.832 0.521 17893 1840 1 6 . 1 1 59 59 ASP N N 59 117.681 117.681 119.030 -1.349 17893 1841 1 6 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.428 0.226 17893 1842 1 6 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.485 -0.862 17893 1843 1 6 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.011 -1.020 17893 1844 1 6 . 1 1 59 59 ASP H H 59 8.012 8.012 7.766 0.246 17893 1845 1 6 . 1 1 60 60 ILE N N 60 119.519 119.519 116.478 3.041 17893 1846 1 6 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.748 -0.205 17893 1847 1 6 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.488 0.418 17893 1848 1 6 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.000 0.416 17893 1849 1 6 . 1 1 60 60 ILE H H 60 8.210 8.210 7.157 1.053 17893 1850 1 6 . 1 1 61 61 PHE N N 61 116.030 116.030 118.210 -2.180 17893 1851 1 6 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.563 -0.117 17893 1852 1 6 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.772 0.049 17893 1853 1 6 . 1 1 61 61 PHE CB C 61 41.965 41.965 40.093 1.872 17893 1854 1 6 . 1 1 61 61 PHE H H 61 8.530 8.530 8.803 -0.273 17893 1855 1 6 . 1 1 62 62 GLN N N 62 116.829 116.829 122.297 -5.468 17893 1856 1 6 . 1 1 62 62 GLN HA H 62 5.057 5.057 5.098 -0.041 17893 1857 1 6 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.742 0.247 17893 1858 1 6 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.362 0.466 17893 1859 1 6 . 1 1 62 62 GLN H H 62 8.737 8.737 9.127 -0.390 17893 1860 1 6 . 1 1 63 63 TRP N N 63 125.623 125.623 123.378 2.245 17893 1861 1 6 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.079 0.128 17893 1862 1 6 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.111 0.420 17893 1863 1 6 . 1 1 63 63 TRP CB C 63 30.704 30.704 29.916 0.787 17893 1864 1 6 . 1 1 63 63 TRP H H 63 9.464 9.464 9.094 0.370 17893 1865 1 6 . 1 1 64 64 GLN N N 64 127.029 127.029 118.375 8.654 17893 1866 1 6 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.234 -0.036 17893 1867 1 6 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.279 -0.777 17893 1868 1 6 . 1 1 64 64 GLN CB C 64 30.673 30.673 30.198 0.475 17893 1869 1 6 . 1 1 64 64 GLN H H 64 7.977 7.977 8.150 -0.173 17893 1870 1 6 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.458 0.222 17893 1871 1 6 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.425 -1.770 17893 1872 1 6 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.076 -0.576 17893 1873 1 7 . 1 1 2 2 ILE N N 2 123.389 123.389 121.193 2.196 17893 1874 1 7 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.943 0.178 17893 1875 1 7 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.160 1.013 17893 1876 1 7 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.423 0.709 17893 1877 1 7 . 1 1 2 2 ILE H H 2 9.112 9.112 7.678 1.434 17893 1878 1 7 . 1 1 3 3 ILE N N 3 108.863 108.863 129.030 -20.167 17893 1879 1 7 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.095 0.338 17893 1880 1 7 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.775 -0.621 17893 1881 1 7 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.021 -0.366 17893 1882 1 7 . 1 1 3 3 ILE H H 3 9.418 9.418 9.183 0.235 17893 1883 1 7 . 1 1 4 4 ASN N N 4 123.919 123.919 126.115 -2.196 17893 1884 1 7 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.688 0.944 17893 1885 1 7 . 1 1 4 4 ASN CA C 4 51.378 51.378 51.861 -0.483 17893 1886 1 7 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.088 1.949 17893 1887 1 7 . 1 1 4 4 ASN H H 4 9.056 9.056 8.801 0.255 17893 1888 1 7 . 1 1 5 5 ASN N N 5 120.944 120.944 123.479 -2.535 17893 1889 1 7 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.779 0.664 17893 1890 1 7 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.992 -1.577 17893 1891 1 7 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.915 0.898 17893 1892 1 7 . 1 1 5 5 ASN H H 5 9.383 9.383 9.060 0.323 17893 1893 1 7 . 1 1 6 6 LEU N N 6 120.594 120.594 123.157 -2.563 17893 1894 1 7 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.876 -0.109 17893 1895 1 7 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.388 0.311 17893 1896 1 7 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.557 -0.752 17893 1897 1 7 . 1 1 6 6 LEU H H 6 8.531 8.531 9.161 -0.630 17893 1898 1 7 . 1 1 7 7 LYS N N 7 118.212 118.212 117.980 0.232 17893 1899 1 7 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.051 -0.118 17893 1900 1 7 . 1 1 7 7 LYS CA C 7 60.263 60.263 58.921 1.342 17893 1901 1 7 . 1 1 7 7 LYS CB C 7 32.303 32.303 30.926 1.377 17893 1902 1 7 . 1 1 7 7 LYS H H 7 8.933 8.933 8.330 0.603 17893 1903 1 7 . 1 1 8 8 LEU N N 8 116.414 116.414 120.881 -4.467 17893 1904 1 7 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.055 0.118 17893 1905 1 7 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.416 -0.026 17893 1906 1 7 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.858 0.169 17893 1907 1 7 . 1 1 8 8 LEU H H 8 7.667 7.667 7.546 0.121 17893 1908 1 7 . 1 1 9 9 ILE N N 9 119.134 119.134 118.921 0.213 17893 1909 1 7 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.586 0.228 17893 1910 1 7 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.315 -2.459 17893 1911 1 7 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.596 -1.134 17893 1912 1 7 . 1 1 9 9 ILE H H 9 8.226 8.226 8.688 -0.462 17893 1913 1 7 . 1 1 10 10 ARG N N 10 120.162 120.162 120.176 -0.014 17893 1914 1 7 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.832 0.069 17893 1915 1 7 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.019 0.708 17893 1916 1 7 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.234 -1.735 17893 1917 1 7 . 1 1 10 10 ARG H H 10 9.260 9.260 8.890 0.370 17893 1918 1 7 . 1 1 11 11 GLU N N 11 115.948 115.948 118.047 -2.099 17893 1919 1 7 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.085 0.088 17893 1920 1 7 . 1 1 11 11 GLU CA C 11 59.386 59.386 59.067 0.319 17893 1921 1 7 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.016 -0.102 17893 1922 1 7 . 1 1 11 11 GLU H H 11 8.701 8.701 7.994 0.707 17893 1923 1 7 . 1 1 12 12 LYS N N 12 122.900 122.900 121.137 1.763 17893 1924 1 7 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.031 0.191 17893 1925 1 7 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.629 -0.213 17893 1926 1 7 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.562 -0.565 17893 1927 1 7 . 1 1 12 12 LYS H H 12 8.254 8.254 7.898 0.356 17893 1928 1 7 . 1 1 13 13 LYS N N 13 116.385 116.385 115.907 0.478 17893 1929 1 7 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.325 -0.028 17893 1930 1 7 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.968 -0.937 17893 1931 1 7 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.189 -0.640 17893 1932 1 7 . 1 1 13 13 LYS H H 13 7.809 7.809 7.843 -0.034 17893 1933 1 7 . 1 1 14 14 LYS N N 14 115.317 115.317 114.762 0.555 17893 1934 1 7 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.925 0.057 17893 1935 1 7 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.850 0.038 17893 1936 1 7 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.318 -1.032 17893 1937 1 7 . 1 1 14 14 LYS H H 14 8.069 8.069 7.824 0.245 17893 1938 1 7 . 1 1 15 15 ILE N N 15 118.431 118.431 120.431 -2.000 17893 1939 1 7 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.114 0.509 17893 1940 1 7 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.945 -0.746 17893 1941 1 7 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.742 2.154 17893 1942 1 7 . 1 1 15 15 ILE H H 15 7.569 7.569 8.018 -0.449 17893 1943 1 7 . 1 1 16 16 SER N N 16 125.034 125.034 122.268 2.766 17893 1944 1 7 . 1 1 16 16 SER HA H 16 4.585 4.585 4.718 -0.133 17893 1945 1 7 . 1 1 16 16 SER CA C 16 57.004 57.004 57.848 -0.844 17893 1946 1 7 . 1 1 16 16 SER CB C 16 64.914 64.914 64.449 0.465 17893 1947 1 7 . 1 1 16 16 SER H H 16 9.440 9.440 8.272 1.168 17893 1948 1 7 . 1 1 17 17 GLN N N 17 120.228 120.228 121.651 -1.423 17893 1949 1 7 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.965 -0.178 17893 1950 1 7 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.627 1.889 17893 1951 1 7 . 1 1 17 17 GLN CB C 17 29.051 29.051 27.718 1.333 17893 1952 1 7 . 1 1 17 17 GLN H H 17 9.527 9.527 8.998 0.529 17893 1953 1 7 . 1 1 18 18 SER N N 18 112.979 112.979 116.402 -3.423 17893 1954 1 7 . 1 1 18 18 SER HA H 18 4.531 4.531 4.068 0.463 17893 1955 1 7 . 1 1 18 18 SER CA C 18 62.872 62.872 61.779 1.093 17893 1956 1 7 . 1 1 18 18 SER CB C 18 65.338 65.338 62.032 3.307 17893 1957 1 7 . 1 1 18 18 SER H H 18 8.949 8.949 8.646 0.303 17893 1958 1 7 . 1 1 19 19 GLU N N 19 124.147 124.147 121.984 2.163 17893 1959 1 7 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.082 0.025 17893 1960 1 7 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.877 -0.264 17893 1961 1 7 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.733 0.806 17893 1962 1 7 . 1 1 19 19 GLU H H 19 8.331 8.331 8.538 -0.207 17893 1963 1 7 . 1 1 20 20 LEU N N 20 119.943 119.943 122.239 -2.296 17893 1964 1 7 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.963 0.191 17893 1965 1 7 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.740 -0.167 17893 1966 1 7 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.332 -0.327 17893 1967 1 7 . 1 1 20 20 LEU H H 20 8.314 8.314 7.747 0.567 17893 1968 1 7 . 1 1 21 21 ALA N N 21 119.877 119.877 121.785 -1.908 17893 1969 1 7 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.936 -0.212 17893 1970 1 7 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.235 0.219 17893 1971 1 7 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.040 -1.179 17893 1972 1 7 . 1 1 21 21 ALA H H 21 8.588 8.588 8.799 -0.211 17893 1973 1 7 . 1 1 22 22 ALA N N 22 117.330 117.330 121.900 -4.570 17893 1974 1 7 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.995 0.269 17893 1975 1 7 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.732 -0.123 17893 1976 1 7 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.552 -0.896 17893 1977 1 7 . 1 1 22 22 ALA H H 22 7.813 7.813 8.285 -0.472 17893 1978 1 7 . 1 1 23 23 LEU N N 23 118.586 118.586 118.060 0.526 17893 1979 1 7 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.613 0.348 17893 1980 1 7 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.287 -0.187 17893 1981 1 7 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.266 0.158 17893 1982 1 7 . 1 1 23 23 LEU H H 23 7.538 7.538 8.437 -0.899 17893 1983 1 7 . 1 1 24 24 LEU N N 24 114.488 114.488 115.554 -1.066 17893 1984 1 7 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.413 -0.149 17893 1985 1 7 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.339 -0.545 17893 1986 1 7 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.202 1.231 17893 1987 1 7 . 1 1 24 24 LEU H H 24 7.449 7.449 8.078 -0.629 17893 1988 1 7 . 1 1 25 25 GLU N N 25 114.895 114.895 116.520 -1.625 17893 1989 1 7 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.068 -0.102 17893 1990 1 7 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.357 -0.209 17893 1991 1 7 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.112 -0.119 17893 1992 1 7 . 1 1 25 25 GLU H H 25 8.029 8.029 8.020 0.009 17893 1993 1 7 . 1 1 26 26 VAL N N 26 109.738 109.738 111.854 -2.116 17893 1994 1 7 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.710 0.180 17893 1995 1 7 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.301 -1.020 17893 1996 1 7 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.887 0.408 17893 1997 1 7 . 1 1 26 26 VAL H H 26 7.989 7.989 8.029 -0.040 17893 1998 1 7 . 1 1 27 27 SER N N 27 114.381 114.381 117.174 -2.793 17893 1999 1 7 . 1 1 27 27 SER HA H 27 4.644 4.644 4.531 0.113 17893 2000 1 7 . 1 1 27 27 SER CA C 27 56.445 56.445 58.339 -1.894 17893 2001 1 7 . 1 1 27 27 SER CB C 27 62.251 62.251 64.060 -1.809 17893 2002 1 7 . 1 1 27 27 SER H H 27 8.618 8.618 8.472 0.146 17893 2003 1 7 . 1 1 28 28 ARG N N 28 115.323 115.323 124.078 -8.755 17893 2004 1 7 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.925 -0.177 17893 2005 1 7 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.728 -0.809 17893 2006 1 7 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.748 -0.698 17893 2007 1 7 . 1 1 28 28 ARG H H 28 8.242 8.242 8.933 -0.691 17893 2008 1 7 . 1 1 29 29 GLN N N 29 117.343 117.343 116.940 0.403 17893 2009 1 7 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.124 0.050 17893 2010 1 7 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.920 0.165 17893 2011 1 7 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.650 -0.082 17893 2012 1 7 . 1 1 29 29 GLN H H 29 8.827 8.827 8.905 -0.078 17893 2013 1 7 . 1 1 30 30 THR N N 30 119.996 119.996 117.611 2.385 17893 2014 1 7 . 1 1 30 30 THR HA H 30 4.434 4.434 4.165 0.269 17893 2015 1 7 . 1 1 30 30 THR CA C 30 67.621 67.621 65.518 2.103 17893 2016 1 7 . 1 1 30 30 THR CB C 30 66.513 66.513 68.498 -1.985 17893 2017 1 7 . 1 1 30 30 THR H H 30 8.132 8.132 7.689 0.443 17893 2018 1 7 . 1 1 31 31 ILE N N 31 118.828 118.828 122.494 -3.666 17893 2019 1 7 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.732 0.054 17893 2020 1 7 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.444 -2.415 17893 2021 1 7 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.665 -1.588 17893 2022 1 7 . 1 1 31 31 ILE H H 31 7.163 7.163 7.568 -0.405 17893 2023 1 7 . 1 1 32 32 ASN N N 32 118.098 118.098 119.082 -0.984 17893 2024 1 7 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.629 -0.274 17893 2025 1 7 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.109 1.145 17893 2026 1 7 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.306 0.942 17893 2027 1 7 . 1 1 32 32 ASN H H 32 8.656 8.656 9.168 -0.512 17893 2028 1 7 . 1 1 33 33 GLY N N 33 124.952 124.952 109.228 15.724 17893 2029 1 7 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.914 0.225 17893 2030 1 7 . 1 1 33 33 GLY H H 33 8.643 8.643 8.537 0.106 17893 2031 1 7 . 1 1 34 34 ILE N N 34 122.233 122.233 123.225 -0.992 17893 2032 1 7 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.961 0.343 17893 2033 1 7 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.628 0.176 17893 2034 1 7 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.319 -0.033 17893 2035 1 7 . 1 1 34 34 ILE H H 34 8.203 8.203 7.885 0.318 17893 2036 1 7 . 1 1 35 35 GLU N N 35 120.686 120.686 118.018 2.668 17893 2037 1 7 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.068 0.146 17893 2038 1 7 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.051 0.641 17893 2039 1 7 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.511 -0.659 17893 2040 1 7 . 1 1 35 35 GLU H H 35 8.575 8.575 8.600 -0.025 17893 2041 1 7 . 1 1 36 36 LYS N N 36 116.029 116.029 119.558 -3.529 17893 2042 1 7 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.058 0.463 17893 2043 1 7 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.942 -3.435 17893 2044 1 7 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.194 -1.255 17893 2045 1 7 . 1 1 36 36 LYS H H 36 8.107 8.107 8.621 -0.514 17893 2046 1 7 . 1 1 37 37 ASN N N 37 114.692 114.692 109.420 5.272 17893 2047 1 7 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.727 0.022 17893 2048 1 7 . 1 1 37 37 ASN CA C 37 54.788 54.788 52.905 1.883 17893 2049 1 7 . 1 1 37 37 ASN CB C 37 36.949 36.949 38.859 -1.910 17893 2050 1 7 . 1 1 37 37 ASN H H 37 8.240 8.240 7.903 0.337 17893 2051 1 7 . 1 1 38 38 LYS N N 38 115.098 115.098 120.821 -5.723 17893 2052 1 7 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.135 0.301 17893 2053 1 7 . 1 1 38 38 LYS CA C 38 56.178 56.178 59.312 -3.134 17893 2054 1 7 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.251 -0.015 17893 2055 1 7 . 1 1 38 38 LYS H H 38 8.727 8.727 8.387 0.340 17893 2056 1 7 . 1 1 39 39 TYR N N 39 117.011 117.011 112.264 4.747 17893 2057 1 7 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.842 -0.213 17893 2058 1 7 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.009 0.550 17893 2059 1 7 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.125 0.778 17893 2060 1 7 . 1 1 39 39 TYR H H 39 7.087 7.087 7.312 -0.225 17893 2061 1 7 . 1 1 40 40 ASN N N 40 123.595 123.595 121.252 2.343 17893 2062 1 7 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.834 0.419 17893 2063 1 7 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.967 -2.195 17893 2064 1 7 . 1 1 40 40 ASN CB C 40 38.476 38.476 38.958 -0.482 17893 2065 1 7 . 1 1 40 40 ASN H H 40 8.842 8.842 8.542 0.300 17893 2066 1 7 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.576 -0.767 17893 2067 1 7 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.401 0.128 17893 2068 1 7 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.176 -0.615 17893 2069 1 7 . 1 1 42 42 SER N N 42 125.580 125.580 115.258 10.322 17893 2070 1 7 . 1 1 42 42 SER HA H 42 4.581 4.581 4.330 0.251 17893 2071 1 7 . 1 1 42 42 SER CA C 42 57.380 57.380 57.874 -0.494 17893 2072 1 7 . 1 1 42 42 SER CB C 42 64.562 64.562 63.711 0.851 17893 2073 1 7 . 1 1 42 42 SER H H 42 8.033 8.033 8.288 -0.255 17893 2074 1 7 . 1 1 43 43 LEU N N 43 120.759 120.759 125.654 -4.895 17893 2075 1 7 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.017 -0.103 17893 2076 1 7 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.620 -0.275 17893 2077 1 7 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.549 -0.693 17893 2078 1 7 . 1 1 43 43 LEU H H 43 9.289 9.289 8.694 0.595 17893 2079 1 7 . 1 1 44 44 GLN N N 44 115.948 115.948 118.982 -3.034 17893 2080 1 7 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.074 -0.347 17893 2081 1 7 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.186 0.950 17893 2082 1 7 . 1 1 44 44 GLN CB C 44 28.250 28.250 27.875 0.375 17893 2083 1 7 . 1 1 44 44 GLN H H 44 8.906 8.906 8.690 0.216 17893 2084 1 7 . 1 1 45 45 LEU N N 45 119.419 119.419 119.696 -0.277 17893 2085 1 7 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.046 -0.121 17893 2086 1 7 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.195 -2.591 17893 2087 1 7 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.281 -0.654 17893 2088 1 7 . 1 1 45 45 LEU H H 45 8.078 8.078 7.886 0.192 17893 2089 1 7 . 1 1 46 46 ALA N N 46 120.544 120.544 122.509 -1.965 17893 2090 1 7 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.892 0.156 17893 2091 1 7 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.282 0.462 17893 2092 1 7 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.962 1.771 17893 2093 1 7 . 1 1 46 46 ALA H H 46 8.518 8.518 8.814 -0.296 17893 2094 1 7 . 1 1 47 47 LEU N N 47 116.461 116.461 118.733 -2.272 17893 2095 1 7 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.827 0.388 17893 2096 1 7 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.062 -0.561 17893 2097 1 7 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.544 -0.458 17893 2098 1 7 . 1 1 47 47 LEU H H 47 8.676 8.676 8.694 -0.018 17893 2099 1 7 . 1 1 48 48 LYS N N 48 120.958 120.958 120.075 0.883 17893 2100 1 7 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.709 -0.109 17893 2101 1 7 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.740 0.189 17893 2102 1 7 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.247 0.021 17893 2103 1 7 . 1 1 48 48 LYS H H 48 8.036 8.036 7.988 0.048 17893 2104 1 7 . 1 1 49 49 ILE N N 49 120.407 120.407 120.392 0.015 17893 2105 1 7 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.889 -0.290 17893 2106 1 7 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.734 1.468 17893 2107 1 7 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.952 -0.299 17893 2108 1 7 . 1 1 49 49 ILE H H 49 8.779 8.779 8.458 0.321 17893 2109 1 7 . 1 1 50 50 ALA N N 50 120.480 120.480 123.090 -2.610 17893 2110 1 7 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.062 0.017 17893 2111 1 7 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.288 0.335 17893 2112 1 7 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.141 -0.136 17893 2113 1 7 . 1 1 50 50 ALA H H 50 8.173 8.173 8.582 -0.409 17893 2114 1 7 . 1 1 51 51 TYR N N 51 117.118 117.118 120.375 -3.257 17893 2115 1 7 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.989 0.376 17893 2116 1 7 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.130 -0.697 17893 2117 1 7 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.389 -0.166 17893 2118 1 7 . 1 1 51 51 TYR H H 51 8.169 8.169 8.358 -0.189 17893 2119 1 7 . 1 1 52 52 TYR N N 52 118.548 118.548 116.555 1.993 17893 2120 1 7 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.072 0.249 17893 2121 1 7 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.017 1.952 17893 2122 1 7 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.302 -0.824 17893 2123 1 7 . 1 1 52 52 TYR H H 52 9.062 9.062 8.068 0.994 17893 2124 1 7 . 1 1 53 53 LEU N N 53 115.380 115.380 116.964 -1.584 17893 2125 1 7 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.087 0.450 17893 2126 1 7 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.289 -2.145 17893 2127 1 7 . 1 1 53 53 LEU CB C 53 40.096 40.096 41.996 -1.900 17893 2128 1 7 . 1 1 53 53 LEU H H 53 8.394 8.394 8.320 0.074 17893 2129 1 7 . 1 1 54 54 ASN N N 54 122.105 122.105 113.336 8.769 17893 2130 1 7 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.327 0.129 17893 2131 1 7 . 1 1 54 54 ASN CA C 54 53.791 53.791 53.881 -0.090 17893 2132 1 7 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.137 0.621 17893 2133 1 7 . 1 1 54 54 ASN H H 54 8.091 8.091 7.581 0.510 17893 2134 1 7 . 1 1 55 55 THR N N 55 114.964 114.964 115.571 -0.607 17893 2135 1 7 . 1 1 55 55 THR HA H 55 4.947 4.947 4.744 0.203 17893 2136 1 7 . 1 1 55 55 THR CA C 55 60.062 60.062 59.690 0.372 17893 2137 1 7 . 1 1 55 55 THR CB C 55 74.945 74.945 70.915 4.030 17893 2138 1 7 . 1 1 55 55 THR H H 55 8.248 8.248 8.238 0.010 17893 2139 1 7 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.525 0.085 17893 2140 1 7 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.508 0.334 17893 2141 1 7 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.507 -0.561 17893 2142 1 7 . 1 1 57 57 LEU N N 57 127.597 127.597 125.421 2.176 17893 2143 1 7 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.109 -0.038 17893 2144 1 7 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.797 0.925 17893 2145 1 7 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.093 -0.600 17893 2146 1 7 . 1 1 57 57 LEU H H 57 9.958 9.958 8.611 1.347 17893 2147 1 7 . 1 1 58 58 GLU N N 58 123.260 123.260 119.155 4.105 17893 2148 1 7 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.331 0.555 17893 2149 1 7 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.070 -0.553 17893 2150 1 7 . 1 1 58 58 GLU CB C 58 29.058 29.058 28.991 0.067 17893 2151 1 7 . 1 1 58 58 GLU H H 58 9.353 9.353 8.783 0.570 17893 2152 1 7 . 1 1 59 59 ASP N N 59 117.681 117.681 118.981 -1.300 17893 2153 1 7 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.431 0.223 17893 2154 1 7 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.381 -0.758 17893 2155 1 7 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.898 -0.907 17893 2156 1 7 . 1 1 59 59 ASP H H 59 8.012 8.012 7.871 0.141 17893 2157 1 7 . 1 1 60 60 ILE N N 60 119.519 119.519 116.562 2.957 17893 2158 1 7 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.786 -0.243 17893 2159 1 7 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.533 0.373 17893 2160 1 7 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.066 0.350 17893 2161 1 7 . 1 1 60 60 ILE H H 60 8.210 8.210 7.164 1.046 17893 2162 1 7 . 1 1 61 61 PHE N N 61 116.030 116.030 117.540 -1.510 17893 2163 1 7 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.750 -0.304 17893 2164 1 7 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.858 -0.037 17893 2165 1 7 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.919 0.046 17893 2166 1 7 . 1 1 61 61 PHE H H 61 8.530 8.530 8.793 -0.263 17893 2167 1 7 . 1 1 62 62 GLN N N 62 116.829 116.829 119.398 -2.569 17893 2168 1 7 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.897 0.160 17893 2169 1 7 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.551 0.438 17893 2170 1 7 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.775 -0.947 17893 2171 1 7 . 1 1 62 62 GLN H H 62 8.737 8.737 8.941 -0.204 17893 2172 1 7 . 1 1 63 63 TRP N N 63 125.623 125.623 125.559 0.064 17893 2173 1 7 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.035 0.172 17893 2174 1 7 . 1 1 63 63 TRP CA C 63 56.531 56.531 57.858 -1.327 17893 2175 1 7 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.440 0.264 17893 2176 1 7 . 1 1 63 63 TRP H H 63 9.464 9.464 8.790 0.674 17893 2177 1 7 . 1 1 64 64 GLN N N 64 127.029 127.029 125.257 1.772 17893 2178 1 7 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.316 -0.118 17893 2179 1 7 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.004 -0.502 17893 2180 1 7 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.016 1.657 17893 2181 1 7 . 1 1 64 64 GLN H H 64 7.977 7.977 8.110 -0.133 17893 2182 1 7 . 1 1 65 65 PRO HA H 65 4.680 4.680 3.307 1.373 17893 2183 1 7 . 1 1 65 65 PRO CA C 65 61.655 61.655 62.759 -1.104 17893 2184 1 7 . 1 1 65 65 PRO CB C 65 31.500 31.500 31.938 -0.438 17893 2185 1 8 . 1 1 2 2 ILE N N 2 123.389 123.389 120.975 2.414 17893 2186 1 8 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.954 0.167 17893 2187 1 8 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.013 1.160 17893 2188 1 8 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.769 0.363 17893 2189 1 8 . 1 1 2 2 ILE H H 2 9.112 9.112 7.908 1.204 17893 2190 1 8 . 1 1 3 3 ILE N N 3 108.863 108.863 128.406 -19.543 17893 2191 1 8 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.096 0.337 17893 2192 1 8 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.969 -0.815 17893 2193 1 8 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.109 -0.454 17893 2194 1 8 . 1 1 3 3 ILE H H 3 9.418 9.418 9.334 0.084 17893 2195 1 8 . 1 1 4 4 ASN N N 4 123.919 123.919 126.180 -2.261 17893 2196 1 8 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.859 0.773 17893 2197 1 8 . 1 1 4 4 ASN CA C 4 51.378 51.378 51.978 -0.600 17893 2198 1 8 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.998 2.039 17893 2199 1 8 . 1 1 4 4 ASN H H 4 9.056 9.056 8.821 0.235 17893 2200 1 8 . 1 1 5 5 ASN N N 5 120.944 120.944 125.219 -4.275 17893 2201 1 8 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.780 0.663 17893 2202 1 8 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.961 -1.546 17893 2203 1 8 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.262 1.551 17893 2204 1 8 . 1 1 5 5 ASN H H 5 9.383 9.383 9.222 0.161 17893 2205 1 8 . 1 1 6 6 LEU N N 6 120.594 120.594 123.349 -2.755 17893 2206 1 8 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.873 -0.106 17893 2207 1 8 . 1 1 6 6 LEU CA C 6 59.699 59.699 58.743 0.956 17893 2208 1 8 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.630 -0.825 17893 2209 1 8 . 1 1 6 6 LEU H H 6 8.531 8.531 8.897 -0.366 17893 2210 1 8 . 1 1 7 7 LYS N N 7 118.212 118.212 118.691 -0.479 17893 2211 1 8 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.947 -0.014 17893 2212 1 8 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.458 0.805 17893 2213 1 8 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.384 0.919 17893 2214 1 8 . 1 1 7 7 LYS H H 7 8.933 8.933 7.557 1.376 17893 2215 1 8 . 1 1 8 8 LEU N N 8 116.414 116.414 120.663 -4.249 17893 2216 1 8 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.013 0.160 17893 2217 1 8 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.323 0.067 17893 2218 1 8 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.880 0.148 17893 2219 1 8 . 1 1 8 8 LEU H H 8 7.667 7.667 7.556 0.111 17893 2220 1 8 . 1 1 9 9 ILE N N 9 119.134 119.134 119.061 0.073 17893 2221 1 8 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.540 0.274 17893 2222 1 8 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.433 -2.577 17893 2223 1 8 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.524 -1.062 17893 2224 1 8 . 1 1 9 9 ILE H H 9 8.226 8.226 8.786 -0.560 17893 2225 1 8 . 1 1 10 10 ARG N N 10 120.162 120.162 120.238 -0.076 17893 2226 1 8 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.816 0.085 17893 2227 1 8 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.944 0.783 17893 2228 1 8 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.119 -1.620 17893 2229 1 8 . 1 1 10 10 ARG H H 10 9.260 9.260 8.814 0.446 17893 2230 1 8 . 1 1 11 11 GLU N N 11 115.948 115.948 118.133 -2.185 17893 2231 1 8 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.080 0.093 17893 2232 1 8 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.815 0.571 17893 2233 1 8 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.141 -0.227 17893 2234 1 8 . 1 1 11 11 GLU H H 11 8.701 8.701 7.947 0.754 17893 2235 1 8 . 1 1 12 12 LYS N N 12 122.900 122.900 118.724 4.176 17893 2236 1 8 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.045 0.177 17893 2237 1 8 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.122 0.294 17893 2238 1 8 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.573 -0.575 17893 2239 1 8 . 1 1 12 12 LYS H H 12 8.254 8.254 8.078 0.176 17893 2240 1 8 . 1 1 13 13 LYS N N 13 116.385 116.385 115.417 0.968 17893 2241 1 8 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.310 -0.013 17893 2242 1 8 . 1 1 13 13 LYS CA C 13 55.031 55.031 56.080 -1.049 17893 2243 1 8 . 1 1 13 13 LYS CB C 13 31.549 31.549 33.106 -1.557 17893 2244 1 8 . 1 1 13 13 LYS H H 13 7.809 7.809 7.878 -0.069 17893 2245 1 8 . 1 1 14 14 LYS N N 14 115.317 115.317 117.710 -2.393 17893 2246 1 8 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.942 0.040 17893 2247 1 8 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.560 0.328 17893 2248 1 8 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.725 -1.439 17893 2249 1 8 . 1 1 14 14 LYS H H 14 8.069 8.069 7.944 0.125 17893 2250 1 8 . 1 1 15 15 ILE N N 15 118.431 118.431 120.498 -2.067 17893 2251 1 8 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.209 0.414 17893 2252 1 8 . 1 1 15 15 ILE CA C 15 59.199 59.199 60.165 -0.966 17893 2253 1 8 . 1 1 15 15 ILE CB C 15 40.896 40.896 39.944 0.952 17893 2254 1 8 . 1 1 15 15 ILE H H 15 7.569 7.569 8.197 -0.628 17893 2255 1 8 . 1 1 16 16 SER N N 16 125.034 125.034 120.661 4.373 17893 2256 1 8 . 1 1 16 16 SER HA H 16 4.585 4.585 4.496 0.089 17893 2257 1 8 . 1 1 16 16 SER CA C 16 57.004 57.004 57.263 -0.259 17893 2258 1 8 . 1 1 16 16 SER CB C 16 64.914 64.914 65.158 -0.244 17893 2259 1 8 . 1 1 16 16 SER H H 16 9.440 9.440 8.892 0.548 17893 2260 1 8 . 1 1 17 17 GLN N N 17 120.228 120.228 124.998 -4.770 17893 2261 1 8 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.031 -0.244 17893 2262 1 8 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.272 2.244 17893 2263 1 8 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.582 0.469 17893 2264 1 8 . 1 1 17 17 GLN H H 17 9.527 9.527 8.945 0.582 17893 2265 1 8 . 1 1 18 18 SER N N 18 112.979 112.979 115.860 -2.881 17893 2266 1 8 . 1 1 18 18 SER HA H 18 4.531 4.531 4.006 0.525 17893 2267 1 8 . 1 1 18 18 SER CA C 18 62.872 62.872 61.782 1.090 17893 2268 1 8 . 1 1 18 18 SER CB C 18 65.338 65.338 62.619 2.719 17893 2269 1 8 . 1 1 18 18 SER H H 18 8.949 8.949 7.997 0.952 17893 2270 1 8 . 1 1 19 19 GLU N N 19 124.147 124.147 121.758 2.389 17893 2271 1 8 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.140 -0.033 17893 2272 1 8 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.473 0.140 17893 2273 1 8 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.109 0.430 17893 2274 1 8 . 1 1 19 19 GLU H H 19 8.331 8.331 8.200 0.131 17893 2275 1 8 . 1 1 20 20 LEU N N 20 119.943 119.943 122.273 -2.330 17893 2276 1 8 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.930 0.224 17893 2277 1 8 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.723 -0.149 17893 2278 1 8 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.393 -0.388 17893 2279 1 8 . 1 1 20 20 LEU H H 20 8.314 8.314 8.528 -0.214 17893 2280 1 8 . 1 1 21 21 ALA N N 21 119.877 119.877 121.213 -1.336 17893 2281 1 8 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.935 -0.211 17893 2282 1 8 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.142 0.312 17893 2283 1 8 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.033 -1.172 17893 2284 1 8 . 1 1 21 21 ALA H H 21 8.588 8.588 8.814 -0.226 17893 2285 1 8 . 1 1 22 22 ALA N N 22 117.330 117.330 121.977 -4.647 17893 2286 1 8 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.975 0.289 17893 2287 1 8 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.733 -0.124 17893 2288 1 8 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.453 -0.797 17893 2289 1 8 . 1 1 22 22 ALA H H 22 7.813 7.813 7.681 0.132 17893 2290 1 8 . 1 1 23 23 LEU N N 23 118.586 118.586 118.496 0.090 17893 2291 1 8 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.596 0.365 17893 2292 1 8 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.242 -0.142 17893 2293 1 8 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.202 0.222 17893 2294 1 8 . 1 1 23 23 LEU H H 23 7.538 7.538 8.321 -0.783 17893 2295 1 8 . 1 1 24 24 LEU N N 24 114.488 114.488 115.608 -1.120 17893 2296 1 8 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.251 0.013 17893 2297 1 8 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.450 -0.656 17893 2298 1 8 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.592 1.841 17893 2299 1 8 . 1 1 24 24 LEU H H 24 7.449 7.449 7.702 -0.253 17893 2300 1 8 . 1 1 25 25 GLU N N 25 114.895 114.895 115.314 -0.419 17893 2301 1 8 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.021 -0.055 17893 2302 1 8 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.590 -0.442 17893 2303 1 8 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.029 -0.036 17893 2304 1 8 . 1 1 25 25 GLU H H 25 8.029 8.029 7.528 0.501 17893 2305 1 8 . 1 1 26 26 VAL N N 26 109.738 109.738 112.716 -2.978 17893 2306 1 8 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.727 0.163 17893 2307 1 8 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.547 -1.266 17893 2308 1 8 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.121 0.174 17893 2309 1 8 . 1 1 26 26 VAL H H 26 7.989 7.989 8.049 -0.060 17893 2310 1 8 . 1 1 27 27 SER N N 27 114.381 114.381 116.652 -2.271 17893 2311 1 8 . 1 1 27 27 SER HA H 27 4.644 4.644 4.591 0.053 17893 2312 1 8 . 1 1 27 27 SER CA C 27 56.445 56.445 58.197 -1.752 17893 2313 1 8 . 1 1 27 27 SER CB C 27 62.251 62.251 64.064 -1.813 17893 2314 1 8 . 1 1 27 27 SER H H 27 8.618 8.618 8.416 0.202 17893 2315 1 8 . 1 1 28 28 ARG N N 28 115.323 115.323 124.638 -9.315 17893 2316 1 8 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.961 -0.213 17893 2317 1 8 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.624 -0.706 17893 2318 1 8 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.755 -0.705 17893 2319 1 8 . 1 1 28 28 ARG H H 28 8.242 8.242 8.907 -0.665 17893 2320 1 8 . 1 1 29 29 GLN N N 29 117.343 117.343 116.404 0.939 17893 2321 1 8 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.066 0.108 17893 2322 1 8 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.992 0.093 17893 2323 1 8 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.543 0.025 17893 2324 1 8 . 1 1 29 29 GLN H H 29 8.827 8.827 8.878 -0.051 17893 2325 1 8 . 1 1 30 30 THR N N 30 119.996 119.996 117.119 2.877 17893 2326 1 8 . 1 1 30 30 THR HA H 30 4.434 4.434 4.300 0.134 17893 2327 1 8 . 1 1 30 30 THR CA C 30 67.621 67.621 65.874 1.747 17893 2328 1 8 . 1 1 30 30 THR CB C 30 66.513 66.513 68.428 -1.915 17893 2329 1 8 . 1 1 30 30 THR H H 30 8.132 8.132 7.748 0.384 17893 2330 1 8 . 1 1 31 31 ILE N N 31 118.828 118.828 123.170 -4.342 17893 2331 1 8 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.758 0.028 17893 2332 1 8 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.206 -2.177 17893 2333 1 8 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.653 -1.576 17893 2334 1 8 . 1 1 31 31 ILE H H 31 7.163 7.163 7.450 -0.287 17893 2335 1 8 . 1 1 32 32 ASN N N 32 118.098 118.098 119.331 -1.233 17893 2336 1 8 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.372 -0.017 17893 2337 1 8 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.620 0.634 17893 2338 1 8 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.207 1.041 17893 2339 1 8 . 1 1 32 32 ASN H H 32 8.656 8.656 9.233 -0.577 17893 2340 1 8 . 1 1 33 33 GLY N N 33 124.952 124.952 108.506 16.446 17893 2341 1 8 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.914 0.226 17893 2342 1 8 . 1 1 33 33 GLY H H 33 8.643 8.643 8.128 0.515 17893 2343 1 8 . 1 1 34 34 ILE N N 34 122.233 122.233 122.775 -0.542 17893 2344 1 8 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.838 0.466 17893 2345 1 8 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.255 0.549 17893 2346 1 8 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.078 0.208 17893 2347 1 8 . 1 1 34 34 ILE H H 34 8.203 8.203 7.074 1.129 17893 2348 1 8 . 1 1 35 35 GLU N N 35 120.686 120.686 118.641 2.045 17893 2349 1 8 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.033 0.181 17893 2350 1 8 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.669 1.023 17893 2351 1 8 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.242 -0.390 17893 2352 1 8 . 1 1 35 35 GLU H H 35 8.575 8.575 8.692 -0.117 17893 2353 1 8 . 1 1 36 36 LYS N N 36 116.029 116.029 118.155 -2.126 17893 2354 1 8 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.034 0.487 17893 2355 1 8 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.284 -2.777 17893 2356 1 8 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.123 -1.184 17893 2357 1 8 . 1 1 36 36 LYS H H 36 8.107 8.107 8.282 -0.175 17893 2358 1 8 . 1 1 37 37 ASN N N 37 114.692 114.692 108.965 5.727 17893 2359 1 8 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.587 0.162 17893 2360 1 8 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.361 1.427 17893 2361 1 8 . 1 1 37 37 ASN CB C 37 36.949 36.949 37.097 -0.148 17893 2362 1 8 . 1 1 37 37 ASN H H 37 8.240 8.240 8.129 0.111 17893 2363 1 8 . 1 1 38 38 LYS N N 38 115.098 115.098 120.958 -5.860 17893 2364 1 8 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.122 0.314 17893 2365 1 8 . 1 1 38 38 LYS CA C 38 56.178 56.178 59.053 -2.874 17893 2366 1 8 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.359 -0.123 17893 2367 1 8 . 1 1 38 38 LYS H H 38 8.727 8.727 8.515 0.212 17893 2368 1 8 . 1 1 39 39 TYR N N 39 117.011 117.011 112.261 4.750 17893 2369 1 8 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.774 -0.145 17893 2370 1 8 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.735 -0.176 17893 2371 1 8 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.564 0.339 17893 2372 1 8 . 1 1 39 39 TYR H H 39 7.087 7.087 7.050 0.037 17893 2373 1 8 . 1 1 40 40 ASN N N 40 123.595 123.595 120.291 3.304 17893 2374 1 8 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.794 0.459 17893 2375 1 8 . 1 1 40 40 ASN CA C 40 49.772 49.772 50.834 -1.062 17893 2376 1 8 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.117 -0.641 17893 2377 1 8 . 1 1 40 40 ASN H H 40 8.842 8.842 8.502 0.340 17893 2378 1 8 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.511 -0.702 17893 2379 1 8 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.436 0.093 17893 2380 1 8 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.280 -0.719 17893 2381 1 8 . 1 1 42 42 SER N N 42 125.580 125.580 115.624 9.956 17893 2382 1 8 . 1 1 42 42 SER HA H 42 4.581 4.581 4.305 0.276 17893 2383 1 8 . 1 1 42 42 SER CA C 42 57.380 57.380 58.094 -0.714 17893 2384 1 8 . 1 1 42 42 SER CB C 42 64.562 64.562 64.088 0.474 17893 2385 1 8 . 1 1 42 42 SER H H 42 8.033 8.033 8.165 -0.132 17893 2386 1 8 . 1 1 43 43 LEU N N 43 120.759 120.759 122.573 -1.814 17893 2387 1 8 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.967 -0.053 17893 2388 1 8 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.405 -0.060 17893 2389 1 8 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.341 -0.485 17893 2390 1 8 . 1 1 43 43 LEU H H 43 9.289 9.289 8.716 0.573 17893 2391 1 8 . 1 1 44 44 GLN N N 44 115.948 115.948 119.344 -3.396 17893 2392 1 8 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.062 -0.335 17893 2393 1 8 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.130 1.006 17893 2394 1 8 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.392 -0.142 17893 2395 1 8 . 1 1 44 44 GLN H H 44 8.906 8.906 8.496 0.410 17893 2396 1 8 . 1 1 45 45 LEU N N 45 119.419 119.419 120.206 -0.787 17893 2397 1 8 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.998 -0.073 17893 2398 1 8 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.508 -2.904 17893 2399 1 8 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.768 -1.141 17893 2400 1 8 . 1 1 45 45 LEU H H 45 8.078 8.078 8.286 -0.208 17893 2401 1 8 . 1 1 46 46 ALA N N 46 120.544 120.544 122.392 -1.848 17893 2402 1 8 . 1 1 46 46 ALA HA H 46 4.048 4.048 4.042 0.006 17893 2403 1 8 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.385 0.359 17893 2404 1 8 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.123 1.610 17893 2405 1 8 . 1 1 46 46 ALA H H 46 8.518 8.518 8.879 -0.361 17893 2406 1 8 . 1 1 47 47 LEU N N 47 116.461 116.461 118.892 -2.431 17893 2407 1 8 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.900 0.315 17893 2408 1 8 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.123 -0.622 17893 2409 1 8 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.658 -0.572 17893 2410 1 8 . 1 1 47 47 LEU H H 47 8.676 8.676 8.742 -0.066 17893 2411 1 8 . 1 1 48 48 LYS N N 48 120.958 120.958 120.293 0.665 17893 2412 1 8 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.046 -0.446 17893 2413 1 8 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.047 -0.118 17893 2414 1 8 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.379 -0.111 17893 2415 1 8 . 1 1 48 48 LYS H H 48 8.036 8.036 8.308 -0.272 17893 2416 1 8 . 1 1 49 49 ILE N N 49 120.407 120.407 120.411 -0.004 17893 2417 1 8 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.831 -0.232 17893 2418 1 8 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.757 1.445 17893 2419 1 8 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.971 -0.318 17893 2420 1 8 . 1 1 49 49 ILE H H 49 8.779 8.779 8.451 0.328 17893 2421 1 8 . 1 1 50 50 ALA N N 50 120.480 120.480 123.438 -2.958 17893 2422 1 8 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.202 -0.123 17893 2423 1 8 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.018 0.605 17893 2424 1 8 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.478 -0.473 17893 2425 1 8 . 1 1 50 50 ALA H H 50 8.173 8.173 8.401 -0.228 17893 2426 1 8 . 1 1 51 51 TYR N N 51 117.118 117.118 120.437 -3.319 17893 2427 1 8 . 1 1 51 51 TYR HA H 51 4.365 4.365 4.009 0.356 17893 2428 1 8 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.013 -0.580 17893 2429 1 8 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.401 -0.179 17893 2430 1 8 . 1 1 51 51 TYR H H 51 8.169 8.169 8.717 -0.548 17893 2431 1 8 . 1 1 52 52 TYR N N 52 118.548 118.548 115.746 2.802 17893 2432 1 8 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.151 0.170 17893 2433 1 8 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.488 1.481 17893 2434 1 8 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.645 -1.167 17893 2435 1 8 . 1 1 52 52 TYR H H 52 9.062 9.062 8.200 0.862 17893 2436 1 8 . 1 1 53 53 LEU N N 53 115.380 115.380 116.792 -1.412 17893 2437 1 8 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.102 0.435 17893 2438 1 8 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.280 -2.136 17893 2439 1 8 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.318 -2.222 17893 2440 1 8 . 1 1 53 53 LEU H H 53 8.394 8.394 8.466 -0.072 17893 2441 1 8 . 1 1 54 54 ASN N N 54 122.105 122.105 115.225 6.880 17893 2442 1 8 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.366 0.090 17893 2443 1 8 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.199 -0.408 17893 2444 1 8 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.579 0.179 17893 2445 1 8 . 1 1 54 54 ASN H H 54 8.091 8.091 8.555 -0.464 17893 2446 1 8 . 1 1 55 55 THR N N 55 114.964 114.964 116.405 -1.441 17893 2447 1 8 . 1 1 55 55 THR HA H 55 4.947 4.947 4.761 0.186 17893 2448 1 8 . 1 1 55 55 THR CA C 55 60.062 60.062 60.681 -0.619 17893 2449 1 8 . 1 1 55 55 THR CB C 55 74.945 74.945 69.913 5.032 17893 2450 1 8 . 1 1 55 55 THR H H 55 8.248 8.248 7.600 0.648 17893 2451 1 8 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.486 0.124 17893 2452 1 8 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.725 0.117 17893 2453 1 8 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.441 -0.495 17893 2454 1 8 . 1 1 57 57 LEU N N 57 127.597 127.597 126.071 1.526 17893 2455 1 8 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.102 -0.031 17893 2456 1 8 . 1 1 57 57 LEU CA C 57 59.722 59.722 59.005 0.717 17893 2457 1 8 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.134 -0.641 17893 2458 1 8 . 1 1 57 57 LEU H H 57 9.958 9.958 8.631 1.327 17893 2459 1 8 . 1 1 58 58 GLU N N 58 123.260 123.260 118.720 4.540 17893 2460 1 8 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.364 0.522 17893 2461 1 8 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.081 -0.564 17893 2462 1 8 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.087 -0.029 17893 2463 1 8 . 1 1 58 58 GLU H H 58 9.353 9.353 8.654 0.699 17893 2464 1 8 . 1 1 59 59 ASP N N 59 117.681 117.681 116.857 0.824 17893 2465 1 8 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.422 0.232 17893 2466 1 8 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.443 -0.820 17893 2467 1 8 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.705 -0.714 17893 2468 1 8 . 1 1 59 59 ASP H H 59 8.012 8.012 8.157 -0.145 17893 2469 1 8 . 1 1 60 60 ILE N N 60 119.519 119.519 118.177 1.342 17893 2470 1 8 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.699 -0.156 17893 2471 1 8 . 1 1 60 60 ILE CA C 60 63.906 63.906 64.141 -0.235 17893 2472 1 8 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.950 0.466 17893 2473 1 8 . 1 1 60 60 ILE H H 60 8.210 8.210 7.721 0.489 17893 2474 1 8 . 1 1 61 61 PHE N N 61 116.030 116.030 118.528 -2.498 17893 2475 1 8 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.630 -0.184 17893 2476 1 8 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.613 0.208 17893 2477 1 8 . 1 1 61 61 PHE CB C 61 41.965 41.965 40.186 1.779 17893 2478 1 8 . 1 1 61 61 PHE H H 61 8.530 8.530 8.771 -0.241 17893 2479 1 8 . 1 1 62 62 GLN N N 62 116.829 116.829 121.778 -4.949 17893 2480 1 8 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.839 0.218 17893 2481 1 8 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.777 0.212 17893 2482 1 8 . 1 1 62 62 GLN CB C 62 31.828 31.828 30.872 0.956 17893 2483 1 8 . 1 1 62 62 GLN H H 62 8.737 8.737 9.009 -0.272 17893 2484 1 8 . 1 1 63 63 TRP N N 63 125.623 125.623 127.214 -1.591 17893 2485 1 8 . 1 1 63 63 TRP HA H 63 5.207 5.207 4.915 0.292 17893 2486 1 8 . 1 1 63 63 TRP CA C 63 56.531 56.531 57.084 -0.553 17893 2487 1 8 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.644 0.060 17893 2488 1 8 . 1 1 63 63 TRP H H 63 9.464 9.464 8.846 0.618 17893 2489 1 8 . 1 1 64 64 GLN N N 64 127.029 127.029 125.316 1.713 17893 2490 1 8 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.193 0.005 17893 2491 1 8 . 1 1 64 64 GLN CA C 64 51.502 51.502 51.761 -0.260 17893 2492 1 8 . 1 1 64 64 GLN CB C 64 30.673 30.673 28.653 2.020 17893 2493 1 8 . 1 1 64 64 GLN H H 64 7.977 7.977 8.510 -0.533 17893 2494 1 8 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.399 0.281 17893 2495 1 8 . 1 1 65 65 PRO CA C 65 61.655 61.655 62.812 -1.157 17893 2496 1 8 . 1 1 65 65 PRO CB C 65 31.500 31.500 31.996 -0.496 17893 2497 1 9 . 1 1 2 2 ILE N N 2 123.389 123.389 121.366 2.023 17893 2498 1 9 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.135 -0.014 17893 2499 1 9 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.623 0.549 17893 2500 1 9 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.251 -0.119 17893 2501 1 9 . 1 1 2 2 ILE H H 2 9.112 9.112 7.764 1.348 17893 2502 1 9 . 1 1 3 3 ILE N N 3 108.863 108.863 127.921 -19.058 17893 2503 1 9 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.272 0.161 17893 2504 1 9 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.172 -0.018 17893 2505 1 9 . 1 1 3 3 ILE CB C 3 38.655 38.655 40.243 -1.588 17893 2506 1 9 . 1 1 3 3 ILE H H 3 9.418 9.418 9.362 0.056 17893 2507 1 9 . 1 1 4 4 ASN N N 4 123.919 123.919 125.776 -1.857 17893 2508 1 9 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.895 0.737 17893 2509 1 9 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.174 -0.796 17893 2510 1 9 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.041 1.996 17893 2511 1 9 . 1 1 4 4 ASN H H 4 9.056 9.056 8.893 0.163 17893 2512 1 9 . 1 1 5 5 ASN N N 5 120.944 120.944 124.260 -3.316 17893 2513 1 9 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.809 0.634 17893 2514 1 9 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.308 -0.893 17893 2515 1 9 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.511 1.302 17893 2516 1 9 . 1 1 5 5 ASN H H 5 9.383 9.383 9.184 0.199 17893 2517 1 9 . 1 1 6 6 LEU N N 6 120.594 120.594 123.164 -2.570 17893 2518 1 9 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.837 -0.070 17893 2519 1 9 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.153 0.546 17893 2520 1 9 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.552 -0.747 17893 2521 1 9 . 1 1 6 6 LEU H H 6 8.531 8.531 9.182 -0.651 17893 2522 1 9 . 1 1 7 7 LYS N N 7 118.212 118.212 118.301 -0.089 17893 2523 1 9 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.985 -0.052 17893 2524 1 9 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.203 1.060 17893 2525 1 9 . 1 1 7 7 LYS CB C 7 32.303 32.303 30.855 1.448 17893 2526 1 9 . 1 1 7 7 LYS H H 7 8.933 8.933 8.311 0.622 17893 2527 1 9 . 1 1 8 8 LEU N N 8 116.414 116.414 120.811 -4.397 17893 2528 1 9 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.050 0.123 17893 2529 1 9 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.360 0.030 17893 2530 1 9 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.901 0.126 17893 2531 1 9 . 1 1 8 8 LEU H H 8 7.667 7.667 7.538 0.129 17893 2532 1 9 . 1 1 9 9 ILE N N 9 119.134 119.134 118.785 0.349 17893 2533 1 9 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.558 0.256 17893 2534 1 9 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.202 -2.346 17893 2535 1 9 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.581 -1.119 17893 2536 1 9 . 1 1 9 9 ILE H H 9 8.226 8.226 8.623 -0.397 17893 2537 1 9 . 1 1 10 10 ARG N N 10 120.162 120.162 120.217 -0.055 17893 2538 1 9 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.875 0.026 17893 2539 1 9 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.028 0.699 17893 2540 1 9 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.093 -1.594 17893 2541 1 9 . 1 1 10 10 ARG H H 10 9.260 9.260 8.810 0.450 17893 2542 1 9 . 1 1 11 11 GLU N N 11 115.948 115.948 117.902 -1.954 17893 2543 1 9 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.143 0.030 17893 2544 1 9 . 1 1 11 11 GLU CA C 11 59.386 59.386 59.135 0.251 17893 2545 1 9 . 1 1 11 11 GLU CB C 11 28.914 28.914 28.897 0.017 17893 2546 1 9 . 1 1 11 11 GLU H H 11 8.701 8.701 7.939 0.762 17893 2547 1 9 . 1 1 12 12 LYS N N 12 122.900 122.900 120.033 2.867 17893 2548 1 9 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.095 0.127 17893 2549 1 9 . 1 1 12 12 LYS CA C 12 59.416 59.416 58.992 0.424 17893 2550 1 9 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.436 -0.438 17893 2551 1 9 . 1 1 12 12 LYS H H 12 8.254 8.254 7.384 0.870 17893 2552 1 9 . 1 1 13 13 LYS N N 13 116.385 116.385 114.858 1.527 17893 2553 1 9 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.398 -0.101 17893 2554 1 9 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.778 -0.747 17893 2555 1 9 . 1 1 13 13 LYS CB C 13 31.549 31.549 33.302 -1.753 17893 2556 1 9 . 1 1 13 13 LYS H H 13 7.809 7.809 7.606 0.203 17893 2557 1 9 . 1 1 14 14 LYS N N 14 115.317 115.317 117.531 -2.214 17893 2558 1 9 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.944 0.038 17893 2559 1 9 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.859 0.029 17893 2560 1 9 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.811 -1.525 17893 2561 1 9 . 1 1 14 14 LYS H H 14 8.069 8.069 7.961 0.108 17893 2562 1 9 . 1 1 15 15 ILE N N 15 118.431 118.431 120.097 -1.666 17893 2563 1 9 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.053 0.570 17893 2564 1 9 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.885 -0.686 17893 2565 1 9 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.242 2.654 17893 2566 1 9 . 1 1 15 15 ILE H H 15 7.569 7.569 7.986 -0.417 17893 2567 1 9 . 1 1 16 16 SER N N 16 125.034 125.034 122.584 2.450 17893 2568 1 9 . 1 1 16 16 SER HA H 16 4.585 4.585 4.535 0.050 17893 2569 1 9 . 1 1 16 16 SER CA C 16 57.004 57.004 57.681 -0.677 17893 2570 1 9 . 1 1 16 16 SER CB C 16 64.914 64.914 64.290 0.624 17893 2571 1 9 . 1 1 16 16 SER H H 16 9.440 9.440 8.359 1.081 17893 2572 1 9 . 1 1 17 17 GLN N N 17 120.228 120.228 123.656 -3.428 17893 2573 1 9 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.986 -0.199 17893 2574 1 9 . 1 1 17 17 GLN CA C 17 61.516 61.516 60.058 1.458 17893 2575 1 9 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.555 0.496 17893 2576 1 9 . 1 1 17 17 GLN H H 17 9.527 9.527 9.032 0.495 17893 2577 1 9 . 1 1 18 18 SER N N 18 112.979 112.979 115.380 -2.401 17893 2578 1 9 . 1 1 18 18 SER HA H 18 4.531 4.531 4.098 0.432 17893 2579 1 9 . 1 1 18 18 SER CA C 18 62.872 62.872 61.428 1.444 17893 2580 1 9 . 1 1 18 18 SER CB C 18 65.338 65.338 62.495 2.843 17893 2581 1 9 . 1 1 18 18 SER H H 18 8.949 8.949 8.625 0.324 17893 2582 1 9 . 1 1 19 19 GLU N N 19 124.147 124.147 122.424 1.723 17893 2583 1 9 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.144 -0.037 17893 2584 1 9 . 1 1 19 19 GLU CA C 19 58.613 58.613 59.318 -0.705 17893 2585 1 9 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.274 0.265 17893 2586 1 9 . 1 1 19 19 GLU H H 19 8.331 8.331 7.998 0.333 17893 2587 1 9 . 1 1 20 20 LEU N N 20 119.943 119.943 121.029 -1.086 17893 2588 1 9 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.976 0.178 17893 2589 1 9 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.977 -0.403 17893 2590 1 9 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.493 -0.488 17893 2591 1 9 . 1 1 20 20 LEU H H 20 8.314 8.314 8.691 -0.377 17893 2592 1 9 . 1 1 21 21 ALA N N 21 119.877 119.877 121.770 -1.893 17893 2593 1 9 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.942 -0.218 17893 2594 1 9 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.257 0.197 17893 2595 1 9 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.031 -1.170 17893 2596 1 9 . 1 1 21 21 ALA H H 21 8.588 8.588 9.038 -0.450 17893 2597 1 9 . 1 1 22 22 ALA N N 22 117.330 117.330 122.197 -4.867 17893 2598 1 9 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.973 0.291 17893 2599 1 9 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.791 -0.182 17893 2600 1 9 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.484 -0.828 17893 2601 1 9 . 1 1 22 22 ALA H H 22 7.813 7.813 8.279 -0.466 17893 2602 1 9 . 1 1 23 23 LEU N N 23 118.586 118.586 118.604 -0.018 17893 2603 1 9 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.539 0.422 17893 2604 1 9 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.040 0.060 17893 2605 1 9 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.570 -0.146 17893 2606 1 9 . 1 1 23 23 LEU H H 23 7.538 7.538 8.351 -0.813 17893 2607 1 9 . 1 1 24 24 LEU N N 24 114.488 114.488 114.864 -0.376 17893 2608 1 9 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.122 0.142 17893 2609 1 9 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.200 -0.406 17893 2610 1 9 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.669 1.764 17893 2611 1 9 . 1 1 24 24 LEU H H 24 7.449 7.449 7.951 -0.502 17893 2612 1 9 . 1 1 25 25 GLU N N 25 114.895 114.895 115.205 -0.310 17893 2613 1 9 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.005 -0.039 17893 2614 1 9 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.259 -0.111 17893 2615 1 9 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.508 -0.515 17893 2616 1 9 . 1 1 25 25 GLU H H 25 8.029 8.029 7.444 0.585 17893 2617 1 9 . 1 1 26 26 VAL N N 26 109.738 109.738 112.269 -2.531 17893 2618 1 9 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.763 0.127 17893 2619 1 9 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.122 -0.841 17893 2620 1 9 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.173 0.121 17893 2621 1 9 . 1 1 26 26 VAL H H 26 7.989 7.989 8.071 -0.082 17893 2622 1 9 . 1 1 27 27 SER N N 27 114.381 114.381 115.886 -1.505 17893 2623 1 9 . 1 1 27 27 SER HA H 27 4.644 4.644 4.657 -0.013 17893 2624 1 9 . 1 1 27 27 SER CA C 27 56.445 56.445 57.458 -1.012 17893 2625 1 9 . 1 1 27 27 SER CB C 27 62.251 62.251 64.229 -1.978 17893 2626 1 9 . 1 1 27 27 SER H H 27 8.618 8.618 8.297 0.321 17893 2627 1 9 . 1 1 28 28 ARG N N 28 115.323 115.323 123.370 -8.047 17893 2628 1 9 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.975 -0.227 17893 2629 1 9 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.664 -0.745 17893 2630 1 9 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.807 -0.757 17893 2631 1 9 . 1 1 28 28 ARG H H 28 8.242 8.242 8.945 -0.703 17893 2632 1 9 . 1 1 29 29 GLN N N 29 117.343 117.343 117.394 -0.051 17893 2633 1 9 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.137 0.037 17893 2634 1 9 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.203 -0.118 17893 2635 1 9 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.591 -0.023 17893 2636 1 9 . 1 1 29 29 GLN H H 29 8.827 8.827 8.859 -0.032 17893 2637 1 9 . 1 1 30 30 THR N N 30 119.996 119.996 117.755 2.241 17893 2638 1 9 . 1 1 30 30 THR HA H 30 4.434 4.434 4.329 0.105 17893 2639 1 9 . 1 1 30 30 THR CA C 30 67.621 67.621 66.029 1.591 17893 2640 1 9 . 1 1 30 30 THR CB C 30 66.513 66.513 68.447 -1.934 17893 2641 1 9 . 1 1 30 30 THR H H 30 8.132 8.132 7.407 0.725 17893 2642 1 9 . 1 1 31 31 ILE N N 31 118.828 118.828 122.531 -3.703 17893 2643 1 9 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.742 0.044 17893 2644 1 9 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.596 -2.567 17893 2645 1 9 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.506 -1.429 17893 2646 1 9 . 1 1 31 31 ILE H H 31 7.163 7.163 7.602 -0.439 17893 2647 1 9 . 1 1 32 32 ASN N N 32 118.098 118.098 118.792 -0.694 17893 2648 1 9 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.397 -0.042 17893 2649 1 9 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.158 0.096 17893 2650 1 9 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.540 0.708 17893 2651 1 9 . 1 1 32 32 ASN H H 32 8.656 8.656 8.993 -0.337 17893 2652 1 9 . 1 1 33 33 GLY N N 33 124.952 124.952 108.463 16.489 17893 2653 1 9 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.973 0.167 17893 2654 1 9 . 1 1 33 33 GLY H H 33 8.643 8.643 8.590 0.053 17893 2655 1 9 . 1 1 34 34 ILE N N 34 122.233 122.233 122.834 -0.601 17893 2656 1 9 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.581 0.723 17893 2657 1 9 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.441 0.363 17893 2658 1 9 . 1 1 34 34 ILE CB C 34 38.286 38.286 37.998 0.288 17893 2659 1 9 . 1 1 34 34 ILE H H 34 8.203 8.203 7.231 0.972 17893 2660 1 9 . 1 1 35 35 GLU N N 35 120.686 120.686 118.479 2.207 17893 2661 1 9 . 1 1 35 35 GLU HA H 35 4.214 4.214 3.914 0.300 17893 2662 1 9 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.190 0.502 17893 2663 1 9 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.407 -0.555 17893 2664 1 9 . 1 1 35 35 GLU H H 35 8.575 8.575 8.312 0.263 17893 2665 1 9 . 1 1 36 36 LYS N N 36 116.029 116.029 116.909 -0.880 17893 2666 1 9 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.130 0.391 17893 2667 1 9 . 1 1 36 36 LYS CA C 36 55.507 55.507 57.997 -2.490 17893 2668 1 9 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.482 -1.543 17893 2669 1 9 . 1 1 36 36 LYS H H 36 8.107 8.107 7.682 0.425 17893 2670 1 9 . 1 1 37 37 ASN N N 37 114.692 114.692 109.332 5.360 17893 2671 1 9 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.643 0.106 17893 2672 1 9 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.234 1.554 17893 2673 1 9 . 1 1 37 37 ASN CB C 37 36.949 36.949 37.784 -0.835 17893 2674 1 9 . 1 1 37 37 ASN H H 37 8.240 8.240 8.014 0.226 17893 2675 1 9 . 1 1 38 38 LYS N N 38 115.098 115.098 121.076 -5.978 17893 2676 1 9 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.138 0.298 17893 2677 1 9 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.940 -2.761 17893 2678 1 9 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.374 -0.138 17893 2679 1 9 . 1 1 38 38 LYS H H 38 8.727 8.727 8.523 0.204 17893 2680 1 9 . 1 1 39 39 TYR N N 39 117.011 117.011 112.098 4.913 17893 2681 1 9 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.764 -0.135 17893 2682 1 9 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.917 -0.359 17893 2683 1 9 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.262 0.641 17893 2684 1 9 . 1 1 39 39 TYR H H 39 7.087 7.087 7.088 -0.001 17893 2685 1 9 . 1 1 40 40 ASN N N 40 123.595 123.595 120.508 3.087 17893 2686 1 9 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.842 0.411 17893 2687 1 9 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.148 -1.376 17893 2688 1 9 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.112 -0.636 17893 2689 1 9 . 1 1 40 40 ASN H H 40 8.842 8.842 8.526 0.316 17893 2690 1 9 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.560 -0.751 17893 2691 1 9 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.634 -0.105 17893 2692 1 9 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.195 -0.634 17893 2693 1 9 . 1 1 42 42 SER N N 42 125.580 125.580 116.548 9.032 17893 2694 1 9 . 1 1 42 42 SER HA H 42 4.581 4.581 4.320 0.261 17893 2695 1 9 . 1 1 42 42 SER CA C 42 57.380 57.380 57.867 -0.487 17893 2696 1 9 . 1 1 42 42 SER CB C 42 64.562 64.562 64.254 0.308 17893 2697 1 9 . 1 1 42 42 SER H H 42 8.033 8.033 8.140 -0.107 17893 2698 1 9 . 1 1 43 43 LEU N N 43 120.759 120.759 123.461 -2.702 17893 2699 1 9 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.030 -0.116 17893 2700 1 9 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.393 -0.048 17893 2701 1 9 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.282 -0.426 17893 2702 1 9 . 1 1 43 43 LEU H H 43 9.289 9.289 8.752 0.537 17893 2703 1 9 . 1 1 44 44 GLN N N 44 115.948 115.948 117.806 -1.858 17893 2704 1 9 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.080 -0.353 17893 2705 1 9 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.291 0.845 17893 2706 1 9 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.185 0.065 17893 2707 1 9 . 1 1 44 44 GLN H H 44 8.906 8.906 8.693 0.213 17893 2708 1 9 . 1 1 45 45 LEU N N 45 119.419 119.419 120.254 -0.835 17893 2709 1 9 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.008 -0.083 17893 2710 1 9 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.433 -2.829 17893 2711 1 9 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.666 -1.039 17893 2712 1 9 . 1 1 45 45 LEU H H 45 8.078 8.078 7.737 0.341 17893 2713 1 9 . 1 1 46 46 ALA N N 46 120.544 120.544 122.321 -1.777 17893 2714 1 9 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.894 0.154 17893 2715 1 9 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.261 0.483 17893 2716 1 9 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.005 1.728 17893 2717 1 9 . 1 1 46 46 ALA H H 46 8.518 8.518 8.781 -0.263 17893 2718 1 9 . 1 1 47 47 LEU N N 47 116.461 116.461 118.730 -2.269 17893 2719 1 9 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.876 0.339 17893 2720 1 9 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.038 -0.537 17893 2721 1 9 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.618 -0.532 17893 2722 1 9 . 1 1 47 47 LEU H H 47 8.676 8.676 8.491 0.185 17893 2723 1 9 . 1 1 48 48 LYS N N 48 120.958 120.958 120.197 0.761 17893 2724 1 9 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.066 -0.466 17893 2725 1 9 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.030 -0.101 17893 2726 1 9 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.427 -0.159 17893 2727 1 9 . 1 1 48 48 LYS H H 48 8.036 8.036 8.115 -0.079 17893 2728 1 9 . 1 1 49 49 ILE N N 49 120.407 120.407 120.396 0.011 17893 2729 1 9 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.845 -0.246 17893 2730 1 9 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.789 1.413 17893 2731 1 9 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.946 -0.293 17893 2732 1 9 . 1 1 49 49 ILE H H 49 8.779 8.779 8.408 0.371 17893 2733 1 9 . 1 1 50 50 ALA N N 50 120.480 120.480 123.827 -3.347 17893 2734 1 9 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.147 -0.068 17893 2735 1 9 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.178 0.445 17893 2736 1 9 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.410 -0.405 17893 2737 1 9 . 1 1 50 50 ALA H H 50 8.173 8.173 8.381 -0.208 17893 2738 1 9 . 1 1 51 51 TYR N N 51 117.118 117.118 120.262 -3.144 17893 2739 1 9 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.997 0.368 17893 2740 1 9 . 1 1 51 51 TYR CA C 51 61.433 61.433 61.943 -0.510 17893 2741 1 9 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.363 -0.140 17893 2742 1 9 . 1 1 51 51 TYR H H 51 8.169 8.169 8.445 -0.276 17893 2743 1 9 . 1 1 52 52 TYR N N 52 118.548 118.548 116.338 2.210 17893 2744 1 9 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.018 0.303 17893 2745 1 9 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.800 1.169 17893 2746 1 9 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.507 -1.029 17893 2747 1 9 . 1 1 52 52 TYR H H 52 9.062 9.062 8.231 0.831 17893 2748 1 9 . 1 1 53 53 LEU N N 53 115.380 115.380 116.554 -1.174 17893 2749 1 9 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.052 0.485 17893 2750 1 9 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.705 -2.561 17893 2751 1 9 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.365 -2.269 17893 2752 1 9 . 1 1 53 53 LEU H H 53 8.394 8.394 8.635 -0.241 17893 2753 1 9 . 1 1 54 54 ASN N N 54 122.105 122.105 115.289 6.816 17893 2754 1 9 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.414 0.042 17893 2755 1 9 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.012 -0.221 17893 2756 1 9 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.337 0.421 17893 2757 1 9 . 1 1 54 54 ASN H H 54 8.091 8.091 8.292 -0.201 17893 2758 1 9 . 1 1 55 55 THR N N 55 114.964 114.964 114.843 0.121 17893 2759 1 9 . 1 1 55 55 THR HA H 55 4.947 4.947 4.843 0.104 17893 2760 1 9 . 1 1 55 55 THR CA C 55 60.062 60.062 60.310 -0.248 17893 2761 1 9 . 1 1 55 55 THR CB C 55 74.945 74.945 71.305 3.640 17893 2762 1 9 . 1 1 55 55 THR H H 55 8.248 8.248 8.162 0.086 17893 2763 1 9 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.634 -0.024 17893 2764 1 9 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.828 0.014 17893 2765 1 9 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.540 -0.594 17893 2766 1 9 . 1 1 57 57 LEU N N 57 127.597 127.597 125.444 2.153 17893 2767 1 9 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.067 0.004 17893 2768 1 9 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.659 1.063 17893 2769 1 9 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.085 -0.592 17893 2770 1 9 . 1 1 57 57 LEU H H 57 9.958 9.958 8.675 1.283 17893 2771 1 9 . 1 1 58 58 GLU N N 58 123.260 123.260 118.240 5.020 17893 2772 1 9 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.287 0.599 17893 2773 1 9 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.178 -0.661 17893 2774 1 9 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.113 -0.054 17893 2775 1 9 . 1 1 58 58 GLU H H 58 9.353 9.353 8.706 0.647 17893 2776 1 9 . 1 1 59 59 ASP N N 59 117.681 117.681 118.631 -0.950 17893 2777 1 9 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.478 0.176 17893 2778 1 9 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.526 -0.903 17893 2779 1 9 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.946 -0.955 17893 2780 1 9 . 1 1 59 59 ASP H H 59 8.012 8.012 8.295 -0.283 17893 2781 1 9 . 1 1 60 60 ILE N N 60 119.519 119.519 116.482 3.037 17893 2782 1 9 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.779 -0.236 17893 2783 1 9 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.858 0.048 17893 2784 1 9 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.911 0.505 17893 2785 1 9 . 1 1 60 60 ILE H H 60 8.210 8.210 7.126 1.084 17893 2786 1 9 . 1 1 61 61 PHE N N 61 116.030 116.030 118.435 -2.405 17893 2787 1 9 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.479 -0.033 17893 2788 1 9 . 1 1 61 61 PHE CA C 61 55.821 55.821 56.018 -0.197 17893 2789 1 9 . 1 1 61 61 PHE CB C 61 41.965 41.965 39.797 2.168 17893 2790 1 9 . 1 1 61 61 PHE H H 61 8.530 8.530 8.705 -0.175 17893 2791 1 9 . 1 1 62 62 GLN N N 62 116.829 116.829 121.463 -4.634 17893 2792 1 9 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.890 0.167 17893 2793 1 9 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.796 0.193 17893 2794 1 9 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.400 0.428 17893 2795 1 9 . 1 1 62 62 GLN H H 62 8.737 8.737 9.239 -0.502 17893 2796 1 9 . 1 1 63 63 TRP N N 63 125.623 125.623 126.309 -0.686 17893 2797 1 9 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.439 -0.232 17893 2798 1 9 . 1 1 63 63 TRP CA C 63 56.531 56.531 55.914 0.617 17893 2799 1 9 . 1 1 63 63 TRP CB C 63 30.704 30.704 31.217 -0.513 17893 2800 1 9 . 1 1 63 63 TRP H H 63 9.464 9.464 8.785 0.679 17893 2801 1 9 . 1 1 64 64 GLN N N 64 127.029 127.029 124.003 3.026 17893 2802 1 9 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.123 0.075 17893 2803 1 9 . 1 1 64 64 GLN CA C 64 51.502 51.502 51.887 -0.385 17893 2804 1 9 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.401 1.272 17893 2805 1 9 . 1 1 64 64 GLN H H 64 7.977 7.977 8.888 -0.911 17893 2806 1 9 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.416 0.264 17893 2807 1 9 . 1 1 65 65 PRO CA C 65 61.655 61.655 64.399 -2.744 17893 2808 1 9 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.151 -0.651 17893 2809 1 10 . 1 1 2 2 ILE N N 2 123.389 123.389 121.243 2.146 17893 2810 1 10 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.099 0.022 17893 2811 1 10 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.497 0.676 17893 2812 1 10 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.268 -0.136 17893 2813 1 10 . 1 1 2 2 ILE H H 2 9.112 9.112 7.796 1.316 17893 2814 1 10 . 1 1 3 3 ILE N N 3 108.863 108.863 128.584 -19.721 17893 2815 1 10 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.176 0.257 17893 2816 1 10 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.323 -0.169 17893 2817 1 10 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.621 -0.966 17893 2818 1 10 . 1 1 3 3 ILE H H 3 9.418 9.418 9.233 0.185 17893 2819 1 10 . 1 1 4 4 ASN N N 4 123.919 123.919 126.056 -2.137 17893 2820 1 10 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.697 0.935 17893 2821 1 10 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.060 -0.683 17893 2822 1 10 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.043 1.994 17893 2823 1 10 . 1 1 4 4 ASN H H 4 9.056 9.056 8.849 0.207 17893 2824 1 10 . 1 1 5 5 ASN N N 5 120.944 120.944 123.628 -2.684 17893 2825 1 10 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.822 0.621 17893 2826 1 10 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.665 -1.250 17893 2827 1 10 . 1 1 5 5 ASN CB C 5 39.813 39.813 39.248 0.565 17893 2828 1 10 . 1 1 5 5 ASN H H 5 9.383 9.383 9.021 0.362 17893 2829 1 10 . 1 1 6 6 LEU N N 6 120.594 120.594 122.494 -1.900 17893 2830 1 10 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.812 -0.045 17893 2831 1 10 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.759 -0.060 17893 2832 1 10 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.756 -0.951 17893 2833 1 10 . 1 1 6 6 LEU H H 6 8.531 8.531 9.247 -0.716 17893 2834 1 10 . 1 1 7 7 LYS N N 7 118.212 118.212 117.869 0.343 17893 2835 1 10 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.186 -0.253 17893 2836 1 10 . 1 1 7 7 LYS CA C 7 60.263 60.263 58.831 1.432 17893 2837 1 10 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.505 0.798 17893 2838 1 10 . 1 1 7 7 LYS H H 7 8.933 8.933 8.227 0.706 17893 2839 1 10 . 1 1 8 8 LEU N N 8 116.414 116.414 120.879 -4.465 17893 2840 1 10 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.004 0.169 17893 2841 1 10 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.435 -0.045 17893 2842 1 10 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.794 0.234 17893 2843 1 10 . 1 1 8 8 LEU H H 8 7.667 7.667 7.544 0.123 17893 2844 1 10 . 1 1 9 9 ILE N N 9 119.134 119.134 118.919 0.215 17893 2845 1 10 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.549 0.265 17893 2846 1 10 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.499 -2.643 17893 2847 1 10 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.558 -1.096 17893 2848 1 10 . 1 1 9 9 ILE H H 9 8.226 8.226 8.791 -0.565 17893 2849 1 10 . 1 1 10 10 ARG N N 10 120.162 120.162 120.281 -0.119 17893 2850 1 10 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.911 -0.010 17893 2851 1 10 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.001 0.726 17893 2852 1 10 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.102 -1.603 17893 2853 1 10 . 1 1 10 10 ARG H H 10 9.260 9.260 8.780 0.480 17893 2854 1 10 . 1 1 11 11 GLU N N 11 115.948 115.948 118.213 -2.265 17893 2855 1 10 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.135 0.038 17893 2856 1 10 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.819 0.567 17893 2857 1 10 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.081 -0.167 17893 2858 1 10 . 1 1 11 11 GLU H H 11 8.701 8.701 8.698 0.003 17893 2859 1 10 . 1 1 12 12 LYS N N 12 122.900 122.900 119.616 3.284 17893 2860 1 10 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.038 0.184 17893 2861 1 10 . 1 1 12 12 LYS CA C 12 59.416 59.416 58.990 0.425 17893 2862 1 10 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.675 -0.677 17893 2863 1 10 . 1 1 12 12 LYS H H 12 8.254 8.254 8.307 -0.053 17893 2864 1 10 . 1 1 13 13 LYS N N 13 116.385 116.385 114.127 2.258 17893 2865 1 10 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.387 -0.090 17893 2866 1 10 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.594 -0.563 17893 2867 1 10 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.815 -1.266 17893 2868 1 10 . 1 1 13 13 LYS H H 13 7.809 7.809 7.726 0.083 17893 2869 1 10 . 1 1 14 14 LYS N N 14 115.317 115.317 115.873 -0.556 17893 2870 1 10 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.893 0.089 17893 2871 1 10 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.695 0.193 17893 2872 1 10 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.967 -1.681 17893 2873 1 10 . 1 1 14 14 LYS H H 14 8.069 8.069 7.612 0.457 17893 2874 1 10 . 1 1 15 15 ILE N N 15 118.431 118.431 120.657 -2.226 17893 2875 1 10 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.108 0.515 17893 2876 1 10 . 1 1 15 15 ILE CA C 15 59.199 59.199 60.002 -0.803 17893 2877 1 10 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.098 2.798 17893 2878 1 10 . 1 1 15 15 ILE H H 15 7.569 7.569 8.355 -0.786 17893 2879 1 10 . 1 1 16 16 SER N N 16 125.034 125.034 121.591 3.443 17893 2880 1 10 . 1 1 16 16 SER HA H 16 4.585 4.585 4.696 -0.111 17893 2881 1 10 . 1 1 16 16 SER CA C 16 57.004 57.004 57.801 -0.797 17893 2882 1 10 . 1 1 16 16 SER CB C 16 64.914 64.914 64.951 -0.037 17893 2883 1 10 . 1 1 16 16 SER H H 16 9.440 9.440 8.985 0.455 17893 2884 1 10 . 1 1 17 17 GLN N N 17 120.228 120.228 122.243 -2.015 17893 2885 1 10 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.997 -0.210 17893 2886 1 10 . 1 1 17 17 GLN CA C 17 61.516 61.516 60.336 1.180 17893 2887 1 10 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.398 0.653 17893 2888 1 10 . 1 1 17 17 GLN H H 17 9.527 9.527 9.006 0.521 17893 2889 1 10 . 1 1 18 18 SER N N 18 112.979 112.979 114.033 -1.054 17893 2890 1 10 . 1 1 18 18 SER HA H 18 4.531 4.531 4.013 0.518 17893 2891 1 10 . 1 1 18 18 SER CA C 18 62.872 62.872 62.333 0.539 17893 2892 1 10 . 1 1 18 18 SER CB C 18 65.338 65.338 62.511 2.828 17893 2893 1 10 . 1 1 18 18 SER H H 18 8.949 8.949 8.744 0.205 17893 2894 1 10 . 1 1 19 19 GLU N N 19 124.147 124.147 121.550 2.597 17893 2895 1 10 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.086 0.021 17893 2896 1 10 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.577 0.036 17893 2897 1 10 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.826 0.713 17893 2898 1 10 . 1 1 19 19 GLU H H 19 8.331 8.331 7.827 0.504 17893 2899 1 10 . 1 1 20 20 LEU N N 20 119.943 119.943 122.408 -2.465 17893 2900 1 10 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.876 0.278 17893 2901 1 10 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.617 -0.043 17893 2902 1 10 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.310 -0.305 17893 2903 1 10 . 1 1 20 20 LEU H H 20 8.314 8.314 7.465 0.849 17893 2904 1 10 . 1 1 21 21 ALA N N 21 119.877 119.877 121.576 -1.699 17893 2905 1 10 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.914 -0.190 17893 2906 1 10 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.255 0.199 17893 2907 1 10 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.003 -1.142 17893 2908 1 10 . 1 1 21 21 ALA H H 21 8.588 8.588 8.955 -0.367 17893 2909 1 10 . 1 1 22 22 ALA N N 22 117.330 117.330 121.876 -4.546 17893 2910 1 10 . 1 1 22 22 ALA HA H 22 4.264 4.264 4.072 0.192 17893 2911 1 10 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.641 -0.032 17893 2912 1 10 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.371 -0.715 17893 2913 1 10 . 1 1 22 22 ALA H H 22 7.813 7.813 7.942 -0.129 17893 2914 1 10 . 1 1 23 23 LEU N N 23 118.586 118.586 118.138 0.448 17893 2915 1 10 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.757 0.203 17893 2916 1 10 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.350 -0.251 17893 2917 1 10 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.154 0.270 17893 2918 1 10 . 1 1 23 23 LEU H H 23 7.538 7.538 8.437 -0.899 17893 2919 1 10 . 1 1 24 24 LEU N N 24 114.488 114.488 116.512 -2.024 17893 2920 1 10 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.325 -0.061 17893 2921 1 10 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.374 -0.580 17893 2922 1 10 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.866 1.567 17893 2923 1 10 . 1 1 24 24 LEU H H 24 7.449 7.449 8.256 -0.807 17893 2924 1 10 . 1 1 25 25 GLU N N 25 114.895 114.895 115.730 -0.835 17893 2925 1 10 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.024 -0.058 17893 2926 1 10 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.323 -0.175 17893 2927 1 10 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.550 -0.557 17893 2928 1 10 . 1 1 25 25 GLU H H 25 8.029 8.029 7.716 0.313 17893 2929 1 10 . 1 1 26 26 VAL N N 26 109.738 109.738 113.455 -3.717 17893 2930 1 10 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.542 0.348 17893 2931 1 10 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.221 -0.940 17893 2932 1 10 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.534 -0.239 17893 2933 1 10 . 1 1 26 26 VAL H H 26 7.989 7.989 7.997 -0.008 17893 2934 1 10 . 1 1 27 27 SER N N 27 114.381 114.381 117.021 -2.640 17893 2935 1 10 . 1 1 27 27 SER HA H 27 4.644 4.644 4.549 0.095 17893 2936 1 10 . 1 1 27 27 SER CA C 27 56.445 56.445 58.171 -1.726 17893 2937 1 10 . 1 1 27 27 SER CB C 27 62.251 62.251 64.026 -1.775 17893 2938 1 10 . 1 1 27 27 SER H H 27 8.618 8.618 8.496 0.122 17893 2939 1 10 . 1 1 28 28 ARG N N 28 115.323 115.323 123.751 -8.428 17893 2940 1 10 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.963 -0.215 17893 2941 1 10 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.431 -0.512 17893 2942 1 10 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.832 -0.782 17893 2943 1 10 . 1 1 28 28 ARG H H 28 8.242 8.242 8.919 -0.677 17893 2944 1 10 . 1 1 29 29 GLN N N 29 117.343 117.343 117.320 0.023 17893 2945 1 10 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.103 0.071 17893 2946 1 10 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.039 0.046 17893 2947 1 10 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.637 -0.069 17893 2948 1 10 . 1 1 29 29 GLN H H 29 8.827 8.827 8.904 -0.077 17893 2949 1 10 . 1 1 30 30 THR N N 30 119.996 119.996 117.826 2.170 17893 2950 1 10 . 1 1 30 30 THR HA H 30 4.434 4.434 4.288 0.146 17893 2951 1 10 . 1 1 30 30 THR CA C 30 67.621 67.621 65.918 1.703 17893 2952 1 10 . 1 1 30 30 THR CB C 30 66.513 66.513 68.694 -2.181 17893 2953 1 10 . 1 1 30 30 THR H H 30 8.132 8.132 7.986 0.146 17893 2954 1 10 . 1 1 31 31 ILE N N 31 118.828 118.828 123.152 -4.324 17893 2955 1 10 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.834 -0.048 17893 2956 1 10 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.587 -2.558 17893 2957 1 10 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.558 -1.481 17893 2958 1 10 . 1 1 31 31 ILE H H 31 7.163 7.163 7.355 -0.192 17893 2959 1 10 . 1 1 32 32 ASN N N 32 118.098 118.098 119.148 -1.050 17893 2960 1 10 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.428 -0.073 17893 2961 1 10 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.159 0.095 17893 2962 1 10 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.426 0.822 17893 2963 1 10 . 1 1 32 32 ASN H H 32 8.656 8.656 9.085 -0.429 17893 2964 1 10 . 1 1 33 33 GLY N N 33 124.952 124.952 108.530 16.422 17893 2965 1 10 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.678 0.462 17893 2966 1 10 . 1 1 33 33 GLY H H 33 8.643 8.643 8.594 0.049 17893 2967 1 10 . 1 1 34 34 ILE N N 34 122.233 122.233 122.090 0.143 17893 2968 1 10 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.669 0.635 17893 2969 1 10 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.493 0.311 17893 2970 1 10 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.116 0.170 17893 2971 1 10 . 1 1 34 34 ILE H H 34 8.203 8.203 7.478 0.725 17893 2972 1 10 . 1 1 35 35 GLU N N 35 120.686 120.686 117.355 3.331 17893 2973 1 10 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.072 0.142 17893 2974 1 10 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.678 1.014 17893 2975 1 10 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.759 -0.907 17893 2976 1 10 . 1 1 35 35 GLU H H 35 8.575 8.575 8.396 0.179 17893 2977 1 10 . 1 1 36 36 LYS N N 36 116.029 116.029 117.991 -1.962 17893 2978 1 10 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.213 0.308 17893 2979 1 10 . 1 1 36 36 LYS CA C 36 55.507 55.507 55.389 0.118 17893 2980 1 10 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.212 -1.272 17893 2981 1 10 . 1 1 36 36 LYS H H 36 8.107 8.107 7.601 0.506 17893 2982 1 10 . 1 1 37 37 ASN N N 37 114.692 114.692 115.611 -0.919 17893 2983 1 10 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.662 0.087 17893 2984 1 10 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.375 1.413 17893 2985 1 10 . 1 1 37 37 ASN CB C 37 36.949 36.949 37.972 -1.023 17893 2986 1 10 . 1 1 37 37 ASN H H 37 8.240 8.240 8.528 -0.288 17893 2987 1 10 . 1 1 38 38 LYS N N 38 115.098 115.098 120.118 -5.020 17893 2988 1 10 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.091 0.345 17893 2989 1 10 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.710 -2.532 17893 2990 1 10 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.056 0.180 17893 2991 1 10 . 1 1 38 38 LYS H H 38 8.727 8.727 7.603 1.124 17893 2992 1 10 . 1 1 39 39 TYR N N 39 117.011 117.011 112.131 4.880 17893 2993 1 10 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.712 -0.083 17893 2994 1 10 . 1 1 39 39 TYR CA C 39 55.559 55.559 56.033 -0.474 17893 2995 1 10 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.638 1.265 17893 2996 1 10 . 1 1 39 39 TYR H H 39 7.087 7.087 7.065 0.022 17893 2997 1 10 . 1 1 40 40 ASN N N 40 123.595 123.595 120.318 3.277 17893 2998 1 10 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.920 0.333 17893 2999 1 10 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.445 -1.673 17893 3000 1 10 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.288 -0.812 17893 3001 1 10 . 1 1 40 40 ASN H H 40 8.842 8.842 8.523 0.319 17893 3002 1 10 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.636 -0.827 17893 3003 1 10 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.507 0.022 17893 3004 1 10 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.238 -0.677 17893 3005 1 10 . 1 1 42 42 SER N N 42 125.580 125.580 115.606 9.974 17893 3006 1 10 . 1 1 42 42 SER HA H 42 4.581 4.581 4.277 0.304 17893 3007 1 10 . 1 1 42 42 SER CA C 42 57.380 57.380 57.955 -0.574 17893 3008 1 10 . 1 1 42 42 SER CB C 42 64.562 64.562 63.911 0.651 17893 3009 1 10 . 1 1 42 42 SER H H 42 8.033 8.033 8.196 -0.163 17893 3010 1 10 . 1 1 43 43 LEU N N 43 120.759 120.759 125.222 -4.463 17893 3011 1 10 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.995 -0.081 17893 3012 1 10 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.459 -0.113 17893 3013 1 10 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.593 -0.737 17893 3014 1 10 . 1 1 43 43 LEU H H 43 9.289 9.289 8.748 0.541 17893 3015 1 10 . 1 1 44 44 GLN N N 44 115.948 115.948 118.809 -2.861 17893 3016 1 10 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.100 -0.373 17893 3017 1 10 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.424 0.712 17893 3018 1 10 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.259 -0.009 17893 3019 1 10 . 1 1 44 44 GLN H H 44 8.906 8.906 8.659 0.247 17893 3020 1 10 . 1 1 45 45 LEU N N 45 119.419 119.419 119.425 -0.006 17893 3021 1 10 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.045 -0.120 17893 3022 1 10 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.362 -2.758 17893 3023 1 10 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.415 -0.788 17893 3024 1 10 . 1 1 45 45 LEU H H 45 8.078 8.078 7.975 0.103 17893 3025 1 10 . 1 1 46 46 ALA N N 46 120.544 120.544 122.577 -2.033 17893 3026 1 10 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.990 0.058 17893 3027 1 10 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.382 0.362 17893 3028 1 10 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.992 1.741 17893 3029 1 10 . 1 1 46 46 ALA H H 46 8.518 8.518 8.760 -0.242 17893 3030 1 10 . 1 1 47 47 LEU N N 47 116.461 116.461 118.868 -2.407 17893 3031 1 10 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.870 0.345 17893 3032 1 10 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.148 -0.647 17893 3033 1 10 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.644 -0.558 17893 3034 1 10 . 1 1 47 47 LEU H H 47 8.676 8.676 8.641 0.035 17893 3035 1 10 . 1 1 48 48 LYS N N 48 120.958 120.958 120.274 0.684 17893 3036 1 10 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.016 -0.416 17893 3037 1 10 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.045 -0.116 17893 3038 1 10 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.442 -0.174 17893 3039 1 10 . 1 1 48 48 LYS H H 48 8.036 8.036 8.291 -0.255 17893 3040 1 10 . 1 1 49 49 ILE N N 49 120.407 120.407 120.488 -0.081 17893 3041 1 10 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.874 -0.275 17893 3042 1 10 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.389 1.813 17893 3043 1 10 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.846 -0.193 17893 3044 1 10 . 1 1 49 49 ILE H H 49 8.779 8.779 8.800 -0.021 17893 3045 1 10 . 1 1 50 50 ALA N N 50 120.480 120.480 123.352 -2.872 17893 3046 1 10 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.072 0.007 17893 3047 1 10 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.332 0.291 17893 3048 1 10 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.303 -0.298 17893 3049 1 10 . 1 1 50 50 ALA H H 50 8.173 8.173 8.682 -0.509 17893 3050 1 10 . 1 1 51 51 TYR N N 51 117.118 117.118 120.380 -3.262 17893 3051 1 10 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.998 0.367 17893 3052 1 10 . 1 1 51 51 TYR CA C 51 61.433 61.433 61.984 -0.551 17893 3053 1 10 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.345 -0.122 17893 3054 1 10 . 1 1 51 51 TYR H H 51 8.169 8.169 8.588 -0.419 17893 3055 1 10 . 1 1 52 52 TYR N N 52 118.548 118.548 116.131 2.417 17893 3056 1 10 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.055 0.266 17893 3057 1 10 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.627 1.342 17893 3058 1 10 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.449 -0.971 17893 3059 1 10 . 1 1 52 52 TYR H H 52 9.062 9.062 8.204 0.858 17893 3060 1 10 . 1 1 53 53 LEU N N 53 115.380 115.380 116.406 -1.026 17893 3061 1 10 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.079 0.458 17893 3062 1 10 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.409 -2.265 17893 3063 1 10 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.307 -2.211 17893 3064 1 10 . 1 1 53 53 LEU H H 53 8.394 8.394 8.644 -0.250 17893 3065 1 10 . 1 1 54 54 ASN N N 54 122.105 122.105 115.291 6.814 17893 3066 1 10 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.336 0.120 17893 3067 1 10 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.056 -0.265 17893 3068 1 10 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.682 0.076 17893 3069 1 10 . 1 1 54 54 ASN H H 54 8.091 8.091 8.279 -0.188 17893 3070 1 10 . 1 1 55 55 THR N N 55 114.964 114.964 115.670 -0.706 17893 3071 1 10 . 1 1 55 55 THR HA H 55 4.947 4.947 4.830 0.117 17893 3072 1 10 . 1 1 55 55 THR CA C 55 60.062 60.062 59.909 0.153 17893 3073 1 10 . 1 1 55 55 THR CB C 55 74.945 74.945 70.741 4.204 17893 3074 1 10 . 1 1 55 55 THR H H 55 8.248 8.248 7.860 0.388 17893 3075 1 10 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.697 -0.087 17893 3076 1 10 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.642 0.200 17893 3077 1 10 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.756 -0.810 17893 3078 1 10 . 1 1 57 57 LEU N N 57 127.597 127.597 125.085 2.512 17893 3079 1 10 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.098 -0.026 17893 3080 1 10 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.781 0.941 17893 3081 1 10 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.104 -0.611 17893 3082 1 10 . 1 1 57 57 LEU H H 57 9.958 9.958 8.632 1.327 17893 3083 1 10 . 1 1 58 58 GLU N N 58 123.260 123.260 119.075 4.185 17893 3084 1 10 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.328 0.558 17893 3085 1 10 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.065 -0.548 17893 3086 1 10 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.055 0.003 17893 3087 1 10 . 1 1 58 58 GLU H H 58 9.353 9.353 8.809 0.544 17893 3088 1 10 . 1 1 59 59 ASP N N 59 117.681 117.681 119.021 -1.340 17893 3089 1 10 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.429 0.225 17893 3090 1 10 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.422 -0.799 17893 3091 1 10 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.029 -1.038 17893 3092 1 10 . 1 1 59 59 ASP H H 59 8.012 8.012 7.773 0.239 17893 3093 1 10 . 1 1 60 60 ILE N N 60 119.519 119.519 116.577 2.942 17893 3094 1 10 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.780 -0.237 17893 3095 1 10 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.536 0.370 17893 3096 1 10 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.063 0.353 17893 3097 1 10 . 1 1 60 60 ILE H H 60 8.210 8.210 7.167 1.043 17893 3098 1 10 . 1 1 61 61 PHE N N 61 116.030 116.030 118.333 -2.303 17893 3099 1 10 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.610 -0.164 17893 3100 1 10 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.933 -0.112 17893 3101 1 10 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.408 0.557 17893 3102 1 10 . 1 1 61 61 PHE H H 61 8.530 8.530 8.832 -0.302 17893 3103 1 10 . 1 1 62 62 GLN N N 62 116.829 116.829 120.969 -4.140 17893 3104 1 10 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.849 0.208 17893 3105 1 10 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.523 0.466 17893 3106 1 10 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.970 -0.142 17893 3107 1 10 . 1 1 62 62 GLN H H 62 8.737 8.737 9.093 -0.356 17893 3108 1 10 . 1 1 63 63 TRP N N 63 125.623 125.623 127.994 -2.371 17893 3109 1 10 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.136 0.071 17893 3110 1 10 . 1 1 63 63 TRP CA C 63 56.531 56.531 57.124 -0.594 17893 3111 1 10 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.494 0.210 17893 3112 1 10 . 1 1 63 63 TRP H H 63 9.464 9.464 8.850 0.614 17893 3113 1 10 . 1 1 64 64 GLN N N 64 127.029 127.029 126.054 0.975 17893 3114 1 10 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.195 0.003 17893 3115 1 10 . 1 1 64 64 GLN CA C 64 51.502 51.502 51.853 -0.351 17893 3116 1 10 . 1 1 64 64 GLN CB C 64 30.673 30.673 28.675 1.998 17893 3117 1 10 . 1 1 64 64 GLN H H 64 7.977 7.977 8.824 -0.847 17893 3118 1 10 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.240 0.440 17893 3119 1 10 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.136 -1.480 17893 3120 1 10 . 1 1 65 65 PRO CB C 65 31.500 31.500 31.811 -0.311 17893 3121 1 11 . 1 1 2 2 ILE N N 2 123.389 123.389 121.201 2.188 17893 3122 1 11 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.046 0.075 17893 3123 1 11 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.485 0.688 17893 3124 1 11 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.030 0.102 17893 3125 1 11 . 1 1 2 2 ILE H H 2 9.112 9.112 7.759 1.353 17893 3126 1 11 . 1 1 3 3 ILE N N 3 108.863 108.863 128.797 -19.934 17893 3127 1 11 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.195 0.238 17893 3128 1 11 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.372 -0.218 17893 3129 1 11 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.560 -0.905 17893 3130 1 11 . 1 1 3 3 ILE H H 3 9.418 9.418 9.373 0.045 17893 3131 1 11 . 1 1 4 4 ASN N N 4 123.919 123.919 126.392 -2.473 17893 3132 1 11 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.859 0.773 17893 3133 1 11 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.130 -0.752 17893 3134 1 11 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.213 1.824 17893 3135 1 11 . 1 1 4 4 ASN H H 4 9.056 9.056 8.920 0.136 17893 3136 1 11 . 1 1 5 5 ASN N N 5 120.944 120.944 126.197 -5.253 17893 3137 1 11 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.844 0.599 17893 3138 1 11 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.423 -1.008 17893 3139 1 11 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.513 1.300 17893 3140 1 11 . 1 1 5 5 ASN H H 5 9.383 9.383 9.223 0.160 17893 3141 1 11 . 1 1 6 6 LEU N N 6 120.594 120.594 122.291 -1.697 17893 3142 1 11 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.807 -0.040 17893 3143 1 11 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.452 0.247 17893 3144 1 11 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.394 -0.589 17893 3145 1 11 . 1 1 6 6 LEU H H 6 8.531 8.531 9.230 -0.699 17893 3146 1 11 . 1 1 7 7 LYS N N 7 118.212 118.212 117.369 0.843 17893 3147 1 11 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.994 -0.061 17893 3148 1 11 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.204 1.059 17893 3149 1 11 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.326 0.977 17893 3150 1 11 . 1 1 7 7 LYS H H 7 8.933 8.933 8.219 0.714 17893 3151 1 11 . 1 1 8 8 LEU N N 8 116.414 116.414 120.999 -4.585 17893 3152 1 11 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.018 0.155 17893 3153 1 11 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.423 -0.033 17893 3154 1 11 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.725 0.303 17893 3155 1 11 . 1 1 8 8 LEU H H 8 7.667 7.667 7.589 0.078 17893 3156 1 11 . 1 1 9 9 ILE N N 9 119.134 119.134 119.554 -0.420 17893 3157 1 11 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.633 0.181 17893 3158 1 11 . 1 1 9 9 ILE CA C 9 62.856 62.856 64.033 -1.177 17893 3159 1 11 . 1 1 9 9 ILE CB C 9 36.462 36.462 36.572 -0.110 17893 3160 1 11 . 1 1 9 9 ILE H H 9 8.226 8.226 8.875 -0.649 17893 3161 1 11 . 1 1 10 10 ARG N N 10 120.162 120.162 119.762 0.400 17893 3162 1 11 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.873 0.028 17893 3163 1 11 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.367 0.360 17893 3164 1 11 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.095 -1.596 17893 3165 1 11 . 1 1 10 10 ARG H H 10 9.260 9.260 8.673 0.587 17893 3166 1 11 . 1 1 11 11 GLU N N 11 115.948 115.948 119.583 -3.635 17893 3167 1 11 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.157 0.016 17893 3168 1 11 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.648 0.738 17893 3169 1 11 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.044 -0.130 17893 3170 1 11 . 1 1 11 11 GLU H H 11 8.701 8.701 8.260 0.441 17893 3171 1 11 . 1 1 12 12 LYS N N 12 122.900 122.900 118.075 4.825 17893 3172 1 11 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.076 0.146 17893 3173 1 11 . 1 1 12 12 LYS CA C 12 59.416 59.416 58.878 0.538 17893 3174 1 11 . 1 1 12 12 LYS CB C 12 31.998 31.998 33.001 -1.003 17893 3175 1 11 . 1 1 12 12 LYS H H 12 8.254 8.254 8.227 0.027 17893 3176 1 11 . 1 1 13 13 LYS N N 13 116.385 116.385 114.720 1.665 17893 3177 1 11 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.412 -0.115 17893 3178 1 11 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.593 -0.562 17893 3179 1 11 . 1 1 13 13 LYS CB C 13 31.549 31.549 33.214 -1.665 17893 3180 1 11 . 1 1 13 13 LYS H H 13 7.809 7.809 7.836 -0.027 17893 3181 1 11 . 1 1 14 14 LYS N N 14 115.317 115.317 116.663 -1.346 17893 3182 1 11 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.926 0.056 17893 3183 1 11 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.606 0.282 17893 3184 1 11 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.888 -1.602 17893 3185 1 11 . 1 1 14 14 LYS H H 14 8.069 8.069 8.205 -0.136 17893 3186 1 11 . 1 1 15 15 ILE N N 15 118.431 118.431 121.687 -3.256 17893 3187 1 11 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.297 0.326 17893 3188 1 11 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.135 0.064 17893 3189 1 11 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.398 2.498 17893 3190 1 11 . 1 1 15 15 ILE H H 15 7.569 7.569 8.600 -1.031 17893 3191 1 11 . 1 1 16 16 SER N N 16 125.034 125.034 123.745 1.289 17893 3192 1 11 . 1 1 16 16 SER HA H 16 4.585 4.585 4.635 -0.050 17893 3193 1 11 . 1 1 16 16 SER CA C 16 57.004 57.004 58.751 -1.747 17893 3194 1 11 . 1 1 16 16 SER CB C 16 64.914 64.914 63.944 0.971 17893 3195 1 11 . 1 1 16 16 SER H H 16 9.440 9.440 9.854 -0.414 17893 3196 1 11 . 1 1 17 17 GLN N N 17 120.228 120.228 124.950 -4.722 17893 3197 1 11 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.959 -0.172 17893 3198 1 11 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.413 2.103 17893 3199 1 11 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.208 0.843 17893 3200 1 11 . 1 1 17 17 GLN H H 17 9.527 9.527 8.961 0.566 17893 3201 1 11 . 1 1 18 18 SER N N 18 112.979 112.979 116.073 -3.094 17893 3202 1 11 . 1 1 18 18 SER HA H 18 4.531 4.531 4.034 0.497 17893 3203 1 11 . 1 1 18 18 SER CA C 18 62.872 62.872 61.444 1.427 17893 3204 1 11 . 1 1 18 18 SER CB C 18 65.338 65.338 62.243 3.095 17893 3205 1 11 . 1 1 18 18 SER H H 18 8.949 8.949 8.661 0.288 17893 3206 1 11 . 1 1 19 19 GLU N N 19 124.147 124.147 122.142 2.005 17893 3207 1 11 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.105 0.002 17893 3208 1 11 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.671 -0.058 17893 3209 1 11 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.015 0.524 17893 3210 1 11 . 1 1 19 19 GLU H H 19 8.331 8.331 8.360 -0.029 17893 3211 1 11 . 1 1 20 20 LEU N N 20 119.943 119.943 122.203 -2.260 17893 3212 1 11 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.930 0.224 17893 3213 1 11 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.934 -0.359 17893 3214 1 11 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.681 -0.676 17893 3215 1 11 . 1 1 20 20 LEU H H 20 8.314 8.314 8.298 0.016 17893 3216 1 11 . 1 1 21 21 ALA N N 21 119.877 119.877 121.633 -1.756 17893 3217 1 11 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.923 -0.199 17893 3218 1 11 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.236 0.218 17893 3219 1 11 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.041 -1.179 17893 3220 1 11 . 1 1 21 21 ALA H H 21 8.588 8.588 8.928 -0.340 17893 3221 1 11 . 1 1 22 22 ALA N N 22 117.330 117.330 121.972 -4.642 17893 3222 1 11 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.969 0.295 17893 3223 1 11 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.779 -0.170 17893 3224 1 11 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.522 -0.866 17893 3225 1 11 . 1 1 22 22 ALA H H 22 7.813 7.813 8.124 -0.311 17893 3226 1 11 . 1 1 23 23 LEU N N 23 118.586 118.586 118.482 0.104 17893 3227 1 11 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.462 0.499 17893 3228 1 11 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.028 0.072 17893 3229 1 11 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.442 -0.018 17893 3230 1 11 . 1 1 23 23 LEU H H 23 7.538 7.538 8.325 -0.787 17893 3231 1 11 . 1 1 24 24 LEU N N 24 114.488 114.488 115.409 -0.921 17893 3232 1 11 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.211 0.053 17893 3233 1 11 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.533 -0.739 17893 3234 1 11 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.110 1.323 17893 3235 1 11 . 1 1 24 24 LEU H H 24 7.449 7.449 8.083 -0.634 17893 3236 1 11 . 1 1 25 25 GLU N N 25 114.895 114.895 115.163 -0.268 17893 3237 1 11 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.017 -0.051 17893 3238 1 11 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.319 -0.171 17893 3239 1 11 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.166 -0.173 17893 3240 1 11 . 1 1 25 25 GLU H H 25 8.029 8.029 7.774 0.255 17893 3241 1 11 . 1 1 26 26 VAL N N 26 109.738 109.738 111.281 -1.543 17893 3242 1 11 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.721 0.169 17893 3243 1 11 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.579 -1.298 17893 3244 1 11 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.106 0.189 17893 3245 1 11 . 1 1 26 26 VAL H H 26 7.989 7.989 8.103 -0.114 17893 3246 1 11 . 1 1 27 27 SER N N 27 114.381 114.381 116.048 -1.667 17893 3247 1 11 . 1 1 27 27 SER HA H 27 4.644 4.644 4.483 0.161 17893 3248 1 11 . 1 1 27 27 SER CA C 27 56.445 56.445 58.712 -2.267 17893 3249 1 11 . 1 1 27 27 SER CB C 27 62.251 62.251 64.144 -1.893 17893 3250 1 11 . 1 1 27 27 SER H H 27 8.618 8.618 8.580 0.038 17893 3251 1 11 . 1 1 28 28 ARG N N 28 115.323 115.323 124.121 -8.798 17893 3252 1 11 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.967 -0.219 17893 3253 1 11 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.581 -0.662 17893 3254 1 11 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.940 -0.890 17893 3255 1 11 . 1 1 28 28 ARG H H 28 8.242 8.242 8.964 -0.722 17893 3256 1 11 . 1 1 29 29 GLN N N 29 117.343 117.343 117.541 -0.198 17893 3257 1 11 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.075 0.099 17893 3258 1 11 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.002 0.083 17893 3259 1 11 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.656 -0.088 17893 3260 1 11 . 1 1 29 29 GLN H H 29 8.827 8.827 8.874 -0.047 17893 3261 1 11 . 1 1 30 30 THR N N 30 119.996 119.996 117.505 2.491 17893 3262 1 11 . 1 1 30 30 THR HA H 30 4.434 4.434 4.196 0.238 17893 3263 1 11 . 1 1 30 30 THR CA C 30 67.621 67.621 65.436 2.185 17893 3264 1 11 . 1 1 30 30 THR CB C 30 66.513 66.513 68.376 -1.863 17893 3265 1 11 . 1 1 30 30 THR H H 30 8.132 8.132 7.451 0.681 17893 3266 1 11 . 1 1 31 31 ILE N N 31 118.828 118.828 122.145 -3.317 17893 3267 1 11 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.760 0.026 17893 3268 1 11 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.668 -2.639 17893 3269 1 11 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.627 -1.550 17893 3270 1 11 . 1 1 31 31 ILE H H 31 7.163 7.163 7.597 -0.434 17893 3271 1 11 . 1 1 32 32 ASN N N 32 118.098 118.098 118.829 -0.731 17893 3272 1 11 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.606 -0.251 17893 3273 1 11 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.259 -0.005 17893 3274 1 11 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.480 0.769 17893 3275 1 11 . 1 1 32 32 ASN H H 32 8.656 8.656 8.936 -0.280 17893 3276 1 11 . 1 1 33 33 GLY N N 33 124.952 124.952 108.672 16.280 17893 3277 1 11 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.920 0.220 17893 3278 1 11 . 1 1 33 33 GLY H H 33 8.643 8.643 8.599 0.044 17893 3279 1 11 . 1 1 34 34 ILE N N 34 122.233 122.233 122.739 -0.506 17893 3280 1 11 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.797 0.507 17893 3281 1 11 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.546 0.258 17893 3282 1 11 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.083 0.203 17893 3283 1 11 . 1 1 34 34 ILE H H 34 8.203 8.203 7.548 0.655 17893 3284 1 11 . 1 1 35 35 GLU N N 35 120.686 120.686 118.628 2.058 17893 3285 1 11 . 1 1 35 35 GLU HA H 35 4.214 4.214 3.905 0.309 17893 3286 1 11 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.436 0.256 17893 3287 1 11 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.206 -0.354 17893 3288 1 11 . 1 1 35 35 GLU H H 35 8.575 8.575 8.213 0.362 17893 3289 1 11 . 1 1 36 36 LYS N N 36 116.029 116.029 116.821 -0.792 17893 3290 1 11 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.036 0.485 17893 3291 1 11 . 1 1 36 36 LYS CA C 36 55.507 55.507 59.055 -3.548 17893 3292 1 11 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.023 -1.084 17893 3293 1 11 . 1 1 36 36 LYS H H 36 8.107 8.107 7.556 0.551 17893 3294 1 11 . 1 1 37 37 ASN N N 37 114.692 114.692 112.077 2.615 17893 3295 1 11 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.597 0.152 17893 3296 1 11 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.244 1.544 17893 3297 1 11 . 1 1 37 37 ASN CB C 37 36.949 36.949 38.357 -1.408 17893 3298 1 11 . 1 1 37 37 ASN H H 37 8.240 8.240 8.103 0.137 17893 3299 1 11 . 1 1 38 38 LYS N N 38 115.098 115.098 120.424 -5.326 17893 3300 1 11 . 1 1 38 38 LYS HA H 38 4.436 4.436 3.950 0.486 17893 3301 1 11 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.832 -2.654 17893 3302 1 11 . 1 1 38 38 LYS CB C 38 33.236 33.236 31.904 1.332 17893 3303 1 11 . 1 1 38 38 LYS H H 38 8.727 8.727 8.347 0.380 17893 3304 1 11 . 1 1 39 39 TYR N N 39 117.011 117.011 113.740 3.271 17893 3305 1 11 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.762 -0.133 17893 3306 1 11 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.473 0.086 17893 3307 1 11 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.847 0.056 17893 3308 1 11 . 1 1 39 39 TYR H H 39 7.087 7.087 7.337 -0.250 17893 3309 1 11 . 1 1 40 40 ASN N N 40 123.595 123.595 120.961 2.634 17893 3310 1 11 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.830 0.423 17893 3311 1 11 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.636 -1.864 17893 3312 1 11 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.172 -0.696 17893 3313 1 11 . 1 1 40 40 ASN H H 40 8.842 8.842 8.553 0.289 17893 3314 1 11 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.604 -0.795 17893 3315 1 11 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.740 -0.211 17893 3316 1 11 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.075 -0.514 17893 3317 1 11 . 1 1 42 42 SER N N 42 125.580 125.580 115.893 9.687 17893 3318 1 11 . 1 1 42 42 SER HA H 42 4.581 4.581 4.255 0.326 17893 3319 1 11 . 1 1 42 42 SER CA C 42 57.380 57.380 57.636 -0.256 17893 3320 1 11 . 1 1 42 42 SER CB C 42 64.562 64.562 64.316 0.246 17893 3321 1 11 . 1 1 42 42 SER H H 42 8.033 8.033 8.153 -0.120 17893 3322 1 11 . 1 1 43 43 LEU N N 43 120.759 120.759 123.015 -2.256 17893 3323 1 11 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.998 -0.084 17893 3324 1 11 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.338 0.007 17893 3325 1 11 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.117 -0.261 17893 3326 1 11 . 1 1 43 43 LEU H H 43 9.289 9.289 8.728 0.561 17893 3327 1 11 . 1 1 44 44 GLN N N 44 115.948 115.948 118.134 -2.186 17893 3328 1 11 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.079 -0.352 17893 3329 1 11 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.134 1.002 17893 3330 1 11 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.060 0.190 17893 3331 1 11 . 1 1 44 44 GLN H H 44 8.906 8.906 8.650 0.256 17893 3332 1 11 . 1 1 45 45 LEU N N 45 119.419 119.419 120.772 -1.353 17893 3333 1 11 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.989 -0.064 17893 3334 1 11 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.377 -2.773 17893 3335 1 11 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.571 -0.944 17893 3336 1 11 . 1 1 45 45 LEU H H 45 8.078 8.078 8.343 -0.265 17893 3337 1 11 . 1 1 46 46 ALA N N 46 120.544 120.544 122.369 -1.825 17893 3338 1 11 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.907 0.141 17893 3339 1 11 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.321 0.423 17893 3340 1 11 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.959 1.774 17893 3341 1 11 . 1 1 46 46 ALA H H 46 8.518 8.518 8.758 -0.240 17893 3342 1 11 . 1 1 47 47 LEU N N 47 116.461 116.461 118.801 -2.340 17893 3343 1 11 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.902 0.313 17893 3344 1 11 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.068 -0.567 17893 3345 1 11 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.634 -0.548 17893 3346 1 11 . 1 1 47 47 LEU H H 47 8.676 8.676 8.432 0.244 17893 3347 1 11 . 1 1 48 48 LYS N N 48 120.958 120.958 119.893 1.065 17893 3348 1 11 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.071 -0.471 17893 3349 1 11 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.163 -0.234 17893 3350 1 11 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.407 -0.139 17893 3351 1 11 . 1 1 48 48 LYS H H 48 8.036 8.036 8.236 -0.200 17893 3352 1 11 . 1 1 49 49 ILE N N 49 120.407 120.407 120.337 0.070 17893 3353 1 11 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.813 -0.214 17893 3354 1 11 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.688 1.514 17893 3355 1 11 . 1 1 49 49 ILE CB C 49 37.653 37.653 38.014 -0.361 17893 3356 1 11 . 1 1 49 49 ILE H H 49 8.779 8.779 8.492 0.287 17893 3357 1 11 . 1 1 50 50 ALA N N 50 120.480 120.480 123.163 -2.683 17893 3358 1 11 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.142 -0.063 17893 3359 1 11 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.209 0.414 17893 3360 1 11 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.409 -0.404 17893 3361 1 11 . 1 1 50 50 ALA H H 50 8.173 8.173 8.478 -0.305 17893 3362 1 11 . 1 1 51 51 TYR N N 51 117.118 117.118 120.337 -3.219 17893 3363 1 11 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.991 0.374 17893 3364 1 11 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.308 -0.875 17893 3365 1 11 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.519 -0.296 17893 3366 1 11 . 1 1 51 51 TYR H H 51 8.169 8.169 8.777 -0.608 17893 3367 1 11 . 1 1 52 52 TYR N N 52 118.548 118.548 116.244 2.304 17893 3368 1 11 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.189 0.132 17893 3369 1 11 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.694 1.275 17893 3370 1 11 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.608 -1.130 17893 3371 1 11 . 1 1 52 52 TYR H H 52 9.062 9.062 8.152 0.910 17893 3372 1 11 . 1 1 53 53 LEU N N 53 115.380 115.380 116.281 -0.901 17893 3373 1 11 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.114 0.423 17893 3374 1 11 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.127 -1.983 17893 3375 1 11 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.205 -2.109 17893 3376 1 11 . 1 1 53 53 LEU H H 53 8.394 8.394 8.305 0.089 17893 3377 1 11 . 1 1 54 54 ASN N N 54 122.105 122.105 113.338 8.767 17893 3378 1 11 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.363 0.093 17893 3379 1 11 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.354 -0.563 17893 3380 1 11 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.540 0.218 17893 3381 1 11 . 1 1 54 54 ASN H H 54 8.091 8.091 8.259 -0.168 17893 3382 1 11 . 1 1 55 55 THR N N 55 114.964 114.964 115.476 -0.512 17893 3383 1 11 . 1 1 55 55 THR HA H 55 4.947 4.947 4.770 0.177 17893 3384 1 11 . 1 1 55 55 THR CA C 55 60.062 60.062 60.317 -0.255 17893 3385 1 11 . 1 1 55 55 THR CB C 55 74.945 74.945 70.726 4.219 17893 3386 1 11 . 1 1 55 55 THR H H 55 8.248 8.248 7.976 0.272 17893 3387 1 11 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.574 0.036 17893 3388 1 11 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.584 0.258 17893 3389 1 11 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.552 -0.606 17893 3390 1 11 . 1 1 57 57 LEU N N 57 127.597 127.597 124.962 2.635 17893 3391 1 11 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.137 -0.066 17893 3392 1 11 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.760 0.962 17893 3393 1 11 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.117 -0.624 17893 3394 1 11 . 1 1 57 57 LEU H H 57 9.958 9.958 8.592 1.366 17893 3395 1 11 . 1 1 58 58 GLU N N 58 123.260 123.260 118.372 4.888 17893 3396 1 11 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.333 0.553 17893 3397 1 11 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.046 -0.529 17893 3398 1 11 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.118 -0.060 17893 3399 1 11 . 1 1 58 58 GLU H H 58 9.353 9.353 8.598 0.755 17893 3400 1 11 . 1 1 59 59 ASP N N 59 117.681 117.681 116.724 0.957 17893 3401 1 11 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.437 0.217 17893 3402 1 11 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.626 -1.003 17893 3403 1 11 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.905 -0.914 17893 3404 1 11 . 1 1 59 59 ASP H H 59 8.012 8.012 7.818 0.194 17893 3405 1 11 . 1 1 60 60 ILE N N 60 119.519 119.519 115.557 3.962 17893 3406 1 11 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.745 -0.202 17893 3407 1 11 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.797 0.109 17893 3408 1 11 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.794 0.622 17893 3409 1 11 . 1 1 60 60 ILE H H 60 8.210 8.210 7.118 1.092 17893 3410 1 11 . 1 1 61 61 PHE N N 61 116.030 116.030 117.751 -1.721 17893 3411 1 11 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.522 -0.076 17893 3412 1 11 . 1 1 61 61 PHE CA C 61 55.821 55.821 56.021 -0.200 17893 3413 1 11 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.584 0.382 17893 3414 1 11 . 1 1 61 61 PHE H H 61 8.530 8.530 8.695 -0.165 17893 3415 1 11 . 1 1 62 62 GLN N N 62 116.829 116.829 120.162 -3.333 17893 3416 1 11 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.926 0.131 17893 3417 1 11 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.812 0.177 17893 3418 1 11 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.843 -0.015 17893 3419 1 11 . 1 1 62 62 GLN H H 62 8.737 8.737 9.282 -0.545 17893 3420 1 11 . 1 1 63 63 TRP N N 63 125.623 125.623 126.823 -1.200 17893 3421 1 11 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.208 -0.001 17893 3422 1 11 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.748 -0.217 17893 3423 1 11 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.971 -0.267 17893 3424 1 11 . 1 1 63 63 TRP H H 63 9.464 9.464 8.853 0.611 17893 3425 1 11 . 1 1 64 64 GLN N N 64 127.029 127.029 124.431 2.598 17893 3426 1 11 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.213 -0.015 17893 3427 1 11 . 1 1 64 64 GLN CA C 64 51.502 51.502 51.926 -0.424 17893 3428 1 11 . 1 1 64 64 GLN CB C 64 30.673 30.673 28.690 1.983 17893 3429 1 11 . 1 1 64 64 GLN H H 64 7.977 7.977 8.349 -0.372 17893 3430 1 11 . 1 1 65 65 PRO HA H 65 4.680 4.680 3.841 0.839 17893 3431 1 11 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.755 -2.100 17893 3432 1 11 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.050 -0.550 17893 3433 1 12 . 1 1 2 2 ILE N N 2 123.389 123.389 121.143 2.246 17893 3434 1 12 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.142 -0.021 17893 3435 1 12 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.050 1.123 17893 3436 1 12 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.434 -0.303 17893 3437 1 12 . 1 1 2 2 ILE H H 2 9.112 9.112 7.610 1.502 17893 3438 1 12 . 1 1 3 3 ILE N N 3 108.863 108.863 127.927 -19.064 17893 3439 1 12 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.231 0.202 17893 3440 1 12 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.303 -0.149 17893 3441 1 12 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.788 -1.133 17893 3442 1 12 . 1 1 3 3 ILE H H 3 9.418 9.418 9.141 0.277 17893 3443 1 12 . 1 1 4 4 ASN N N 4 123.919 123.919 126.075 -2.156 17893 3444 1 12 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.666 0.966 17893 3445 1 12 . 1 1 4 4 ASN CA C 4 51.378 51.378 51.835 -0.457 17893 3446 1 12 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.277 1.760 17893 3447 1 12 . 1 1 4 4 ASN H H 4 9.056 9.056 8.830 0.226 17893 3448 1 12 . 1 1 5 5 ASN N N 5 120.944 120.944 124.706 -3.762 17893 3449 1 12 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.751 0.692 17893 3450 1 12 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.638 -1.223 17893 3451 1 12 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.372 1.441 17893 3452 1 12 . 1 1 5 5 ASN H H 5 9.383 9.383 9.108 0.275 17893 3453 1 12 . 1 1 6 6 LEU N N 6 120.594 120.594 123.173 -2.579 17893 3454 1 12 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.911 -0.144 17893 3455 1 12 . 1 1 6 6 LEU CA C 6 59.699 59.699 58.993 0.706 17893 3456 1 12 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.700 -0.895 17893 3457 1 12 . 1 1 6 6 LEU H H 6 8.531 8.531 9.271 -0.740 17893 3458 1 12 . 1 1 7 7 LYS N N 7 118.212 118.212 118.336 -0.124 17893 3459 1 12 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.974 -0.041 17893 3460 1 12 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.229 1.034 17893 3461 1 12 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.382 0.921 17893 3462 1 12 . 1 1 7 7 LYS H H 7 8.933 8.933 7.868 1.065 17893 3463 1 12 . 1 1 8 8 LEU N N 8 116.414 116.414 120.286 -3.872 17893 3464 1 12 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.042 0.131 17893 3465 1 12 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.192 0.198 17893 3466 1 12 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.904 0.124 17893 3467 1 12 . 1 1 8 8 LEU H H 8 7.667 7.667 7.581 0.086 17893 3468 1 12 . 1 1 9 9 ILE N N 9 119.134 119.134 118.149 0.985 17893 3469 1 12 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.610 0.204 17893 3470 1 12 . 1 1 9 9 ILE CA C 9 62.856 62.856 64.785 -1.929 17893 3471 1 12 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.742 -1.280 17893 3472 1 12 . 1 1 9 9 ILE H H 9 8.226 8.226 8.569 -0.343 17893 3473 1 12 . 1 1 10 10 ARG N N 10 120.162 120.162 119.964 0.198 17893 3474 1 12 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.842 0.059 17893 3475 1 12 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.006 0.721 17893 3476 1 12 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.282 -1.783 17893 3477 1 12 . 1 1 10 10 ARG H H 10 9.260 9.260 8.557 0.703 17893 3478 1 12 . 1 1 11 11 GLU N N 11 115.948 115.948 117.296 -1.348 17893 3479 1 12 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.138 0.035 17893 3480 1 12 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.862 0.524 17893 3481 1 12 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.258 -0.344 17893 3482 1 12 . 1 1 11 11 GLU H H 11 8.701 8.701 7.862 0.839 17893 3483 1 12 . 1 1 12 12 LYS N N 12 122.900 122.900 119.230 3.670 17893 3484 1 12 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.024 0.198 17893 3485 1 12 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.043 0.373 17893 3486 1 12 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.388 -0.390 17893 3487 1 12 . 1 1 12 12 LYS H H 12 8.254 8.254 7.556 0.698 17893 3488 1 12 . 1 1 13 13 LYS N N 13 116.385 116.385 115.323 1.062 17893 3489 1 12 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.321 -0.024 17893 3490 1 12 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.058 -0.027 17893 3491 1 12 . 1 1 13 13 LYS CB C 13 31.549 31.549 31.955 -0.406 17893 3492 1 12 . 1 1 13 13 LYS H H 13 7.809 7.809 7.508 0.301 17893 3493 1 12 . 1 1 14 14 LYS N N 14 115.317 115.317 116.672 -1.355 17893 3494 1 12 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.946 0.036 17893 3495 1 12 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.836 0.052 17893 3496 1 12 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.088 -0.802 17893 3497 1 12 . 1 1 14 14 LYS H H 14 8.069 8.069 8.222 -0.153 17893 3498 1 12 . 1 1 15 15 ILE N N 15 118.431 118.431 121.263 -2.832 17893 3499 1 12 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.375 0.248 17893 3500 1 12 . 1 1 15 15 ILE CA C 15 59.199 59.199 60.353 -1.154 17893 3501 1 12 . 1 1 15 15 ILE CB C 15 40.896 40.896 40.138 0.758 17893 3502 1 12 . 1 1 15 15 ILE H H 15 7.569 7.569 8.073 -0.504 17893 3503 1 12 . 1 1 16 16 SER N N 16 125.034 125.034 122.994 2.040 17893 3504 1 12 . 1 1 16 16 SER HA H 16 4.585 4.585 4.724 -0.139 17893 3505 1 12 . 1 1 16 16 SER CA C 16 57.004 57.004 57.460 -0.456 17893 3506 1 12 . 1 1 16 16 SER CB C 16 64.914 64.914 64.173 0.741 17893 3507 1 12 . 1 1 16 16 SER H H 16 9.440 9.440 9.552 -0.112 17893 3508 1 12 . 1 1 17 17 GLN N N 17 120.228 120.228 121.324 -1.096 17893 3509 1 12 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.973 -0.186 17893 3510 1 12 . 1 1 17 17 GLN CA C 17 61.516 61.516 60.124 1.392 17893 3511 1 12 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.404 0.647 17893 3512 1 12 . 1 1 17 17 GLN H H 17 9.527 9.527 8.952 0.575 17893 3513 1 12 . 1 1 18 18 SER N N 18 112.979 112.979 114.958 -1.979 17893 3514 1 12 . 1 1 18 18 SER HA H 18 4.531 4.531 4.050 0.481 17893 3515 1 12 . 1 1 18 18 SER CA C 18 62.872 62.872 61.697 1.175 17893 3516 1 12 . 1 1 18 18 SER CB C 18 65.338 65.338 62.177 3.161 17893 3517 1 12 . 1 1 18 18 SER H H 18 8.949 8.949 8.635 0.314 17893 3518 1 12 . 1 1 19 19 GLU N N 19 124.147 124.147 121.892 2.255 17893 3519 1 12 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.102 0.005 17893 3520 1 12 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.709 -0.096 17893 3521 1 12 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.955 0.584 17893 3522 1 12 . 1 1 19 19 GLU H H 19 8.331 8.331 8.412 -0.081 17893 3523 1 12 . 1 1 20 20 LEU N N 20 119.943 119.943 122.332 -2.389 17893 3524 1 12 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.905 0.249 17893 3525 1 12 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.633 -0.058 17893 3526 1 12 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.378 -0.373 17893 3527 1 12 . 1 1 20 20 LEU H H 20 8.314 8.314 8.085 0.229 17893 3528 1 12 . 1 1 21 21 ALA N N 21 119.877 119.877 121.620 -1.743 17893 3529 1 12 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.904 -0.180 17893 3530 1 12 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.263 0.191 17893 3531 1 12 . 1 1 21 21 ALA CB C 21 16.861 16.861 17.983 -1.122 17893 3532 1 12 . 1 1 21 21 ALA H H 21 8.588 8.588 8.950 -0.362 17893 3533 1 12 . 1 1 22 22 ALA N N 22 117.330 117.330 122.054 -4.724 17893 3534 1 12 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.945 0.319 17893 3535 1 12 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.906 -0.297 17893 3536 1 12 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.496 -0.840 17893 3537 1 12 . 1 1 22 22 ALA H H 22 7.813 7.813 7.860 -0.047 17893 3538 1 12 . 1 1 23 23 LEU N N 23 118.586 118.586 118.539 0.047 17893 3539 1 12 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.768 0.193 17893 3540 1 12 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.237 -0.137 17893 3541 1 12 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.128 0.296 17893 3542 1 12 . 1 1 23 23 LEU H H 23 7.538 7.538 8.351 -0.813 17893 3543 1 12 . 1 1 24 24 LEU N N 24 114.488 114.488 118.201 -3.713 17893 3544 1 12 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.286 -0.022 17893 3545 1 12 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.973 -1.179 17893 3546 1 12 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.626 0.807 17893 3547 1 12 . 1 1 24 24 LEU H H 24 7.449 7.449 8.604 -1.155 17893 3548 1 12 . 1 1 25 25 GLU N N 25 114.895 114.895 113.660 1.235 17893 3549 1 12 . 1 1 25 25 GLU HA H 25 3.966 3.966 3.998 -0.032 17893 3550 1 12 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.266 -0.118 17893 3551 1 12 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.260 -0.267 17893 3552 1 12 . 1 1 25 25 GLU H H 25 8.029 8.029 7.862 0.167 17893 3553 1 12 . 1 1 26 26 VAL N N 26 109.738 109.738 113.188 -3.450 17893 3554 1 12 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.559 0.331 17893 3555 1 12 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.247 -0.966 17893 3556 1 12 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.640 0.655 17893 3557 1 12 . 1 1 26 26 VAL H H 26 7.989 7.989 7.900 0.089 17893 3558 1 12 . 1 1 27 27 SER N N 27 114.381 114.381 115.466 -1.085 17893 3559 1 12 . 1 1 27 27 SER HA H 27 4.644 4.644 4.449 0.195 17893 3560 1 12 . 1 1 27 27 SER CA C 27 56.445 56.445 57.898 -1.453 17893 3561 1 12 . 1 1 27 27 SER CB C 27 62.251 62.251 64.400 -2.150 17893 3562 1 12 . 1 1 27 27 SER H H 27 8.618 8.618 8.538 0.080 17893 3563 1 12 . 1 1 28 28 ARG N N 28 115.323 115.323 128.624 -13.301 17893 3564 1 12 . 1 1 28 28 ARG HA H 28 3.748 3.748 4.006 -0.258 17893 3565 1 12 . 1 1 28 28 ARG CA C 28 59.919 59.919 59.647 0.272 17893 3566 1 12 . 1 1 28 28 ARG CB C 28 29.050 29.050 30.330 -1.280 17893 3567 1 12 . 1 1 28 28 ARG H H 28 8.242 8.242 8.927 -0.685 17893 3568 1 12 . 1 1 29 29 GLN N N 29 117.343 117.343 116.659 0.684 17893 3569 1 12 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.040 0.134 17893 3570 1 12 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.697 0.388 17893 3571 1 12 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.521 0.047 17893 3572 1 12 . 1 1 29 29 GLN H H 29 8.827 8.827 8.537 0.290 17893 3573 1 12 . 1 1 30 30 THR N N 30 119.996 119.996 117.368 2.628 17893 3574 1 12 . 1 1 30 30 THR HA H 30 4.434 4.434 4.327 0.107 17893 3575 1 12 . 1 1 30 30 THR CA C 30 67.621 67.621 66.310 1.311 17893 3576 1 12 . 1 1 30 30 THR CB C 30 66.513 66.513 68.678 -2.165 17893 3577 1 12 . 1 1 30 30 THR H H 30 8.132 8.132 8.052 0.080 17893 3578 1 12 . 1 1 31 31 ILE N N 31 118.828 118.828 122.594 -3.766 17893 3579 1 12 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.761 0.025 17893 3580 1 12 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.846 -2.817 17893 3581 1 12 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.667 -1.590 17893 3582 1 12 . 1 1 31 31 ILE H H 31 7.163 7.163 7.913 -0.750 17893 3583 1 12 . 1 1 32 32 ASN N N 32 118.098 118.098 118.896 -0.798 17893 3584 1 12 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.396 -0.041 17893 3585 1 12 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.146 0.108 17893 3586 1 12 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.369 0.879 17893 3587 1 12 . 1 1 32 32 ASN H H 32 8.656 8.656 8.522 0.134 17893 3588 1 12 . 1 1 33 33 GLY N N 33 124.952 124.952 109.089 15.863 17893 3589 1 12 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.798 0.341 17893 3590 1 12 . 1 1 33 33 GLY H H 33 8.643 8.643 8.372 0.271 17893 3591 1 12 . 1 1 34 34 ILE N N 34 122.233 122.233 123.243 -1.010 17893 3592 1 12 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.895 0.409 17893 3593 1 12 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.505 0.299 17893 3594 1 12 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.290 -0.004 17893 3595 1 12 . 1 1 34 34 ILE H H 34 8.203 8.203 8.165 0.038 17893 3596 1 12 . 1 1 35 35 GLU N N 35 120.686 120.686 119.029 1.657 17893 3597 1 12 . 1 1 35 35 GLU HA H 35 4.214 4.214 3.957 0.257 17893 3598 1 12 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.376 0.316 17893 3599 1 12 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.290 -0.438 17893 3600 1 12 . 1 1 35 35 GLU H H 35 8.575 8.575 8.734 -0.159 17893 3601 1 12 . 1 1 36 36 LYS N N 36 116.029 116.029 119.585 -3.556 17893 3602 1 12 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.035 0.485 17893 3603 1 12 . 1 1 36 36 LYS CA C 36 55.507 55.507 59.745 -4.238 17893 3604 1 12 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.317 -1.378 17893 3605 1 12 . 1 1 36 36 LYS H H 36 8.107 8.107 7.652 0.455 17893 3606 1 12 . 1 1 37 37 ASN N N 37 114.692 114.692 109.977 4.715 17893 3607 1 12 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.741 0.008 17893 3608 1 12 . 1 1 37 37 ASN CA C 37 54.788 54.788 52.986 1.802 17893 3609 1 12 . 1 1 37 37 ASN CB C 37 36.949 36.949 38.501 -1.552 17893 3610 1 12 . 1 1 37 37 ASN H H 37 8.240 8.240 7.924 0.316 17893 3611 1 12 . 1 1 38 38 LYS N N 38 115.098 115.098 120.253 -5.155 17893 3612 1 12 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.099 0.337 17893 3613 1 12 . 1 1 38 38 LYS CA C 38 56.178 56.178 59.218 -3.040 17893 3614 1 12 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.194 0.042 17893 3615 1 12 . 1 1 38 38 LYS H H 38 8.727 8.727 8.512 0.215 17893 3616 1 12 . 1 1 39 39 TYR N N 39 117.011 117.011 112.913 4.098 17893 3617 1 12 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.762 -0.133 17893 3618 1 12 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.942 -0.383 17893 3619 1 12 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.960 0.943 17893 3620 1 12 . 1 1 39 39 TYR H H 39 7.087 7.087 7.019 0.068 17893 3621 1 12 . 1 1 40 40 ASN N N 40 123.595 123.595 120.718 2.877 17893 3622 1 12 . 1 1 40 40 ASN HA H 40 5.253 5.253 5.012 0.241 17893 3623 1 12 . 1 1 40 40 ASN CA C 40 49.772 49.772 50.822 -1.050 17893 3624 1 12 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.112 -0.636 17893 3625 1 12 . 1 1 40 40 ASN H H 40 8.842 8.842 8.477 0.365 17893 3626 1 12 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.500 -0.691 17893 3627 1 12 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.674 -0.145 17893 3628 1 12 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.331 -0.770 17893 3629 1 12 . 1 1 42 42 SER N N 42 125.580 125.580 114.540 11.040 17893 3630 1 12 . 1 1 42 42 SER HA H 42 4.581 4.581 4.243 0.338 17893 3631 1 12 . 1 1 42 42 SER CA C 42 57.380 57.380 57.623 -0.243 17893 3632 1 12 . 1 1 42 42 SER CB C 42 64.562 64.562 64.032 0.530 17893 3633 1 12 . 1 1 42 42 SER H H 42 8.033 8.033 8.117 -0.084 17893 3634 1 12 . 1 1 43 43 LEU N N 43 120.759 120.759 122.331 -1.572 17893 3635 1 12 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.054 -0.140 17893 3636 1 12 . 1 1 43 43 LEU CA C 43 58.345 58.345 57.893 0.452 17893 3637 1 12 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.541 -0.685 17893 3638 1 12 . 1 1 43 43 LEU H H 43 9.289 9.289 8.709 0.580 17893 3639 1 12 . 1 1 44 44 GLN N N 44 115.948 115.948 119.527 -3.579 17893 3640 1 12 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.033 -0.306 17893 3641 1 12 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.591 0.545 17893 3642 1 12 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.625 -0.375 17893 3643 1 12 . 1 1 44 44 GLN H H 44 8.906 8.906 7.978 0.928 17893 3644 1 12 . 1 1 45 45 LEU N N 45 119.419 119.419 118.988 0.431 17893 3645 1 12 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.023 -0.098 17893 3646 1 12 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.543 -2.939 17893 3647 1 12 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.522 -0.895 17893 3648 1 12 . 1 1 45 45 LEU H H 45 8.078 8.078 8.107 -0.029 17893 3649 1 12 . 1 1 46 46 ALA N N 46 120.544 120.544 122.245 -1.701 17893 3650 1 12 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.901 0.147 17893 3651 1 12 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.199 0.545 17893 3652 1 12 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.017 1.716 17893 3653 1 12 . 1 1 46 46 ALA H H 46 8.518 8.518 8.736 -0.218 17893 3654 1 12 . 1 1 47 47 LEU N N 47 116.461 116.461 118.928 -2.467 17893 3655 1 12 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.863 0.352 17893 3656 1 12 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.094 -0.594 17893 3657 1 12 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.628 -0.542 17893 3658 1 12 . 1 1 47 47 LEU H H 47 8.676 8.676 8.611 0.065 17893 3659 1 12 . 1 1 48 48 LYS N N 48 120.958 120.958 120.033 0.925 17893 3660 1 12 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.996 -0.396 17893 3661 1 12 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.968 -0.038 17893 3662 1 12 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.366 -0.098 17893 3663 1 12 . 1 1 48 48 LYS H H 48 8.036 8.036 8.258 -0.222 17893 3664 1 12 . 1 1 49 49 ILE N N 49 120.407 120.407 120.253 0.154 17893 3665 1 12 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.853 -0.254 17893 3666 1 12 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.703 1.499 17893 3667 1 12 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.998 -0.345 17893 3668 1 12 . 1 1 49 49 ILE H H 49 8.779 8.779 8.172 0.607 17893 3669 1 12 . 1 1 50 50 ALA N N 50 120.480 120.480 123.112 -2.632 17893 3670 1 12 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.098 -0.019 17893 3671 1 12 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.244 0.379 17893 3672 1 12 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.168 -0.163 17893 3673 1 12 . 1 1 50 50 ALA H H 50 8.173 8.173 8.364 -0.191 17893 3674 1 12 . 1 1 51 51 TYR N N 51 117.118 117.118 120.386 -3.268 17893 3675 1 12 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.974 0.391 17893 3676 1 12 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.133 -0.700 17893 3677 1 12 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.374 -0.151 17893 3678 1 12 . 1 1 51 51 TYR H H 51 8.169 8.169 8.532 -0.363 17893 3679 1 12 . 1 1 52 52 TYR N N 52 118.548 118.548 116.467 2.081 17893 3680 1 12 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.056 0.265 17893 3681 1 12 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.755 1.214 17893 3682 1 12 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.294 -0.816 17893 3683 1 12 . 1 1 52 52 TYR H H 52 9.062 9.062 8.072 0.990 17893 3684 1 12 . 1 1 53 53 LEU N N 53 115.380 115.380 116.590 -1.210 17893 3685 1 12 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.023 0.514 17893 3686 1 12 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.557 -2.413 17893 3687 1 12 . 1 1 53 53 LEU CB C 53 40.096 40.096 41.964 -1.868 17893 3688 1 12 . 1 1 53 53 LEU H H 53 8.394 8.394 8.438 -0.044 17893 3689 1 12 . 1 1 54 54 ASN N N 54 122.105 122.105 114.705 7.400 17893 3690 1 12 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.304 0.152 17893 3691 1 12 . 1 1 54 54 ASN CA C 54 53.791 53.791 53.704 0.087 17893 3692 1 12 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.571 0.188 17893 3693 1 12 . 1 1 54 54 ASN H H 54 8.091 8.091 8.011 0.080 17893 3694 1 12 . 1 1 55 55 THR N N 55 114.964 114.964 114.855 0.109 17893 3695 1 12 . 1 1 55 55 THR HA H 55 4.947 4.947 4.758 0.189 17893 3696 1 12 . 1 1 55 55 THR CA C 55 60.062 60.062 60.271 -0.209 17893 3697 1 12 . 1 1 55 55 THR CB C 55 74.945 74.945 71.357 3.588 17893 3698 1 12 . 1 1 55 55 THR H H 55 8.248 8.248 8.038 0.210 17893 3699 1 12 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.610 0.000 17893 3700 1 12 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.498 0.344 17893 3701 1 12 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.544 -0.598 17893 3702 1 12 . 1 1 57 57 LEU N N 57 127.597 127.597 125.060 2.537 17893 3703 1 12 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.126 -0.055 17893 3704 1 12 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.844 0.878 17893 3705 1 12 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.113 -0.620 17893 3706 1 12 . 1 1 57 57 LEU H H 57 9.958 9.958 8.628 1.330 17893 3707 1 12 . 1 1 58 58 GLU N N 58 123.260 123.260 118.931 4.329 17893 3708 1 12 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.372 0.514 17893 3709 1 12 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.072 -0.555 17893 3710 1 12 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.083 -0.025 17893 3711 1 12 . 1 1 58 58 GLU H H 58 9.353 9.353 8.839 0.514 17893 3712 1 12 . 1 1 59 59 ASP N N 59 117.681 117.681 118.578 -0.897 17893 3713 1 12 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.459 0.195 17893 3714 1 12 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.428 -0.805 17893 3715 1 12 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.157 -1.166 17893 3716 1 12 . 1 1 59 59 ASP H H 59 8.012 8.012 7.672 0.340 17893 3717 1 12 . 1 1 60 60 ILE N N 60 119.519 119.519 117.654 1.865 17893 3718 1 12 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.880 -0.337 17893 3719 1 12 . 1 1 60 60 ILE CA C 60 63.906 63.906 64.053 -0.147 17893 3720 1 12 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.460 -0.044 17893 3721 1 12 . 1 1 60 60 ILE H H 60 8.210 8.210 7.312 0.898 17893 3722 1 12 . 1 1 61 61 PHE N N 61 116.030 116.030 118.391 -2.361 17893 3723 1 12 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.605 -0.159 17893 3724 1 12 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.976 -0.155 17893 3725 1 12 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.181 0.784 17893 3726 1 12 . 1 1 61 61 PHE H H 61 8.530 8.530 8.875 -0.345 17893 3727 1 12 . 1 1 62 62 GLN N N 62 116.829 116.829 120.899 -4.070 17893 3728 1 12 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.935 0.122 17893 3729 1 12 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.513 0.476 17893 3730 1 12 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.056 -0.228 17893 3731 1 12 . 1 1 62 62 GLN H H 62 8.737 8.737 9.022 -0.285 17893 3732 1 12 . 1 1 63 63 TRP N N 63 125.623 125.623 125.904 -0.281 17893 3733 1 12 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.330 -0.123 17893 3734 1 12 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.325 0.206 17893 3735 1 12 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.921 -0.216 17893 3736 1 12 . 1 1 63 63 TRP H H 63 9.464 9.464 8.833 0.631 17893 3737 1 12 . 1 1 64 64 GLN N N 64 127.029 127.029 123.968 3.061 17893 3738 1 12 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.173 0.025 17893 3739 1 12 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.135 -0.633 17893 3740 1 12 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.529 1.144 17893 3741 1 12 . 1 1 64 64 GLN H H 64 7.977 7.977 8.922 -0.945 17893 3742 1 12 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.408 0.272 17893 3743 1 12 . 1 1 65 65 PRO CA C 65 61.655 61.655 64.430 -2.775 17893 3744 1 12 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.348 -0.848 17893 3745 1 13 . 1 1 2 2 ILE N N 2 123.389 123.389 120.756 2.633 17893 3746 1 13 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.065 0.056 17893 3747 1 13 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.120 1.053 17893 3748 1 13 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.309 -0.177 17893 3749 1 13 . 1 1 2 2 ILE H H 2 9.112 9.112 7.747 1.365 17893 3750 1 13 . 1 1 3 3 ILE N N 3 108.863 108.863 127.748 -18.885 17893 3751 1 13 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.169 0.264 17893 3752 1 13 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.675 -0.521 17893 3753 1 13 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.337 -0.682 17893 3754 1 13 . 1 1 3 3 ILE H H 3 9.418 9.418 9.234 0.184 17893 3755 1 13 . 1 1 4 4 ASN N N 4 123.919 123.919 126.209 -2.290 17893 3756 1 13 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.650 0.982 17893 3757 1 13 . 1 1 4 4 ASN CA C 4 51.378 51.378 51.900 -0.522 17893 3758 1 13 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.982 2.055 17893 3759 1 13 . 1 1 4 4 ASN H H 4 9.056 9.056 8.865 0.191 17893 3760 1 13 . 1 1 5 5 ASN N N 5 120.944 120.944 125.239 -4.295 17893 3761 1 13 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.729 0.714 17893 3762 1 13 . 1 1 5 5 ASN CA C 5 51.415 51.415 53.059 -1.644 17893 3763 1 13 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.237 1.576 17893 3764 1 13 . 1 1 5 5 ASN H H 5 9.383 9.383 8.958 0.425 17893 3765 1 13 . 1 1 6 6 LEU N N 6 120.594 120.594 123.307 -2.713 17893 3766 1 13 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.896 -0.129 17893 3767 1 13 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.011 0.688 17893 3768 1 13 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.687 -0.882 17893 3769 1 13 . 1 1 6 6 LEU H H 6 8.531 8.531 9.202 -0.671 17893 3770 1 13 . 1 1 7 7 LYS N N 7 118.212 118.212 117.792 0.420 17893 3771 1 13 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.236 -0.303 17893 3772 1 13 . 1 1 7 7 LYS CA C 7 60.263 60.263 58.995 1.268 17893 3773 1 13 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.450 0.853 17893 3774 1 13 . 1 1 7 7 LYS H H 7 8.933 8.933 7.715 1.218 17893 3775 1 13 . 1 1 8 8 LEU N N 8 116.414 116.414 120.581 -4.167 17893 3776 1 13 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.022 0.151 17893 3777 1 13 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.392 -0.001 17893 3778 1 13 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.832 0.196 17893 3779 1 13 . 1 1 8 8 LEU H H 8 7.667 7.667 7.553 0.114 17893 3780 1 13 . 1 1 9 9 ILE N N 9 119.134 119.134 118.863 0.271 17893 3781 1 13 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.571 0.243 17893 3782 1 13 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.361 -2.505 17893 3783 1 13 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.577 -1.115 17893 3784 1 13 . 1 1 9 9 ILE H H 9 8.226 8.226 8.445 -0.219 17893 3785 1 13 . 1 1 10 10 ARG N N 10 120.162 120.162 120.180 -0.018 17893 3786 1 13 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.916 -0.015 17893 3787 1 13 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.092 0.635 17893 3788 1 13 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.139 -1.639 17893 3789 1 13 . 1 1 10 10 ARG H H 10 9.260 9.260 8.756 0.504 17893 3790 1 13 . 1 1 11 11 GLU N N 11 115.948 115.948 117.669 -1.721 17893 3791 1 13 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.141 0.032 17893 3792 1 13 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.799 0.587 17893 3793 1 13 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.091 -0.177 17893 3794 1 13 . 1 1 11 11 GLU H H 11 8.701 8.701 8.169 0.532 17893 3795 1 13 . 1 1 12 12 LYS N N 12 122.900 122.900 119.108 3.792 17893 3796 1 13 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.082 0.140 17893 3797 1 13 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.148 0.268 17893 3798 1 13 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.813 -0.815 17893 3799 1 13 . 1 1 12 12 LYS H H 12 8.254 8.254 7.681 0.573 17893 3800 1 13 . 1 1 13 13 LYS N N 13 116.385 116.385 115.136 1.249 17893 3801 1 13 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.340 -0.043 17893 3802 1 13 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.784 -0.753 17893 3803 1 13 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.620 -1.071 17893 3804 1 13 . 1 1 13 13 LYS H H 13 7.809 7.809 7.780 0.029 17893 3805 1 13 . 1 1 14 14 LYS N N 14 115.317 115.317 116.311 -0.994 17893 3806 1 13 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.935 0.047 17893 3807 1 13 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.858 0.030 17893 3808 1 13 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.783 -1.497 17893 3809 1 13 . 1 1 14 14 LYS H H 14 8.069 8.069 7.331 0.738 17893 3810 1 13 . 1 1 15 15 ILE N N 15 118.431 118.431 120.622 -2.191 17893 3811 1 13 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.285 0.338 17893 3812 1 13 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.723 -0.524 17893 3813 1 13 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.344 2.551 17893 3814 1 13 . 1 1 15 15 ILE H H 15 7.569 7.569 7.968 -0.400 17893 3815 1 13 . 1 1 16 16 SER N N 16 125.034 125.034 122.511 2.523 17893 3816 1 13 . 1 1 16 16 SER HA H 16 4.585 4.585 4.469 0.116 17893 3817 1 13 . 1 1 16 16 SER CA C 16 57.004 57.004 57.525 -0.521 17893 3818 1 13 . 1 1 16 16 SER CB C 16 64.914 64.914 64.273 0.641 17893 3819 1 13 . 1 1 16 16 SER H H 16 9.440 9.440 8.147 1.293 17893 3820 1 13 . 1 1 17 17 GLN N N 17 120.228 120.228 127.412 -7.184 17893 3821 1 13 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.003 -0.216 17893 3822 1 13 . 1 1 17 17 GLN CA C 17 61.516 61.516 60.036 1.480 17893 3823 1 13 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.604 0.447 17893 3824 1 13 . 1 1 17 17 GLN H H 17 9.527 9.527 8.974 0.553 17893 3825 1 13 . 1 1 18 18 SER N N 18 112.979 112.979 115.340 -2.361 17893 3826 1 13 . 1 1 18 18 SER HA H 18 4.531 4.531 4.050 0.481 17893 3827 1 13 . 1 1 18 18 SER CA C 18 62.872 62.872 62.342 0.530 17893 3828 1 13 . 1 1 18 18 SER CB C 18 65.338 65.338 62.597 2.741 17893 3829 1 13 . 1 1 18 18 SER H H 18 8.949 8.949 8.156 0.793 17893 3830 1 13 . 1 1 19 19 GLU N N 19 124.147 124.147 122.604 1.543 17893 3831 1 13 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.039 0.068 17893 3832 1 13 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.997 -0.384 17893 3833 1 13 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.697 -0.158 17893 3834 1 13 . 1 1 19 19 GLU H H 19 8.331 8.331 7.595 0.736 17893 3835 1 13 . 1 1 20 20 LEU N N 20 119.943 119.943 120.974 -1.031 17893 3836 1 13 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.953 0.201 17893 3837 1 13 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.853 -0.279 17893 3838 1 13 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.569 -0.564 17893 3839 1 13 . 1 1 20 20 LEU H H 20 8.314 8.314 8.573 -0.259 17893 3840 1 13 . 1 1 21 21 ALA N N 21 119.877 119.877 121.695 -1.818 17893 3841 1 13 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.932 -0.208 17893 3842 1 13 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.185 0.269 17893 3843 1 13 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.080 -1.219 17893 3844 1 13 . 1 1 21 21 ALA H H 21 8.588 8.588 8.874 -0.286 17893 3845 1 13 . 1 1 22 22 ALA N N 22 117.330 117.330 121.390 -4.060 17893 3846 1 13 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.984 0.280 17893 3847 1 13 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.742 -0.133 17893 3848 1 13 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.466 -0.810 17893 3849 1 13 . 1 1 22 22 ALA H H 22 7.813 7.813 8.089 -0.276 17893 3850 1 13 . 1 1 23 23 LEU N N 23 118.586 118.586 118.006 0.580 17893 3851 1 13 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.669 0.292 17893 3852 1 13 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.126 -0.026 17893 3853 1 13 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.188 0.236 17893 3854 1 13 . 1 1 23 23 LEU H H 23 7.538 7.538 7.710 -0.172 17893 3855 1 13 . 1 1 24 24 LEU N N 24 114.488 114.488 115.825 -1.337 17893 3856 1 13 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.464 -0.200 17893 3857 1 13 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.379 -0.585 17893 3858 1 13 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.099 1.334 17893 3859 1 13 . 1 1 24 24 LEU H H 24 7.449 7.449 7.992 -0.543 17893 3860 1 13 . 1 1 25 25 GLU N N 25 114.895 114.895 114.269 0.626 17893 3861 1 13 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.032 -0.066 17893 3862 1 13 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.543 -0.395 17893 3863 1 13 . 1 1 25 25 GLU CB C 25 26.993 26.993 26.480 0.513 17893 3864 1 13 . 1 1 25 25 GLU H H 25 8.029 8.029 7.858 0.171 17893 3865 1 13 . 1 1 26 26 VAL N N 26 109.738 109.738 111.124 -1.386 17893 3866 1 13 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.618 0.272 17893 3867 1 13 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.204 -0.923 17893 3868 1 13 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.784 0.511 17893 3869 1 13 . 1 1 26 26 VAL H H 26 7.989 7.989 7.845 0.144 17893 3870 1 13 . 1 1 27 27 SER N N 27 114.381 114.381 115.345 -0.964 17893 3871 1 13 . 1 1 27 27 SER HA H 27 4.644 4.644 4.477 0.167 17893 3872 1 13 . 1 1 27 27 SER CA C 27 56.445 56.445 57.583 -1.138 17893 3873 1 13 . 1 1 27 27 SER CB C 27 62.251 62.251 64.512 -2.261 17893 3874 1 13 . 1 1 27 27 SER H H 27 8.618 8.618 8.544 0.074 17893 3875 1 13 . 1 1 28 28 ARG N N 28 115.323 115.323 126.941 -11.618 17893 3876 1 13 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.989 -0.241 17893 3877 1 13 . 1 1 28 28 ARG CA C 28 59.919 59.919 59.555 0.364 17893 3878 1 13 . 1 1 28 28 ARG CB C 28 29.050 29.050 30.241 -1.191 17893 3879 1 13 . 1 1 28 28 ARG H H 28 8.242 8.242 8.938 -0.696 17893 3880 1 13 . 1 1 29 29 GLN N N 29 117.343 117.343 116.503 0.840 17893 3881 1 13 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.030 0.144 17893 3882 1 13 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.639 0.445 17893 3883 1 13 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.364 0.204 17893 3884 1 13 . 1 1 29 29 GLN H H 29 8.827 8.827 8.023 0.804 17893 3885 1 13 . 1 1 30 30 THR N N 30 119.996 119.996 116.508 3.488 17893 3886 1 13 . 1 1 30 30 THR HA H 30 4.434 4.434 4.213 0.221 17893 3887 1 13 . 1 1 30 30 THR CA C 30 67.621 67.621 65.532 2.089 17893 3888 1 13 . 1 1 30 30 THR CB C 30 66.513 66.513 68.219 -1.706 17893 3889 1 13 . 1 1 30 30 THR H H 30 8.132 8.132 7.706 0.426 17893 3890 1 13 . 1 1 31 31 ILE N N 31 118.828 118.828 122.514 -3.686 17893 3891 1 13 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.763 0.023 17893 3892 1 13 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.837 -2.808 17893 3893 1 13 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.829 -1.752 17893 3894 1 13 . 1 1 31 31 ILE H H 31 7.163 7.163 7.622 -0.459 17893 3895 1 13 . 1 1 32 32 ASN N N 32 118.098 118.098 119.030 -0.932 17893 3896 1 13 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.472 -0.117 17893 3897 1 13 . 1 1 32 32 ASN CA C 32 57.254 57.254 55.854 1.400 17893 3898 1 13 . 1 1 32 32 ASN CB C 32 39.248 39.248 37.823 1.425 17893 3899 1 13 . 1 1 32 32 ASN H H 32 8.656 8.656 8.852 -0.196 17893 3900 1 13 . 1 1 33 33 GLY N N 33 124.952 124.952 109.034 15.918 17893 3901 1 13 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.967 0.173 17893 3902 1 13 . 1 1 33 33 GLY H H 33 8.643 8.643 8.732 -0.089 17893 3903 1 13 . 1 1 34 34 ILE N N 34 122.233 122.233 123.368 -1.135 17893 3904 1 13 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.016 0.288 17893 3905 1 13 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.607 0.197 17893 3906 1 13 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.041 0.245 17893 3907 1 13 . 1 1 34 34 ILE H H 34 8.203 8.203 7.632 0.571 17893 3908 1 13 . 1 1 35 35 GLU N N 35 120.686 120.686 119.887 0.799 17893 3909 1 13 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.020 0.194 17893 3910 1 13 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.337 0.355 17893 3911 1 13 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.575 -0.723 17893 3912 1 13 . 1 1 35 35 GLU H H 35 8.575 8.575 8.133 0.442 17893 3913 1 13 . 1 1 36 36 LYS N N 36 116.029 116.029 115.988 0.041 17893 3914 1 13 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.279 0.242 17893 3915 1 13 . 1 1 36 36 LYS CA C 36 55.507 55.507 55.500 0.007 17893 3916 1 13 . 1 1 36 36 LYS CB C 36 31.939 31.939 32.038 -0.099 17893 3917 1 13 . 1 1 36 36 LYS H H 36 8.107 8.107 8.060 0.047 17893 3918 1 13 . 1 1 37 37 ASN N N 37 114.692 114.692 114.197 0.495 17893 3919 1 13 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.318 0.431 17893 3920 1 13 . 1 1 37 37 ASN CA C 37 54.788 54.788 54.604 0.184 17893 3921 1 13 . 1 1 37 37 ASN CB C 37 36.949 36.949 36.367 0.583 17893 3922 1 13 . 1 1 37 37 ASN H H 37 8.240 8.240 7.959 0.281 17893 3923 1 13 . 1 1 38 38 LYS N N 38 115.098 115.098 119.500 -4.402 17893 3924 1 13 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.055 0.381 17893 3925 1 13 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.694 -2.516 17893 3926 1 13 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.282 -0.046 17893 3927 1 13 . 1 1 38 38 LYS H H 38 8.727 8.727 8.325 0.402 17893 3928 1 13 . 1 1 39 39 TYR N N 39 117.011 117.011 111.178 5.833 17893 3929 1 13 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.736 -0.107 17893 3930 1 13 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.915 -0.356 17893 3931 1 13 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.102 0.800 17893 3932 1 13 . 1 1 39 39 TYR H H 39 7.087 7.087 7.137 -0.050 17893 3933 1 13 . 1 1 40 40 ASN N N 40 123.595 123.595 120.344 3.251 17893 3934 1 13 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.906 0.347 17893 3935 1 13 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.094 -1.322 17893 3936 1 13 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.465 -0.988 17893 3937 1 13 . 1 1 40 40 ASN H H 40 8.842 8.842 8.544 0.298 17893 3938 1 13 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.527 -0.718 17893 3939 1 13 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.690 -0.161 17893 3940 1 13 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.183 -0.622 17893 3941 1 13 . 1 1 42 42 SER N N 42 125.580 125.580 115.615 9.965 17893 3942 1 13 . 1 1 42 42 SER HA H 42 4.581 4.581 4.254 0.327 17893 3943 1 13 . 1 1 42 42 SER CA C 42 57.380 57.380 58.559 -1.179 17893 3944 1 13 . 1 1 42 42 SER CB C 42 64.562 64.562 63.975 0.587 17893 3945 1 13 . 1 1 42 42 SER H H 42 8.033 8.033 8.231 -0.198 17893 3946 1 13 . 1 1 43 43 LEU N N 43 120.759 120.759 124.895 -4.136 17893 3947 1 13 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.017 -0.103 17893 3948 1 13 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.525 -0.180 17893 3949 1 13 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.593 -0.737 17893 3950 1 13 . 1 1 43 43 LEU H H 43 9.289 9.289 8.737 0.552 17893 3951 1 13 . 1 1 44 44 GLN N N 44 115.948 115.948 118.763 -2.815 17893 3952 1 13 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.071 -0.344 17893 3953 1 13 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.316 0.821 17893 3954 1 13 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.277 -0.027 17893 3955 1 13 . 1 1 44 44 GLN H H 44 8.906 8.906 8.583 0.323 17893 3956 1 13 . 1 1 45 45 LEU N N 45 119.419 119.419 119.168 0.251 17893 3957 1 13 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.978 -0.053 17893 3958 1 13 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.449 -2.845 17893 3959 1 13 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.495 -0.868 17893 3960 1 13 . 1 1 45 45 LEU H H 45 8.078 8.078 7.998 0.080 17893 3961 1 13 . 1 1 46 46 ALA N N 46 120.544 120.544 122.402 -1.858 17893 3962 1 13 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.969 0.079 17893 3963 1 13 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.285 0.459 17893 3964 1 13 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.984 1.749 17893 3965 1 13 . 1 1 46 46 ALA H H 46 8.518 8.518 8.829 -0.311 17893 3966 1 13 . 1 1 47 47 LEU N N 47 116.461 116.461 118.799 -2.338 17893 3967 1 13 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.818 0.397 17893 3968 1 13 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.106 -0.605 17893 3969 1 13 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.554 -0.468 17893 3970 1 13 . 1 1 47 47 LEU H H 47 8.676 8.676 8.428 0.248 17893 3971 1 13 . 1 1 48 48 LYS N N 48 120.958 120.958 119.937 1.021 17893 3972 1 13 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.665 -0.065 17893 3973 1 13 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.612 0.317 17893 3974 1 13 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.210 0.058 17893 3975 1 13 . 1 1 48 48 LYS H H 48 8.036 8.036 7.801 0.235 17893 3976 1 13 . 1 1 49 49 ILE N N 49 120.407 120.407 120.453 -0.046 17893 3977 1 13 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.891 -0.292 17893 3978 1 13 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.756 1.446 17893 3979 1 13 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.950 -0.297 17893 3980 1 13 . 1 1 49 49 ILE H H 49 8.779 8.779 8.412 0.367 17893 3981 1 13 . 1 1 50 50 ALA N N 50 120.480 120.480 123.522 -3.042 17893 3982 1 13 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.093 -0.014 17893 3983 1 13 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.260 0.363 17893 3984 1 13 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.305 -0.300 17893 3985 1 13 . 1 1 50 50 ALA H H 50 8.173 8.173 8.657 -0.484 17893 3986 1 13 . 1 1 51 51 TYR N N 51 117.118 117.118 120.018 -2.900 17893 3987 1 13 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.985 0.380 17893 3988 1 13 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.229 -0.796 17893 3989 1 13 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.467 -0.244 17893 3990 1 13 . 1 1 51 51 TYR H H 51 8.169 8.169 8.157 0.012 17893 3991 1 13 . 1 1 52 52 TYR N N 52 118.548 118.548 116.713 1.835 17893 3992 1 13 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.185 0.136 17893 3993 1 13 . 1 1 52 52 TYR CA C 52 62.969 62.969 60.846 2.123 17893 3994 1 13 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.257 -0.779 17893 3995 1 13 . 1 1 52 52 TYR H H 52 9.062 9.062 7.978 1.084 17893 3996 1 13 . 1 1 53 53 LEU N N 53 115.380 115.380 117.262 -1.882 17893 3997 1 13 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.076 0.461 17893 3998 1 13 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.782 -2.638 17893 3999 1 13 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.090 -1.994 17893 4000 1 13 . 1 1 53 53 LEU H H 53 8.394 8.394 8.609 -0.215 17893 4001 1 13 . 1 1 54 54 ASN N N 54 122.105 122.105 113.865 8.240 17893 4002 1 13 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.315 0.141 17893 4003 1 13 . 1 1 54 54 ASN CA C 54 53.791 53.791 53.832 -0.041 17893 4004 1 13 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.157 0.600 17893 4005 1 13 . 1 1 54 54 ASN H H 54 8.091 8.091 8.139 -0.048 17893 4006 1 13 . 1 1 55 55 THR N N 55 114.964 114.964 114.293 0.671 17893 4007 1 13 . 1 1 55 55 THR HA H 55 4.947 4.947 4.812 0.135 17893 4008 1 13 . 1 1 55 55 THR CA C 55 60.062 60.062 59.134 0.928 17893 4009 1 13 . 1 1 55 55 THR CB C 55 74.945 74.945 70.609 4.336 17893 4010 1 13 . 1 1 55 55 THR H H 55 8.248 8.248 7.807 0.441 17893 4011 1 13 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.558 0.052 17893 4012 1 13 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.826 0.016 17893 4013 1 13 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.614 -0.668 17893 4014 1 13 . 1 1 57 57 LEU N N 57 127.597 127.597 124.940 2.657 17893 4015 1 13 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.069 0.002 17893 4016 1 13 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.898 0.824 17893 4017 1 13 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.092 -0.599 17893 4018 1 13 . 1 1 57 57 LEU H H 57 9.958 9.958 8.613 1.345 17893 4019 1 13 . 1 1 58 58 GLU N N 58 123.260 123.260 118.804 4.456 17893 4020 1 13 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.369 0.517 17893 4021 1 13 . 1 1 58 58 GLU CA C 58 58.517 58.517 58.973 -0.456 17893 4022 1 13 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.076 -0.018 17893 4023 1 13 . 1 1 58 58 GLU H H 58 9.353 9.353 8.800 0.553 17893 4024 1 13 . 1 1 59 59 ASP N N 59 117.681 117.681 118.783 -1.102 17893 4025 1 13 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.430 0.224 17893 4026 1 13 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.434 -0.811 17893 4027 1 13 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.068 -1.077 17893 4028 1 13 . 1 1 59 59 ASP H H 59 8.012 8.012 7.863 0.149 17893 4029 1 13 . 1 1 60 60 ILE N N 60 119.519 119.519 117.125 2.394 17893 4030 1 13 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.836 -0.293 17893 4031 1 13 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.319 0.587 17893 4032 1 13 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.184 0.232 17893 4033 1 13 . 1 1 60 60 ILE H H 60 8.210 8.210 7.202 1.008 17893 4034 1 13 . 1 1 61 61 PHE N N 61 116.030 116.030 118.427 -2.397 17893 4035 1 13 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.774 -0.328 17893 4036 1 13 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.700 0.120 17893 4037 1 13 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.214 0.751 17893 4038 1 13 . 1 1 61 61 PHE H H 61 8.530 8.530 8.705 -0.175 17893 4039 1 13 . 1 1 62 62 GLN N N 62 116.829 116.829 120.776 -3.947 17893 4040 1 13 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.954 0.103 17893 4041 1 13 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.741 0.248 17893 4042 1 13 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.082 -0.254 17893 4043 1 13 . 1 1 62 62 GLN H H 62 8.737 8.737 8.765 -0.028 17893 4044 1 13 . 1 1 63 63 TRP N N 63 125.623 125.623 124.862 0.761 17893 4045 1 13 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.377 -0.170 17893 4046 1 13 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.304 0.227 17893 4047 1 13 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.987 -0.283 17893 4048 1 13 . 1 1 63 63 TRP H H 63 9.464 9.464 8.853 0.611 17893 4049 1 13 . 1 1 64 64 GLN N N 64 127.029 127.029 122.676 4.353 17893 4050 1 13 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.474 -0.276 17893 4051 1 13 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.482 -0.980 17893 4052 1 13 . 1 1 64 64 GLN CB C 64 30.673 30.673 30.263 0.410 17893 4053 1 13 . 1 1 64 64 GLN H H 64 7.977 7.977 8.977 -1.000 17893 4054 1 13 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.510 0.170 17893 4055 1 13 . 1 1 65 65 PRO CA C 65 61.655 61.655 62.811 -1.156 17893 4056 1 13 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.320 -0.820 17893 4057 1 14 . 1 1 2 2 ILE N N 2 123.389 123.389 120.923 2.466 17893 4058 1 14 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.054 0.067 17893 4059 1 14 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.046 1.127 17893 4060 1 14 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.867 0.265 17893 4061 1 14 . 1 1 2 2 ILE H H 2 9.112 9.112 7.701 1.411 17893 4062 1 14 . 1 1 3 3 ILE N N 3 108.863 108.863 128.192 -19.329 17893 4063 1 14 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.245 0.188 17893 4064 1 14 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.495 -0.341 17893 4065 1 14 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.508 -0.853 17893 4066 1 14 . 1 1 3 3 ILE H H 3 9.418 9.418 9.333 0.085 17893 4067 1 14 . 1 1 4 4 ASN N N 4 123.919 123.919 126.685 -2.766 17893 4068 1 14 . 1 1 4 4 ASN HA H 4 5.632 5.632 5.310 0.322 17893 4069 1 14 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.009 -0.631 17893 4070 1 14 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.152 1.885 17893 4071 1 14 . 1 1 4 4 ASN H H 4 9.056 9.056 8.960 0.096 17893 4072 1 14 . 1 1 5 5 ASN N N 5 120.944 120.944 125.926 -4.982 17893 4073 1 14 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.828 0.615 17893 4074 1 14 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.889 -1.474 17893 4075 1 14 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.244 1.569 17893 4076 1 14 . 1 1 5 5 ASN H H 5 9.383 9.383 9.417 -0.034 17893 4077 1 14 . 1 1 6 6 LEU N N 6 120.594 120.594 123.271 -2.677 17893 4078 1 14 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.859 -0.092 17893 4079 1 14 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.206 0.493 17893 4080 1 14 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.620 -0.815 17893 4081 1 14 . 1 1 6 6 LEU H H 6 8.531 8.531 9.465 -0.934 17893 4082 1 14 . 1 1 7 7 LYS N N 7 118.212 118.212 117.587 0.625 17893 4083 1 14 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.014 -0.081 17893 4084 1 14 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.303 0.960 17893 4085 1 14 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.374 0.929 17893 4086 1 14 . 1 1 7 7 LYS H H 7 8.933 8.933 7.973 0.960 17893 4087 1 14 . 1 1 8 8 LEU N N 8 116.414 116.414 120.725 -4.311 17893 4088 1 14 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.024 0.149 17893 4089 1 14 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.396 -0.006 17893 4090 1 14 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.803 0.225 17893 4091 1 14 . 1 1 8 8 LEU H H 8 7.667 7.667 7.584 0.083 17893 4092 1 14 . 1 1 9 9 ILE N N 9 119.134 119.134 118.783 0.351 17893 4093 1 14 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.560 0.254 17893 4094 1 14 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.340 -2.484 17893 4095 1 14 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.610 -1.148 17893 4096 1 14 . 1 1 9 9 ILE H H 9 8.226 8.226 8.730 -0.504 17893 4097 1 14 . 1 1 10 10 ARG N N 10 120.162 120.162 120.238 -0.076 17893 4098 1 14 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.901 0.000 17893 4099 1 14 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.941 0.786 17893 4100 1 14 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.145 -1.646 17893 4101 1 14 . 1 1 10 10 ARG H H 10 9.260 9.260 8.722 0.538 17893 4102 1 14 . 1 1 11 11 GLU N N 11 115.948 115.948 117.820 -1.872 17893 4103 1 14 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.124 0.049 17893 4104 1 14 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.762 0.624 17893 4105 1 14 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.049 -0.135 17893 4106 1 14 . 1 1 11 11 GLU H H 11 8.701 8.701 8.540 0.161 17893 4107 1 14 . 1 1 12 12 LYS N N 12 122.900 122.900 120.185 2.715 17893 4108 1 14 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.028 0.194 17893 4109 1 14 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.557 -0.141 17893 4110 1 14 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.618 -0.620 17893 4111 1 14 . 1 1 12 12 LYS H H 12 8.254 8.254 7.887 0.367 17893 4112 1 14 . 1 1 13 13 LYS N N 13 116.385 116.385 115.120 1.265 17893 4113 1 14 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.360 -0.063 17893 4114 1 14 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.793 -0.762 17893 4115 1 14 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.218 -0.669 17893 4116 1 14 . 1 1 13 13 LYS H H 13 7.809 7.809 7.544 0.265 17893 4117 1 14 . 1 1 14 14 LYS N N 14 115.317 115.317 114.041 1.276 17893 4118 1 14 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.857 0.125 17893 4119 1 14 . 1 1 14 14 LYS CA C 14 56.888 56.888 57.079 -0.191 17893 4120 1 14 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.245 -0.959 17893 4121 1 14 . 1 1 14 14 LYS H H 14 8.069 8.069 7.754 0.315 17893 4122 1 14 . 1 1 15 15 ILE N N 15 118.431 118.431 120.809 -2.378 17893 4123 1 14 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.080 0.543 17893 4124 1 14 . 1 1 15 15 ILE CA C 15 59.199 59.199 61.325 -2.126 17893 4125 1 14 . 1 1 15 15 ILE CB C 15 40.896 40.896 39.076 1.820 17893 4126 1 14 . 1 1 15 15 ILE H H 15 7.569 7.569 7.701 -0.132 17893 4127 1 14 . 1 1 16 16 SER N N 16 125.034 125.034 122.591 2.443 17893 4128 1 14 . 1 1 16 16 SER HA H 16 4.585 4.585 4.504 0.081 17893 4129 1 14 . 1 1 16 16 SER CA C 16 57.004 57.004 58.103 -1.099 17893 4130 1 14 . 1 1 16 16 SER CB C 16 64.914 64.914 65.263 -0.349 17893 4131 1 14 . 1 1 16 16 SER H H 16 9.440 9.440 8.422 1.018 17893 4132 1 14 . 1 1 17 17 GLN N N 17 120.228 120.228 123.332 -3.104 17893 4133 1 14 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.005 -0.218 17893 4134 1 14 . 1 1 17 17 GLN CA C 17 61.516 61.516 60.108 1.408 17893 4135 1 14 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.504 0.547 17893 4136 1 14 . 1 1 17 17 GLN H H 17 9.527 9.527 9.006 0.521 17893 4137 1 14 . 1 1 18 18 SER N N 18 112.979 112.979 116.087 -3.108 17893 4138 1 14 . 1 1 18 18 SER HA H 18 4.531 4.531 4.088 0.443 17893 4139 1 14 . 1 1 18 18 SER CA C 18 62.872 62.872 62.496 0.376 17893 4140 1 14 . 1 1 18 18 SER CB C 18 65.338 65.338 62.459 2.879 17893 4141 1 14 . 1 1 18 18 SER H H 18 8.949 8.949 8.510 0.439 17893 4142 1 14 . 1 1 19 19 GLU N N 19 124.147 124.147 122.405 1.742 17893 4143 1 14 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.044 0.063 17893 4144 1 14 . 1 1 19 19 GLU CA C 19 58.613 58.613 59.366 -0.753 17893 4145 1 14 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.512 0.027 17893 4146 1 14 . 1 1 19 19 GLU H H 19 8.331 8.331 8.530 -0.199 17893 4147 1 14 . 1 1 20 20 LEU N N 20 119.943 119.943 120.549 -0.606 17893 4148 1 14 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.984 0.170 17893 4149 1 14 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.768 -0.194 17893 4150 1 14 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.558 -0.553 17893 4151 1 14 . 1 1 20 20 LEU H H 20 8.314 8.314 8.332 -0.018 17893 4152 1 14 . 1 1 21 21 ALA N N 21 119.877 119.877 121.673 -1.796 17893 4153 1 14 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.920 -0.196 17893 4154 1 14 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.135 0.319 17893 4155 1 14 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.090 -1.228 17893 4156 1 14 . 1 1 21 21 ALA H H 21 8.588 8.588 8.947 -0.359 17893 4157 1 14 . 1 1 22 22 ALA N N 22 117.330 117.330 121.695 -4.365 17893 4158 1 14 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.986 0.278 17893 4159 1 14 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.772 -0.163 17893 4160 1 14 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.401 -0.745 17893 4161 1 14 . 1 1 22 22 ALA H H 22 7.813 7.813 8.224 -0.411 17893 4162 1 14 . 1 1 23 23 LEU N N 23 118.586 118.586 119.120 -0.534 17893 4163 1 14 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.641 0.320 17893 4164 1 14 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.128 -0.028 17893 4165 1 14 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.233 0.191 17893 4166 1 14 . 1 1 23 23 LEU H H 23 7.538 7.538 7.543 -0.005 17893 4167 1 14 . 1 1 24 24 LEU N N 24 114.488 114.488 114.077 0.411 17893 4168 1 14 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.348 -0.084 17893 4169 1 14 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.285 -0.491 17893 4170 1 14 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.974 1.459 17893 4171 1 14 . 1 1 24 24 LEU H H 24 7.449 7.449 7.556 -0.107 17893 4172 1 14 . 1 1 25 25 GLU N N 25 114.895 114.895 116.247 -1.352 17893 4173 1 14 . 1 1 25 25 GLU HA H 25 3.966 3.966 3.974 -0.008 17893 4174 1 14 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.285 -0.137 17893 4175 1 14 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.467 -0.474 17893 4176 1 14 . 1 1 25 25 GLU H H 25 8.029 8.029 7.613 0.416 17893 4177 1 14 . 1 1 26 26 VAL N N 26 109.738 109.738 111.722 -1.984 17893 4178 1 14 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.772 0.118 17893 4179 1 14 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.695 -1.414 17893 4180 1 14 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.177 0.118 17893 4181 1 14 . 1 1 26 26 VAL H H 26 7.989 7.989 7.926 0.063 17893 4182 1 14 . 1 1 27 27 SER N N 27 114.381 114.381 116.095 -1.714 17893 4183 1 14 . 1 1 27 27 SER HA H 27 4.644 4.644 4.495 0.149 17893 4184 1 14 . 1 1 27 27 SER CA C 27 56.445 56.445 58.342 -1.897 17893 4185 1 14 . 1 1 27 27 SER CB C 27 62.251 62.251 64.185 -1.934 17893 4186 1 14 . 1 1 27 27 SER H H 27 8.618 8.618 8.408 0.210 17893 4187 1 14 . 1 1 28 28 ARG N N 28 115.323 115.323 124.149 -8.826 17893 4188 1 14 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.997 -0.249 17893 4189 1 14 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.235 -0.316 17893 4190 1 14 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.991 -0.942 17893 4191 1 14 . 1 1 28 28 ARG H H 28 8.242 8.242 8.947 -0.705 17893 4192 1 14 . 1 1 29 29 GLN N N 29 117.343 117.343 116.189 1.154 17893 4193 1 14 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.079 0.095 17893 4194 1 14 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.017 0.068 17893 4195 1 14 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.701 -0.133 17893 4196 1 14 . 1 1 29 29 GLN H H 29 8.827 8.827 8.905 -0.078 17893 4197 1 14 . 1 1 30 30 THR N N 30 119.996 119.996 117.075 2.921 17893 4198 1 14 . 1 1 30 30 THR HA H 30 4.434 4.434 4.236 0.198 17893 4199 1 14 . 1 1 30 30 THR CA C 30 67.621 67.621 65.671 1.950 17893 4200 1 14 . 1 1 30 30 THR CB C 30 66.513 66.513 68.364 -1.851 17893 4201 1 14 . 1 1 30 30 THR H H 30 8.132 8.132 7.634 0.498 17893 4202 1 14 . 1 1 31 31 ILE N N 31 118.828 118.828 122.732 -3.904 17893 4203 1 14 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.833 -0.047 17893 4204 1 14 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.725 -2.696 17893 4205 1 14 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.717 -1.640 17893 4206 1 14 . 1 1 31 31 ILE H H 31 7.163 7.163 7.378 -0.215 17893 4207 1 14 . 1 1 32 32 ASN N N 32 118.098 118.098 119.236 -1.138 17893 4208 1 14 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.365 -0.010 17893 4209 1 14 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.255 -0.001 17893 4210 1 14 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.336 0.912 17893 4211 1 14 . 1 1 32 32 ASN H H 32 8.656 8.656 8.676 -0.020 17893 4212 1 14 . 1 1 33 33 GLY N N 33 124.952 124.952 108.927 16.025 17893 4213 1 14 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.872 0.268 17893 4214 1 14 . 1 1 33 33 GLY H H 33 8.643 8.643 8.686 -0.043 17893 4215 1 14 . 1 1 34 34 ILE N N 34 122.233 122.233 122.924 -0.691 17893 4216 1 14 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.072 0.232 17893 4217 1 14 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.664 0.140 17893 4218 1 14 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.190 0.096 17893 4219 1 14 . 1 1 34 34 ILE H H 34 8.203 8.203 7.716 0.487 17893 4220 1 14 . 1 1 35 35 GLU N N 35 120.686 120.686 118.706 1.980 17893 4221 1 14 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.086 0.128 17893 4222 1 14 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.615 0.077 17893 4223 1 14 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.930 -1.078 17893 4224 1 14 . 1 1 35 35 GLU H H 35 8.575 8.575 8.551 0.024 17893 4225 1 14 . 1 1 36 36 LYS N N 36 116.029 116.029 119.106 -3.077 17893 4226 1 14 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.159 0.362 17893 4227 1 14 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.128 -2.621 17893 4228 1 14 . 1 1 36 36 LYS CB C 36 31.939 31.939 32.836 -0.897 17893 4229 1 14 . 1 1 36 36 LYS H H 36 8.107 8.107 8.567 -0.460 17893 4230 1 14 . 1 1 37 37 ASN N N 37 114.692 114.692 113.351 1.341 17893 4231 1 14 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.820 -0.071 17893 4232 1 14 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.122 1.666 17893 4233 1 14 . 1 1 37 37 ASN CB C 37 36.949 36.949 39.257 -2.308 17893 4234 1 14 . 1 1 37 37 ASN H H 37 8.240 8.240 8.521 -0.281 17893 4235 1 14 . 1 1 38 38 LYS N N 38 115.098 115.098 121.762 -6.664 17893 4236 1 14 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.082 0.354 17893 4237 1 14 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.637 -2.459 17893 4238 1 14 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.091 0.145 17893 4239 1 14 . 1 1 38 38 LYS H H 38 8.727 8.727 7.938 0.789 17893 4240 1 14 . 1 1 39 39 TYR N N 39 117.011 117.011 112.167 4.844 17893 4241 1 14 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.743 -0.114 17893 4242 1 14 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.861 -0.302 17893 4243 1 14 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.901 1.002 17893 4244 1 14 . 1 1 39 39 TYR H H 39 7.087 7.087 7.298 -0.211 17893 4245 1 14 . 1 1 40 40 ASN N N 40 123.595 123.595 120.638 2.957 17893 4246 1 14 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.906 0.347 17893 4247 1 14 . 1 1 40 40 ASN CA C 40 49.772 49.772 50.923 -1.151 17893 4248 1 14 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.037 -0.561 17893 4249 1 14 . 1 1 40 40 ASN H H 40 8.842 8.842 8.450 0.392 17893 4250 1 14 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.680 -0.871 17893 4251 1 14 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.503 0.026 17893 4252 1 14 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.611 -1.050 17893 4253 1 14 . 1 1 42 42 SER N N 42 125.580 125.580 115.276 10.304 17893 4254 1 14 . 1 1 42 42 SER HA H 42 4.581 4.581 4.244 0.337 17893 4255 1 14 . 1 1 42 42 SER CA C 42 57.380 57.380 57.999 -0.619 17893 4256 1 14 . 1 1 42 42 SER CB C 42 64.562 64.562 64.278 0.284 17893 4257 1 14 . 1 1 42 42 SER H H 42 8.033 8.033 8.141 -0.108 17893 4258 1 14 . 1 1 43 43 LEU N N 43 120.759 120.759 123.624 -2.865 17893 4259 1 14 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.040 -0.126 17893 4260 1 14 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.277 0.068 17893 4261 1 14 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.372 -0.516 17893 4262 1 14 . 1 1 43 43 LEU H H 43 9.289 9.289 8.769 0.520 17893 4263 1 14 . 1 1 44 44 GLN N N 44 115.948 115.948 118.229 -2.281 17893 4264 1 14 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.067 -0.340 17893 4265 1 14 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.271 0.865 17893 4266 1 14 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.331 -0.081 17893 4267 1 14 . 1 1 44 44 GLN H H 44 8.906 8.906 8.453 0.453 17893 4268 1 14 . 1 1 45 45 LEU N N 45 119.419 119.419 120.491 -1.072 17893 4269 1 14 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.011 -0.086 17893 4270 1 14 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.621 -3.017 17893 4271 1 14 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.769 -1.142 17893 4272 1 14 . 1 1 45 45 LEU H H 45 8.078 8.078 8.569 -0.491 17893 4273 1 14 . 1 1 46 46 ALA N N 46 120.544 120.544 122.425 -1.881 17893 4274 1 14 . 1 1 46 46 ALA HA H 46 4.048 4.048 4.268 -0.220 17893 4275 1 14 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.512 0.232 17893 4276 1 14 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.140 1.593 17893 4277 1 14 . 1 1 46 46 ALA H H 46 8.518 8.518 8.790 -0.272 17893 4278 1 14 . 1 1 47 47 LEU N N 47 116.461 116.461 118.693 -2.232 17893 4279 1 14 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.873 0.342 17893 4280 1 14 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.061 -0.560 17893 4281 1 14 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.615 -0.529 17893 4282 1 14 . 1 1 47 47 LEU H H 47 8.676 8.676 8.332 0.344 17893 4283 1 14 . 1 1 48 48 LYS N N 48 120.958 120.958 120.068 0.890 17893 4284 1 14 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.759 -0.159 17893 4285 1 14 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.769 0.160 17893 4286 1 14 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.320 -0.052 17893 4287 1 14 . 1 1 48 48 LYS H H 48 8.036 8.036 8.057 -0.021 17893 4288 1 14 . 1 1 49 49 ILE N N 49 120.407 120.407 120.470 -0.063 17893 4289 1 14 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.914 -0.315 17893 4290 1 14 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.813 1.389 17893 4291 1 14 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.927 -0.274 17893 4292 1 14 . 1 1 49 49 ILE H H 49 8.779 8.779 8.571 0.208 17893 4293 1 14 . 1 1 50 50 ALA N N 50 120.480 120.480 123.587 -3.107 17893 4294 1 14 . 1 1 50 50 ALA HA H 50 4.079 4.079 3.978 0.101 17893 4295 1 14 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.401 0.222 17893 4296 1 14 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.184 -0.179 17893 4297 1 14 . 1 1 50 50 ALA H H 50 8.173 8.173 8.543 -0.370 17893 4298 1 14 . 1 1 51 51 TYR N N 51 117.118 117.118 120.118 -3.000 17893 4299 1 14 . 1 1 51 51 TYR HA H 51 4.365 4.365 4.001 0.364 17893 4300 1 14 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.037 -0.604 17893 4301 1 14 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.388 -0.165 17893 4302 1 14 . 1 1 51 51 TYR H H 51 8.169 8.169 8.265 -0.096 17893 4303 1 14 . 1 1 52 52 TYR N N 52 118.548 118.548 116.252 2.296 17893 4304 1 14 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.117 0.204 17893 4305 1 14 . 1 1 52 52 TYR CA C 52 62.969 62.969 60.970 1.999 17893 4306 1 14 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.170 -0.692 17893 4307 1 14 . 1 1 52 52 TYR H H 52 9.062 9.062 8.080 0.982 17893 4308 1 14 . 1 1 53 53 LEU N N 53 115.380 115.380 116.422 -1.042 17893 4309 1 14 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.063 0.474 17893 4310 1 14 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.681 -2.537 17893 4311 1 14 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.451 -2.355 17893 4312 1 14 . 1 1 53 53 LEU H H 53 8.394 8.394 8.691 -0.297 17893 4313 1 14 . 1 1 54 54 ASN N N 54 122.105 122.105 114.691 7.414 17893 4314 1 14 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.372 0.084 17893 4315 1 14 . 1 1 54 54 ASN CA C 54 53.791 53.791 53.905 -0.114 17893 4316 1 14 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.304 0.454 17893 4317 1 14 . 1 1 54 54 ASN H H 54 8.091 8.091 8.389 -0.298 17893 4318 1 14 . 1 1 55 55 THR N N 55 114.964 114.964 114.997 -0.033 17893 4319 1 14 . 1 1 55 55 THR HA H 55 4.947 4.947 4.703 0.244 17893 4320 1 14 . 1 1 55 55 THR CA C 55 60.062 60.062 59.639 0.423 17893 4321 1 14 . 1 1 55 55 THR CB C 55 74.945 74.945 71.516 3.429 17893 4322 1 14 . 1 1 55 55 THR H H 55 8.248 8.248 8.038 0.210 17893 4323 1 14 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.620 -0.010 17893 4324 1 14 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.503 0.339 17893 4325 1 14 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.650 -0.704 17893 4326 1 14 . 1 1 57 57 LEU N N 57 127.597 127.597 124.894 2.703 17893 4327 1 14 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.025 0.046 17893 4328 1 14 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.634 1.088 17893 4329 1 14 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.119 -0.626 17893 4330 1 14 . 1 1 57 57 LEU H H 57 9.958 9.958 8.559 1.399 17893 4331 1 14 . 1 1 58 58 GLU N N 58 123.260 123.260 118.691 4.569 17893 4332 1 14 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.366 0.520 17893 4333 1 14 . 1 1 58 58 GLU CA C 58 58.517 58.517 58.777 -0.260 17893 4334 1 14 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.000 0.058 17893 4335 1 14 . 1 1 58 58 GLU H H 58 9.353 9.353 8.793 0.560 17893 4336 1 14 . 1 1 59 59 ASP N N 59 117.681 117.681 118.700 -1.019 17893 4337 1 14 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.424 0.230 17893 4338 1 14 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.306 -0.683 17893 4339 1 14 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.058 -1.067 17893 4340 1 14 . 1 1 59 59 ASP H H 59 8.012 8.012 7.701 0.311 17893 4341 1 14 . 1 1 60 60 ILE N N 60 119.519 119.519 117.317 2.202 17893 4342 1 14 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.680 -0.137 17893 4343 1 14 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.614 0.291 17893 4344 1 14 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.868 0.548 17893 4345 1 14 . 1 1 60 60 ILE H H 60 8.210 8.210 7.319 0.891 17893 4346 1 14 . 1 1 61 61 PHE N N 61 116.030 116.030 118.124 -2.094 17893 4347 1 14 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.689 -0.243 17893 4348 1 14 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.094 0.727 17893 4349 1 14 . 1 1 61 61 PHE CB C 61 41.965 41.965 40.215 1.750 17893 4350 1 14 . 1 1 61 61 PHE H H 61 8.530 8.530 8.471 0.059 17893 4351 1 14 . 1 1 62 62 GLN N N 62 116.829 116.829 120.908 -4.079 17893 4352 1 14 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.987 0.070 17893 4353 1 14 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.668 0.321 17893 4354 1 14 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.011 -0.183 17893 4355 1 14 . 1 1 62 62 GLN H H 62 8.737 8.737 9.097 -0.360 17893 4356 1 14 . 1 1 63 63 TRP N N 63 125.623 125.623 124.969 0.654 17893 4357 1 14 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.514 -0.307 17893 4358 1 14 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.248 0.283 17893 4359 1 14 . 1 1 63 63 TRP CB C 63 30.704 30.704 31.248 -0.544 17893 4360 1 14 . 1 1 63 63 TRP H H 63 9.464 9.464 8.826 0.638 17893 4361 1 14 . 1 1 64 64 GLN N N 64 127.029 127.029 121.992 5.037 17893 4362 1 14 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.290 -0.092 17893 4363 1 14 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.410 -0.908 17893 4364 1 14 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.654 1.019 17893 4365 1 14 . 1 1 64 64 GLN H H 64 7.977 7.977 8.796 -0.819 17893 4366 1 14 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.543 0.137 17893 4367 1 14 . 1 1 65 65 PRO CA C 65 61.655 61.655 62.994 -1.339 17893 4368 1 14 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.141 -0.641 17893 4369 1 15 . 1 1 2 2 ILE N N 2 123.389 123.389 120.918 2.471 17893 4370 1 15 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.002 0.119 17893 4371 1 15 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.324 0.849 17893 4372 1 15 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.076 0.056 17893 4373 1 15 . 1 1 2 2 ILE H H 2 9.112 9.112 7.761 1.351 17893 4374 1 15 . 1 1 3 3 ILE N N 3 108.863 108.863 128.685 -19.822 17893 4375 1 15 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.183 0.250 17893 4376 1 15 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.506 -0.352 17893 4377 1 15 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.658 -1.004 17893 4378 1 15 . 1 1 3 3 ILE H H 3 9.418 9.418 9.383 0.035 17893 4379 1 15 . 1 1 4 4 ASN N N 4 123.919 123.919 126.391 -2.472 17893 4380 1 15 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.914 0.718 17893 4381 1 15 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.365 -0.987 17893 4382 1 15 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.020 2.017 17893 4383 1 15 . 1 1 4 4 ASN H H 4 9.056 9.056 8.893 0.163 17893 4384 1 15 . 1 1 5 5 ASN N N 5 120.944 120.944 125.510 -4.566 17893 4385 1 15 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.819 0.624 17893 4386 1 15 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.880 -1.465 17893 4387 1 15 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.343 1.470 17893 4388 1 15 . 1 1 5 5 ASN H H 5 9.383 9.383 9.241 0.142 17893 4389 1 15 . 1 1 6 6 LEU N N 6 120.594 120.594 123.807 -3.213 17893 4390 1 15 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.862 -0.095 17893 4391 1 15 . 1 1 6 6 LEU CA C 6 59.699 59.699 58.680 1.019 17893 4392 1 15 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.624 -0.819 17893 4393 1 15 . 1 1 6 6 LEU H H 6 8.531 8.531 8.967 -0.436 17893 4394 1 15 . 1 1 7 7 LYS N N 7 118.212 118.212 118.425 -0.213 17893 4395 1 15 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.998 -0.065 17893 4396 1 15 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.420 0.843 17893 4397 1 15 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.506 0.797 17893 4398 1 15 . 1 1 7 7 LYS H H 7 8.933 8.933 7.775 1.158 17893 4399 1 15 . 1 1 8 8 LEU N N 8 116.414 116.414 120.658 -4.244 17893 4400 1 15 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.027 0.146 17893 4401 1 15 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.335 0.055 17893 4402 1 15 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.887 0.141 17893 4403 1 15 . 1 1 8 8 LEU H H 8 7.667 7.667 7.544 0.123 17893 4404 1 15 . 1 1 9 9 ILE N N 9 119.134 119.134 119.170 -0.036 17893 4405 1 15 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.545 0.269 17893 4406 1 15 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.490 -2.634 17893 4407 1 15 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.525 -1.063 17893 4408 1 15 . 1 1 9 9 ILE H H 9 8.226 8.226 8.696 -0.470 17893 4409 1 15 . 1 1 10 10 ARG N N 10 120.162 120.162 119.802 0.360 17893 4410 1 15 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.834 0.067 17893 4411 1 15 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.996 0.731 17893 4412 1 15 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.178 -1.679 17893 4413 1 15 . 1 1 10 10 ARG H H 10 9.260 9.260 8.762 0.498 17893 4414 1 15 . 1 1 11 11 GLU N N 11 115.948 115.948 118.527 -2.579 17893 4415 1 15 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.110 0.063 17893 4416 1 15 . 1 1 11 11 GLU CA C 11 59.386 59.386 59.118 0.268 17893 4417 1 15 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.021 -0.107 17893 4418 1 15 . 1 1 11 11 GLU H H 11 8.701 8.701 7.863 0.838 17893 4419 1 15 . 1 1 12 12 LYS N N 12 122.900 122.900 120.557 2.343 17893 4420 1 15 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.085 0.137 17893 4421 1 15 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.191 0.225 17893 4422 1 15 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.573 -0.575 17893 4423 1 15 . 1 1 12 12 LYS H H 12 8.254 8.254 8.162 0.091 17893 4424 1 15 . 1 1 13 13 LYS N N 13 116.385 116.385 114.628 1.757 17893 4425 1 15 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.403 -0.106 17893 4426 1 15 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.510 -0.479 17893 4427 1 15 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.920 -1.371 17893 4428 1 15 . 1 1 13 13 LYS H H 13 7.809 7.809 7.668 0.141 17893 4429 1 15 . 1 1 14 14 LYS N N 14 115.317 115.317 117.228 -1.911 17893 4430 1 15 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.972 0.010 17893 4431 1 15 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.872 0.016 17893 4432 1 15 . 1 1 14 14 LYS CB C 14 28.286 28.286 30.079 -1.793 17893 4433 1 15 . 1 1 14 14 LYS H H 14 8.069 8.069 7.299 0.770 17893 4434 1 15 . 1 1 15 15 ILE N N 15 118.431 118.431 120.554 -2.123 17893 4435 1 15 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.059 0.564 17893 4436 1 15 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.719 -0.520 17893 4437 1 15 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.438 2.458 17893 4438 1 15 . 1 1 15 15 ILE H H 15 7.569 7.569 8.270 -0.701 17893 4439 1 15 . 1 1 16 16 SER N N 16 125.034 125.034 123.138 1.896 17893 4440 1 15 . 1 1 16 16 SER HA H 16 4.585 4.585 4.514 0.071 17893 4441 1 15 . 1 1 16 16 SER CA C 16 57.004 57.004 58.979 -1.975 17893 4442 1 15 . 1 1 16 16 SER CB C 16 64.914 64.914 64.026 0.888 17893 4443 1 15 . 1 1 16 16 SER H H 16 9.440 9.440 8.533 0.907 17893 4444 1 15 . 1 1 17 17 GLN N N 17 120.228 120.228 123.873 -3.645 17893 4445 1 15 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.983 -0.196 17893 4446 1 15 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.806 1.710 17893 4447 1 15 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.557 0.494 17893 4448 1 15 . 1 1 17 17 GLN H H 17 9.527 9.527 8.969 0.558 17893 4449 1 15 . 1 1 18 18 SER N N 18 112.979 112.979 114.706 -1.727 17893 4450 1 15 . 1 1 18 18 SER HA H 18 4.531 4.531 4.090 0.441 17893 4451 1 15 . 1 1 18 18 SER CA C 18 62.872 62.872 61.401 1.472 17893 4452 1 15 . 1 1 18 18 SER CB C 18 65.338 65.338 62.292 3.046 17893 4453 1 15 . 1 1 18 18 SER H H 18 8.949 8.949 8.573 0.376 17893 4454 1 15 . 1 1 19 19 GLU N N 19 124.147 124.147 122.424 1.723 17893 4455 1 15 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.097 0.010 17893 4456 1 15 . 1 1 19 19 GLU CA C 19 58.613 58.613 59.467 -0.854 17893 4457 1 15 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.201 0.338 17893 4458 1 15 . 1 1 19 19 GLU H H 19 8.331 8.331 8.039 0.292 17893 4459 1 15 . 1 1 20 20 LEU N N 20 119.943 119.943 120.705 -0.762 17893 4460 1 15 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.924 0.230 17893 4461 1 15 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.932 -0.358 17893 4462 1 15 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.458 -0.453 17893 4463 1 15 . 1 1 20 20 LEU H H 20 8.314 8.314 8.317 -0.003 17893 4464 1 15 . 1 1 21 21 ALA N N 21 119.877 119.877 122.060 -2.183 17893 4465 1 15 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.900 -0.176 17893 4466 1 15 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.249 0.205 17893 4467 1 15 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.022 -1.161 17893 4468 1 15 . 1 1 21 21 ALA H H 21 8.588 8.588 8.663 -0.075 17893 4469 1 15 . 1 1 22 22 ALA N N 22 117.330 117.330 121.806 -4.476 17893 4470 1 15 . 1 1 22 22 ALA HA H 22 4.264 4.264 4.073 0.191 17893 4471 1 15 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.548 0.061 17893 4472 1 15 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.515 -0.859 17893 4473 1 15 . 1 1 22 22 ALA H H 22 7.813 7.813 8.258 -0.445 17893 4474 1 15 . 1 1 23 23 LEU N N 23 118.586 118.586 118.509 0.077 17893 4475 1 15 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.657 0.304 17893 4476 1 15 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.120 -0.020 17893 4477 1 15 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.370 0.054 17893 4478 1 15 . 1 1 23 23 LEU H H 23 7.538 7.538 8.227 -0.689 17893 4479 1 15 . 1 1 24 24 LEU N N 24 114.488 114.488 115.734 -1.246 17893 4480 1 15 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.279 -0.015 17893 4481 1 15 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.871 -1.077 17893 4482 1 15 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.895 1.538 17893 4483 1 15 . 1 1 24 24 LEU H H 24 7.449 7.449 8.235 -0.786 17893 4484 1 15 . 1 1 25 25 GLU N N 25 114.895 114.895 115.780 -0.885 17893 4485 1 15 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.029 -0.063 17893 4486 1 15 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.635 -0.486 17893 4487 1 15 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.402 -0.409 17893 4488 1 15 . 1 1 25 25 GLU H H 25 8.029 8.029 7.669 0.360 17893 4489 1 15 . 1 1 26 26 VAL N N 26 109.738 109.738 113.734 -3.996 17893 4490 1 15 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.708 0.182 17893 4491 1 15 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.314 -1.033 17893 4492 1 15 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.768 0.527 17893 4493 1 15 . 1 1 26 26 VAL H H 26 7.989 7.989 8.153 -0.164 17893 4494 1 15 . 1 1 27 27 SER N N 27 114.381 114.381 116.493 -2.112 17893 4495 1 15 . 1 1 27 27 SER HA H 27 4.644 4.644 4.481 0.163 17893 4496 1 15 . 1 1 27 27 SER CA C 27 56.445 56.445 58.662 -2.217 17893 4497 1 15 . 1 1 27 27 SER CB C 27 62.251 62.251 63.975 -1.724 17893 4498 1 15 . 1 1 27 27 SER H H 27 8.618 8.618 8.480 0.138 17893 4499 1 15 . 1 1 28 28 ARG N N 28 115.323 115.323 125.191 -9.868 17893 4500 1 15 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.940 -0.192 17893 4501 1 15 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.298 -0.379 17893 4502 1 15 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.913 -0.863 17893 4503 1 15 . 1 1 28 28 ARG H H 28 8.242 8.242 8.933 -0.691 17893 4504 1 15 . 1 1 29 29 GLN N N 29 117.343 117.343 115.877 1.466 17893 4505 1 15 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.044 0.130 17893 4506 1 15 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.947 0.138 17893 4507 1 15 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.808 -0.239 17893 4508 1 15 . 1 1 29 29 GLN H H 29 8.827 8.827 8.925 -0.098 17893 4509 1 15 . 1 1 30 30 THR N N 30 119.996 119.996 117.185 2.811 17893 4510 1 15 . 1 1 30 30 THR HA H 30 4.434 4.434 4.276 0.158 17893 4511 1 15 . 1 1 30 30 THR CA C 30 67.621 67.621 65.752 1.869 17893 4512 1 15 . 1 1 30 30 THR CB C 30 66.513 66.513 68.670 -2.157 17893 4513 1 15 . 1 1 30 30 THR H H 30 8.132 8.132 7.874 0.258 17893 4514 1 15 . 1 1 31 31 ILE N N 31 118.828 118.828 122.765 -3.937 17893 4515 1 15 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.808 -0.022 17893 4516 1 15 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.069 -2.040 17893 4517 1 15 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.663 -1.586 17893 4518 1 15 . 1 1 31 31 ILE H H 31 7.163 7.163 7.672 -0.509 17893 4519 1 15 . 1 1 32 32 ASN N N 32 118.098 118.098 119.033 -0.935 17893 4520 1 15 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.356 -0.001 17893 4521 1 15 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.302 0.952 17893 4522 1 15 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.263 0.985 17893 4523 1 15 . 1 1 32 32 ASN H H 32 8.656 8.656 9.021 -0.365 17893 4524 1 15 . 1 1 33 33 GLY N N 33 124.952 124.952 108.793 16.159 17893 4525 1 15 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.569 0.570 17893 4526 1 15 . 1 1 33 33 GLY H H 33 8.643 8.643 8.539 0.104 17893 4527 1 15 . 1 1 34 34 ILE N N 34 122.233 122.233 123.340 -1.107 17893 4528 1 15 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.292 0.012 17893 4529 1 15 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.858 -0.054 17893 4530 1 15 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.314 -0.028 17893 4531 1 15 . 1 1 34 34 ILE H H 34 8.203 8.203 8.142 0.061 17893 4532 1 15 . 1 1 35 35 GLU N N 35 120.686 120.686 117.509 3.177 17893 4533 1 15 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.109 0.105 17893 4534 1 15 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.908 0.784 17893 4535 1 15 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.888 -1.036 17893 4536 1 15 . 1 1 35 35 GLU H H 35 8.575 8.575 8.476 0.099 17893 4537 1 15 . 1 1 36 36 LYS N N 36 116.029 116.029 117.369 -1.340 17893 4538 1 15 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.393 0.128 17893 4539 1 15 . 1 1 36 36 LYS CA C 36 55.507 55.507 55.048 0.459 17893 4540 1 15 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.471 -1.532 17893 4541 1 15 . 1 1 36 36 LYS H H 36 8.107 8.107 7.512 0.595 17893 4542 1 15 . 1 1 37 37 ASN N N 37 114.692 114.692 116.254 -1.562 17893 4543 1 15 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.582 0.167 17893 4544 1 15 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.637 1.151 17893 4545 1 15 . 1 1 37 37 ASN CB C 37 36.949 36.949 37.925 -0.976 17893 4546 1 15 . 1 1 37 37 ASN H H 37 8.240 8.240 8.658 -0.418 17893 4547 1 15 . 1 1 38 38 LYS N N 38 115.098 115.098 120.772 -5.674 17893 4548 1 15 . 1 1 38 38 LYS HA H 38 4.436 4.436 3.963 0.473 17893 4549 1 15 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.467 -2.289 17893 4550 1 15 . 1 1 38 38 LYS CB C 38 33.236 33.236 32.777 0.459 17893 4551 1 15 . 1 1 38 38 LYS H H 38 8.727 8.727 7.723 1.004 17893 4552 1 15 . 1 1 39 39 TYR N N 39 117.011 117.011 111.817 5.194 17893 4553 1 15 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.745 -0.116 17893 4554 1 15 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.129 0.430 17893 4555 1 15 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.525 1.379 17893 4556 1 15 . 1 1 39 39 TYR H H 39 7.087 7.087 7.368 -0.281 17893 4557 1 15 . 1 1 40 40 ASN N N 40 123.595 123.595 120.704 2.891 17893 4558 1 15 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.955 0.298 17893 4559 1 15 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.040 -1.268 17893 4560 1 15 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.185 -0.709 17893 4561 1 15 . 1 1 40 40 ASN H H 40 8.842 8.842 8.467 0.375 17893 4562 1 15 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.488 -0.679 17893 4563 1 15 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.426 0.103 17893 4564 1 15 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.328 -0.767 17893 4565 1 15 . 1 1 42 42 SER N N 42 125.580 125.580 115.388 10.192 17893 4566 1 15 . 1 1 42 42 SER HA H 42 4.581 4.581 4.283 0.298 17893 4567 1 15 . 1 1 42 42 SER CA C 42 57.380 57.380 57.866 -0.486 17893 4568 1 15 . 1 1 42 42 SER CB C 42 64.562 64.562 64.215 0.347 17893 4569 1 15 . 1 1 42 42 SER H H 42 8.033 8.033 8.097 -0.064 17893 4570 1 15 . 1 1 43 43 LEU N N 43 120.759 120.759 123.985 -3.226 17893 4571 1 15 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.018 -0.104 17893 4572 1 15 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.379 -0.034 17893 4573 1 15 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.437 -0.581 17893 4574 1 15 . 1 1 43 43 LEU H H 43 9.289 9.289 8.728 0.561 17893 4575 1 15 . 1 1 44 44 GLN N N 44 115.948 115.948 117.393 -1.445 17893 4576 1 15 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.056 -0.329 17893 4577 1 15 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.375 0.761 17893 4578 1 15 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.177 0.073 17893 4579 1 15 . 1 1 44 44 GLN H H 44 8.906 8.906 8.763 0.143 17893 4580 1 15 . 1 1 45 45 LEU N N 45 119.419 119.419 120.237 -0.818 17893 4581 1 15 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.996 -0.071 17893 4582 1 15 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.429 -2.825 17893 4583 1 15 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.619 -0.992 17893 4584 1 15 . 1 1 45 45 LEU H H 45 8.078 8.078 7.460 0.618 17893 4585 1 15 . 1 1 46 46 ALA N N 46 120.544 120.544 122.349 -1.805 17893 4586 1 15 . 1 1 46 46 ALA HA H 46 4.048 4.048 4.025 0.023 17893 4587 1 15 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.306 0.438 17893 4588 1 15 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.010 1.723 17893 4589 1 15 . 1 1 46 46 ALA H H 46 8.518 8.518 8.701 -0.183 17893 4590 1 15 . 1 1 47 47 LEU N N 47 116.461 116.461 118.921 -2.460 17893 4591 1 15 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.888 0.327 17893 4592 1 15 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.098 -0.597 17893 4593 1 15 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.665 -0.579 17893 4594 1 15 . 1 1 47 47 LEU H H 47 8.676 8.676 8.482 0.194 17893 4595 1 15 . 1 1 48 48 LYS N N 48 120.958 120.958 120.016 0.942 17893 4596 1 15 . 1 1 48 48 LYS HA H 48 3.600 3.600 4.029 -0.429 17893 4597 1 15 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.937 -0.008 17893 4598 1 15 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.416 -0.148 17893 4599 1 15 . 1 1 48 48 LYS H H 48 8.036 8.036 8.302 -0.266 17893 4600 1 15 . 1 1 49 49 ILE N N 49 120.407 120.407 120.258 0.149 17893 4601 1 15 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.868 -0.269 17893 4602 1 15 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.707 1.495 17893 4603 1 15 . 1 1 49 49 ILE CB C 49 37.653 37.653 38.002 -0.349 17893 4604 1 15 . 1 1 49 49 ILE H H 49 8.779 8.779 8.524 0.255 17893 4605 1 15 . 1 1 50 50 ALA N N 50 120.480 120.480 123.082 -2.602 17893 4606 1 15 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.072 0.007 17893 4607 1 15 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.273 0.350 17893 4608 1 15 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.144 -0.139 17893 4609 1 15 . 1 1 50 50 ALA H H 50 8.173 8.173 8.377 -0.204 17893 4610 1 15 . 1 1 51 51 TYR N N 51 117.118 117.118 120.305 -3.187 17893 4611 1 15 . 1 1 51 51 TYR HA H 51 4.365 4.365 4.003 0.362 17893 4612 1 15 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.294 -0.861 17893 4613 1 15 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.441 -0.218 17893 4614 1 15 . 1 1 51 51 TYR H H 51 8.169 8.169 8.276 -0.107 17893 4615 1 15 . 1 1 52 52 TYR N N 52 118.548 118.548 117.023 1.525 17893 4616 1 15 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.144 0.177 17893 4617 1 15 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.723 1.246 17893 4618 1 15 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.594 -1.116 17893 4619 1 15 . 1 1 52 52 TYR H H 52 9.062 9.062 7.977 1.085 17893 4620 1 15 . 1 1 53 53 LEU N N 53 115.380 115.380 117.529 -2.149 17893 4621 1 15 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.049 0.488 17893 4622 1 15 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.724 -2.580 17893 4623 1 15 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.029 -1.933 17893 4624 1 15 . 1 1 53 53 LEU H H 53 8.394 8.394 8.621 -0.227 17893 4625 1 15 . 1 1 54 54 ASN N N 54 122.105 122.105 113.287 8.818 17893 4626 1 15 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.327 0.129 17893 4627 1 15 . 1 1 54 54 ASN CA C 54 53.791 53.791 53.612 0.179 17893 4628 1 15 . 1 1 54 54 ASN CB C 54 37.758 37.758 36.613 1.145 17893 4629 1 15 . 1 1 54 54 ASN H H 54 8.091 8.091 8.293 -0.202 17893 4630 1 15 . 1 1 55 55 THR N N 55 114.964 114.964 114.707 0.257 17893 4631 1 15 . 1 1 55 55 THR HA H 55 4.947 4.947 4.706 0.241 17893 4632 1 15 . 1 1 55 55 THR CA C 55 60.062 60.062 59.460 0.602 17893 4633 1 15 . 1 1 55 55 THR CB C 55 74.945 74.945 70.906 4.039 17893 4634 1 15 . 1 1 55 55 THR H H 55 8.248 8.248 7.964 0.284 17893 4635 1 15 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.472 0.138 17893 4636 1 15 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.452 0.390 17893 4637 1 15 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.403 -0.457 17893 4638 1 15 . 1 1 57 57 LEU N N 57 127.597 127.597 125.750 1.847 17893 4639 1 15 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.125 -0.054 17893 4640 1 15 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.744 0.978 17893 4641 1 15 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.201 -0.708 17893 4642 1 15 . 1 1 57 57 LEU H H 57 9.958 9.958 8.590 1.368 17893 4643 1 15 . 1 1 58 58 GLU N N 58 123.260 123.260 118.745 4.515 17893 4644 1 15 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.303 0.583 17893 4645 1 15 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.158 -0.641 17893 4646 1 15 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.071 -0.013 17893 4647 1 15 . 1 1 58 58 GLU H H 58 9.353 9.353 8.588 0.765 17893 4648 1 15 . 1 1 59 59 ASP N N 59 117.681 117.681 117.129 0.552 17893 4649 1 15 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.425 0.229 17893 4650 1 15 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.636 -1.012 17893 4651 1 15 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.811 -0.820 17893 4652 1 15 . 1 1 59 59 ASP H H 59 8.012 8.012 7.685 0.327 17893 4653 1 15 . 1 1 60 60 ILE N N 60 119.519 119.519 116.272 3.247 17893 4654 1 15 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.734 -0.191 17893 4655 1 15 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.420 0.486 17893 4656 1 15 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.917 0.499 17893 4657 1 15 . 1 1 60 60 ILE H H 60 8.210 8.210 7.146 1.064 17893 4658 1 15 . 1 1 61 61 PHE N N 61 116.030 116.030 118.164 -2.134 17893 4659 1 15 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.651 -0.205 17893 4660 1 15 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.782 0.039 17893 4661 1 15 . 1 1 61 61 PHE CB C 61 41.965 41.965 40.874 1.091 17893 4662 1 15 . 1 1 61 61 PHE H H 61 8.530 8.530 8.746 -0.216 17893 4663 1 15 . 1 1 62 62 GLN N N 62 116.829 116.829 120.733 -3.904 17893 4664 1 15 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.907 0.150 17893 4665 1 15 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.773 0.216 17893 4666 1 15 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.507 0.321 17893 4667 1 15 . 1 1 62 62 GLN H H 62 8.737 8.737 9.186 -0.449 17893 4668 1 15 . 1 1 63 63 TRP N N 63 125.623 125.623 126.679 -1.056 17893 4669 1 15 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.183 0.024 17893 4670 1 15 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.914 -0.384 17893 4671 1 15 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.961 -0.257 17893 4672 1 15 . 1 1 63 63 TRP H H 63 9.464 9.464 8.844 0.620 17893 4673 1 15 . 1 1 64 64 GLN N N 64 127.029 127.029 123.801 3.228 17893 4674 1 15 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.063 0.135 17893 4675 1 15 . 1 1 64 64 GLN CA C 64 51.502 51.502 51.832 -0.330 17893 4676 1 15 . 1 1 64 64 GLN CB C 64 30.673 30.673 30.164 0.509 17893 4677 1 15 . 1 1 64 64 GLN H H 64 7.977 7.977 8.331 -0.354 17893 4678 1 15 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.469 0.211 17893 4679 1 15 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.091 -1.436 17893 4680 1 15 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.275 -0.775 17893 4681 1 16 . 1 1 2 2 ILE N N 2 123.389 123.389 122.071 1.318 17893 4682 1 16 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.476 0.645 17893 4683 1 16 . 1 1 2 2 ILE CA C 2 60.173 60.173 60.545 -0.372 17893 4684 1 16 . 1 1 2 2 ILE CB C 2 39.132 39.132 37.979 1.153 17893 4685 1 16 . 1 1 2 2 ILE H H 2 9.112 9.112 8.068 1.044 17893 4686 1 16 . 1 1 3 3 ILE N N 3 108.863 108.863 128.864 -20.001 17893 4687 1 16 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.064 0.369 17893 4688 1 16 . 1 1 3 3 ILE CA C 3 60.154 60.154 61.130 -0.976 17893 4689 1 16 . 1 1 3 3 ILE CB C 3 38.655 38.655 38.614 0.041 17893 4690 1 16 . 1 1 3 3 ILE H H 3 9.418 9.418 8.890 0.528 17893 4691 1 16 . 1 1 4 4 ASN N N 4 123.919 123.919 126.391 -2.472 17893 4692 1 16 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.915 0.717 17893 4693 1 16 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.179 -0.801 17893 4694 1 16 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.141 1.897 17893 4695 1 16 . 1 1 4 4 ASN H H 4 9.056 9.056 8.859 0.197 17893 4696 1 16 . 1 1 5 5 ASN N N 5 120.944 120.944 123.678 -2.734 17893 4697 1 16 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.803 0.640 17893 4698 1 16 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.921 -1.506 17893 4699 1 16 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.796 1.017 17893 4700 1 16 . 1 1 5 5 ASN H H 5 9.383 9.383 9.069 0.314 17893 4701 1 16 . 1 1 6 6 LEU N N 6 120.594 120.594 123.285 -2.691 17893 4702 1 16 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.859 -0.092 17893 4703 1 16 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.088 0.611 17893 4704 1 16 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.579 -0.774 17893 4705 1 16 . 1 1 6 6 LEU H H 6 8.531 8.531 9.321 -0.790 17893 4706 1 16 . 1 1 7 7 LYS N N 7 118.212 118.212 118.182 0.030 17893 4707 1 16 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.930 0.003 17893 4708 1 16 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.485 0.778 17893 4709 1 16 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.425 0.878 17893 4710 1 16 . 1 1 7 7 LYS H H 7 8.933 8.933 7.910 1.023 17893 4711 1 16 . 1 1 8 8 LEU N N 8 116.414 116.414 120.633 -4.219 17893 4712 1 16 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.027 0.146 17893 4713 1 16 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.284 0.106 17893 4714 1 16 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.859 0.169 17893 4715 1 16 . 1 1 8 8 LEU H H 8 7.667 7.667 7.557 0.110 17893 4716 1 16 . 1 1 9 9 ILE N N 9 119.134 119.134 119.452 -0.318 17893 4717 1 16 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.525 0.289 17893 4718 1 16 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.433 -2.577 17893 4719 1 16 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.497 -1.035 17893 4720 1 16 . 1 1 9 9 ILE H H 9 8.226 8.226 8.763 -0.537 17893 4721 1 16 . 1 1 10 10 ARG N N 10 120.162 120.162 119.356 0.806 17893 4722 1 16 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.878 0.023 17893 4723 1 16 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.209 0.519 17893 4724 1 16 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.015 -1.516 17893 4725 1 16 . 1 1 10 10 ARG H H 10 9.260 9.260 8.757 0.503 17893 4726 1 16 . 1 1 11 11 GLU N N 11 115.948 115.948 119.243 -3.295 17893 4727 1 16 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.161 0.012 17893 4728 1 16 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.593 0.793 17893 4729 1 16 . 1 1 11 11 GLU CB C 11 28.914 28.914 28.992 -0.078 17893 4730 1 16 . 1 1 11 11 GLU H H 11 8.701 8.701 7.834 0.867 17893 4731 1 16 . 1 1 12 12 LYS N N 12 122.900 122.900 119.016 3.884 17893 4732 1 16 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.091 0.131 17893 4733 1 16 . 1 1 12 12 LYS CA C 12 59.416 59.416 58.674 0.742 17893 4734 1 16 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.905 -0.907 17893 4735 1 16 . 1 1 12 12 LYS H H 12 8.254 8.254 7.986 0.268 17893 4736 1 16 . 1 1 13 13 LYS N N 13 116.385 116.385 114.598 1.787 17893 4737 1 16 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.416 -0.119 17893 4738 1 16 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.700 -0.669 17893 4739 1 16 . 1 1 13 13 LYS CB C 13 31.549 31.549 33.375 -1.826 17893 4740 1 16 . 1 1 13 13 LYS H H 13 7.809 7.809 7.548 0.261 17893 4741 1 16 . 1 1 14 14 LYS N N 14 115.317 115.317 117.223 -1.906 17893 4742 1 16 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.929 0.053 17893 4743 1 16 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.705 0.183 17893 4744 1 16 . 1 1 14 14 LYS CB C 14 28.286 28.286 30.018 -1.732 17893 4745 1 16 . 1 1 14 14 LYS H H 14 8.069 8.069 8.113 -0.044 17893 4746 1 16 . 1 1 15 15 ILE N N 15 118.431 118.431 121.839 -3.408 17893 4747 1 16 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.195 0.428 17893 4748 1 16 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.365 -0.166 17893 4749 1 16 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.693 2.203 17893 4750 1 16 . 1 1 15 15 ILE H H 15 7.569 7.569 8.632 -1.063 17893 4751 1 16 . 1 1 16 16 SER N N 16 125.034 125.034 123.310 1.724 17893 4752 1 16 . 1 1 16 16 SER HA H 16 4.585 4.585 4.642 -0.057 17893 4753 1 16 . 1 1 16 16 SER CA C 16 57.004 57.004 58.338 -1.334 17893 4754 1 16 . 1 1 16 16 SER CB C 16 64.914 64.914 64.197 0.717 17893 4755 1 16 . 1 1 16 16 SER H H 16 9.440 9.440 9.140 0.300 17893 4756 1 16 . 1 1 17 17 GLN N N 17 120.228 120.228 121.830 -1.602 17893 4757 1 16 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.992 -0.205 17893 4758 1 16 . 1 1 17 17 GLN CA C 17 61.516 61.516 60.191 1.325 17893 4759 1 16 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.462 0.589 17893 4760 1 16 . 1 1 17 17 GLN H H 17 9.527 9.527 8.880 0.647 17893 4761 1 16 . 1 1 18 18 SER N N 18 112.979 112.979 115.085 -2.106 17893 4762 1 16 . 1 1 18 18 SER HA H 18 4.531 4.531 4.030 0.501 17893 4763 1 16 . 1 1 18 18 SER CA C 18 62.872 62.872 61.891 0.981 17893 4764 1 16 . 1 1 18 18 SER CB C 18 65.338 65.338 62.500 2.838 17893 4765 1 16 . 1 1 18 18 SER H H 18 8.949 8.949 8.710 0.239 17893 4766 1 16 . 1 1 19 19 GLU N N 19 124.147 124.147 121.500 2.647 17893 4767 1 16 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.139 -0.032 17893 4768 1 16 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.735 -0.122 17893 4769 1 16 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.924 0.615 17893 4770 1 16 . 1 1 19 19 GLU H H 19 8.331 8.331 8.459 -0.128 17893 4771 1 16 . 1 1 20 20 LEU N N 20 119.943 119.943 122.567 -2.624 17893 4772 1 16 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.916 0.238 17893 4773 1 16 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.734 -0.160 17893 4774 1 16 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.337 -0.331 17893 4775 1 16 . 1 1 20 20 LEU H H 20 8.314 8.314 7.860 0.454 17893 4776 1 16 . 1 1 21 21 ALA N N 21 119.877 119.877 121.439 -1.562 17893 4777 1 16 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.935 -0.211 17893 4778 1 16 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.224 0.230 17893 4779 1 16 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.050 -1.189 17893 4780 1 16 . 1 1 21 21 ALA H H 21 8.588 8.588 8.993 -0.405 17893 4781 1 16 . 1 1 22 22 ALA N N 22 117.330 117.330 121.778 -4.448 17893 4782 1 16 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.966 0.298 17893 4783 1 16 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.815 -0.206 17893 4784 1 16 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.514 -0.858 17893 4785 1 16 . 1 1 22 22 ALA H H 22 7.813 7.813 7.803 0.010 17893 4786 1 16 . 1 1 23 23 LEU N N 23 118.586 118.586 118.634 -0.048 17893 4787 1 16 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.675 0.286 17893 4788 1 16 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.411 -0.311 17893 4789 1 16 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.218 0.206 17893 4790 1 16 . 1 1 23 23 LEU H H 23 7.538 7.538 8.539 -1.001 17893 4791 1 16 . 1 1 24 24 LEU N N 24 114.488 114.488 114.432 0.056 17893 4792 1 16 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.441 -0.177 17893 4793 1 16 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.093 -0.299 17893 4794 1 16 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.917 1.516 17893 4795 1 16 . 1 1 24 24 LEU H H 24 7.449 7.449 8.008 -0.559 17893 4796 1 16 . 1 1 25 25 GLU N N 25 114.895 114.895 115.598 -0.703 17893 4797 1 16 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.063 -0.097 17893 4798 1 16 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.300 -0.152 17893 4799 1 16 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.612 -0.619 17893 4800 1 16 . 1 1 25 25 GLU H H 25 8.029 8.029 7.717 0.312 17893 4801 1 16 . 1 1 26 26 VAL N N 26 109.738 109.738 112.529 -2.791 17893 4802 1 16 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.646 0.244 17893 4803 1 16 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.099 -0.818 17893 4804 1 16 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.969 0.326 17893 4805 1 16 . 1 1 26 26 VAL H H 26 7.989 7.989 7.937 0.052 17893 4806 1 16 . 1 1 27 27 SER N N 27 114.381 114.381 116.322 -1.941 17893 4807 1 16 . 1 1 27 27 SER HA H 27 4.644 4.644 4.473 0.171 17893 4808 1 16 . 1 1 27 27 SER CA C 27 56.445 56.445 58.447 -2.002 17893 4809 1 16 . 1 1 27 27 SER CB C 27 62.251 62.251 63.952 -1.701 17893 4810 1 16 . 1 1 27 27 SER H H 27 8.618 8.618 8.484 0.134 17893 4811 1 16 . 1 1 28 28 ARG N N 28 115.323 115.323 124.744 -9.421 17893 4812 1 16 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.952 -0.204 17893 4813 1 16 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.376 -0.457 17893 4814 1 16 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.980 -0.930 17893 4815 1 16 . 1 1 28 28 ARG H H 28 8.242 8.242 8.916 -0.674 17893 4816 1 16 . 1 1 29 29 GLN N N 29 117.343 117.343 116.297 1.046 17893 4817 1 16 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.072 0.102 17893 4818 1 16 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.007 0.078 17893 4819 1 16 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.735 -0.167 17893 4820 1 16 . 1 1 29 29 GLN H H 29 8.827 8.827 8.887 -0.060 17893 4821 1 16 . 1 1 30 30 THR N N 30 119.996 119.996 116.910 3.086 17893 4822 1 16 . 1 1 30 30 THR HA H 30 4.434 4.434 4.146 0.288 17893 4823 1 16 . 1 1 30 30 THR CA C 30 67.621 67.621 65.546 2.075 17893 4824 1 16 . 1 1 30 30 THR CB C 30 66.513 66.513 68.289 -1.776 17893 4825 1 16 . 1 1 30 30 THR H H 30 8.132 8.132 7.763 0.369 17893 4826 1 16 . 1 1 31 31 ILE N N 31 118.828 118.828 122.838 -4.010 17893 4827 1 16 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.819 -0.033 17893 4828 1 16 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.694 -2.665 17893 4829 1 16 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.771 -1.694 17893 4830 1 16 . 1 1 31 31 ILE H H 31 7.163 7.163 7.297 -0.134 17893 4831 1 16 . 1 1 32 32 ASN N N 32 118.098 118.098 119.184 -1.086 17893 4832 1 16 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.412 -0.057 17893 4833 1 16 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.102 0.152 17893 4834 1 16 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.473 0.775 17893 4835 1 16 . 1 1 32 32 ASN H H 32 8.656 8.656 8.801 -0.145 17893 4836 1 16 . 1 1 33 33 GLY N N 33 124.952 124.952 109.373 15.579 17893 4837 1 16 . 1 1 33 33 GLY CA C 33 47.140 47.140 47.061 0.079 17893 4838 1 16 . 1 1 33 33 GLY H H 33 8.643 8.643 8.653 -0.010 17893 4839 1 16 . 1 1 34 34 ILE N N 34 122.233 122.233 122.589 -0.356 17893 4840 1 16 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.900 0.404 17893 4841 1 16 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.673 0.131 17893 4842 1 16 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.159 0.127 17893 4843 1 16 . 1 1 34 34 ILE H H 34 8.203 8.203 8.015 0.188 17893 4844 1 16 . 1 1 35 35 GLU N N 35 120.686 120.686 118.623 2.063 17893 4845 1 16 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.078 0.136 17893 4846 1 16 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.203 0.489 17893 4847 1 16 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.907 -1.055 17893 4848 1 16 . 1 1 35 35 GLU H H 35 8.575 8.575 8.439 0.136 17893 4849 1 16 . 1 1 36 36 LYS N N 36 116.029 116.029 115.541 0.488 17893 4850 1 16 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.129 0.392 17893 4851 1 16 . 1 1 36 36 LYS CA C 36 55.507 55.507 57.971 -2.464 17893 4852 1 16 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.098 -1.159 17893 4853 1 16 . 1 1 36 36 LYS H H 36 8.107 8.107 8.657 -0.550 17893 4854 1 16 . 1 1 37 37 ASN N N 37 114.692 114.692 112.988 1.704 17893 4855 1 16 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.577 0.172 17893 4856 1 16 . 1 1 37 37 ASN CA C 37 54.788 54.788 54.010 0.778 17893 4857 1 16 . 1 1 37 37 ASN CB C 37 36.949 36.949 37.834 -0.885 17893 4858 1 16 . 1 1 37 37 ASN H H 37 8.240 8.240 8.206 0.034 17893 4859 1 16 . 1 1 38 38 LYS N N 38 115.098 115.098 121.092 -5.994 17893 4860 1 16 . 1 1 38 38 LYS HA H 38 4.436 4.436 3.848 0.588 17893 4861 1 16 . 1 1 38 38 LYS CA C 38 56.178 56.178 59.198 -3.020 17893 4862 1 16 . 1 1 38 38 LYS CB C 38 33.236 33.236 32.219 1.017 17893 4863 1 16 . 1 1 38 38 LYS H H 38 8.727 8.727 8.364 0.363 17893 4864 1 16 . 1 1 39 39 TYR N N 39 117.011 117.011 111.640 5.371 17893 4865 1 16 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.830 -0.201 17893 4866 1 16 . 1 1 39 39 TYR CA C 39 55.559 55.559 54.838 0.721 17893 4867 1 16 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.931 -0.028 17893 4868 1 16 . 1 1 39 39 TYR H H 39 7.087 7.087 7.224 -0.137 17893 4869 1 16 . 1 1 40 40 ASN N N 40 123.595 123.595 121.191 2.404 17893 4870 1 16 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.686 0.567 17893 4871 1 16 . 1 1 40 40 ASN CA C 40 49.772 49.772 52.138 -2.366 17893 4872 1 16 . 1 1 40 40 ASN CB C 40 38.476 38.476 38.841 -0.365 17893 4873 1 16 . 1 1 40 40 ASN H H 40 8.842 8.842 8.512 0.330 17893 4874 1 16 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.502 -0.693 17893 4875 1 16 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.727 -0.198 17893 4876 1 16 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.082 -0.521 17893 4877 1 16 . 1 1 42 42 SER N N 42 125.580 125.580 115.687 9.893 17893 4878 1 16 . 1 1 42 42 SER HA H 42 4.581 4.581 4.239 0.342 17893 4879 1 16 . 1 1 42 42 SER CA C 42 57.380 57.380 58.096 -0.716 17893 4880 1 16 . 1 1 42 42 SER CB C 42 64.562 64.562 63.907 0.655 17893 4881 1 16 . 1 1 42 42 SER H H 42 8.033 8.033 8.207 -0.174 17893 4882 1 16 . 1 1 43 43 LEU N N 43 120.759 120.759 125.294 -4.535 17893 4883 1 16 . 1 1 43 43 LEU HA H 43 3.914 3.914 3.994 -0.080 17893 4884 1 16 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.427 -0.082 17893 4885 1 16 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.542 -0.686 17893 4886 1 16 . 1 1 43 43 LEU H H 43 9.289 9.289 8.755 0.534 17893 4887 1 16 . 1 1 44 44 GLN N N 44 115.948 115.948 118.880 -2.932 17893 4888 1 16 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.077 -0.350 17893 4889 1 16 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.409 0.727 17893 4890 1 16 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.130 0.120 17893 4891 1 16 . 1 1 44 44 GLN H H 44 8.906 8.906 8.650 0.256 17893 4892 1 16 . 1 1 45 45 LEU N N 45 119.419 119.419 119.118 0.301 17893 4893 1 16 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.015 -0.090 17893 4894 1 16 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.499 -2.895 17893 4895 1 16 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.447 -0.820 17893 4896 1 16 . 1 1 45 45 LEU H H 45 8.078 8.078 8.002 0.076 17893 4897 1 16 . 1 1 46 46 ALA N N 46 120.544 120.544 122.218 -1.674 17893 4898 1 16 . 1 1 46 46 ALA HA H 46 4.048 4.048 4.045 0.003 17893 4899 1 16 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.251 0.493 17893 4900 1 16 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.223 1.510 17893 4901 1 16 . 1 1 46 46 ALA H H 46 8.518 8.518 8.690 -0.172 17893 4902 1 16 . 1 1 47 47 LEU N N 47 116.461 116.461 118.805 -2.344 17893 4903 1 16 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.876 0.339 17893 4904 1 16 . 1 1 47 47 LEU CA C 47 57.501 57.501 57.991 -0.490 17893 4905 1 16 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.662 -0.576 17893 4906 1 16 . 1 1 47 47 LEU H H 47 8.676 8.676 8.413 0.263 17893 4907 1 16 . 1 1 48 48 LYS N N 48 120.958 120.958 119.633 1.325 17893 4908 1 16 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.791 -0.191 17893 4909 1 16 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.593 0.336 17893 4910 1 16 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.348 -0.080 17893 4911 1 16 . 1 1 48 48 LYS H H 48 8.036 8.036 7.868 0.168 17893 4912 1 16 . 1 1 49 49 ILE N N 49 120.407 120.407 120.322 0.085 17893 4913 1 16 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.936 -0.337 17893 4914 1 16 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.710 1.492 17893 4915 1 16 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.961 -0.308 17893 4916 1 16 . 1 1 49 49 ILE H H 49 8.779 8.779 8.551 0.228 17893 4917 1 16 . 1 1 50 50 ALA N N 50 120.480 120.480 123.811 -3.331 17893 4918 1 16 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.099 -0.020 17893 4919 1 16 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.197 0.427 17893 4920 1 16 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.236 -0.231 17893 4921 1 16 . 1 1 50 50 ALA H H 50 8.173 8.173 8.272 -0.099 17893 4922 1 16 . 1 1 51 51 TYR N N 51 117.118 117.118 119.834 -2.716 17893 4923 1 16 . 1 1 51 51 TYR HA H 51 4.365 4.365 4.005 0.360 17893 4924 1 16 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.087 -0.654 17893 4925 1 16 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.466 -0.243 17893 4926 1 16 . 1 1 51 51 TYR H H 51 8.169 8.169 7.664 0.505 17893 4927 1 16 . 1 1 52 52 TYR N N 52 118.548 118.548 116.620 1.928 17893 4928 1 16 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.203 0.118 17893 4929 1 16 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.033 1.936 17893 4930 1 16 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.362 -0.884 17893 4931 1 16 . 1 1 52 52 TYR H H 52 9.062 9.062 7.682 1.380 17893 4932 1 16 . 1 1 53 53 LEU N N 53 115.380 115.380 116.832 -1.452 17893 4933 1 16 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.019 0.518 17893 4934 1 16 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.485 -2.341 17893 4935 1 16 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.197 -2.101 17893 4936 1 16 . 1 1 53 53 LEU H H 53 8.394 8.394 8.868 -0.474 17893 4937 1 16 . 1 1 54 54 ASN N N 54 122.105 122.105 115.647 6.458 17893 4938 1 16 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.284 0.172 17893 4939 1 16 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.018 -0.227 17893 4940 1 16 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.481 0.277 17893 4941 1 16 . 1 1 54 54 ASN H H 54 8.091 8.091 8.008 0.083 17893 4942 1 16 . 1 1 55 55 THR N N 55 114.964 114.964 114.180 0.784 17893 4943 1 16 . 1 1 55 55 THR HA H 55 4.947 4.947 4.800 0.147 17893 4944 1 16 . 1 1 55 55 THR CA C 55 60.062 60.062 59.417 0.645 17893 4945 1 16 . 1 1 55 55 THR CB C 55 74.945 74.945 70.701 4.244 17893 4946 1 16 . 1 1 55 55 THR H H 55 8.248 8.248 8.287 -0.039 17893 4947 1 16 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.693 -0.083 17893 4948 1 16 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.842 -0.000 17893 4949 1 16 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.926 -0.980 17893 4950 1 16 . 1 1 57 57 LEU N N 57 127.597 127.597 124.618 2.979 17893 4951 1 16 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.088 -0.017 17893 4952 1 16 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.621 1.101 17893 4953 1 16 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.071 -0.578 17893 4954 1 16 . 1 1 57 57 LEU H H 57 9.958 9.958 8.611 1.347 17893 4955 1 16 . 1 1 58 58 GLU N N 58 123.260 123.260 117.709 5.551 17893 4956 1 16 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.332 0.554 17893 4957 1 16 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.054 -0.537 17893 4958 1 16 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.146 -0.088 17893 4959 1 16 . 1 1 58 58 GLU H H 58 9.353 9.353 8.688 0.665 17893 4960 1 16 . 1 1 59 59 ASP N N 59 117.681 117.681 117.660 0.021 17893 4961 1 16 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.453 0.201 17893 4962 1 16 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.582 -0.959 17893 4963 1 16 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.074 -1.083 17893 4964 1 16 . 1 1 59 59 ASP H H 59 8.012 8.012 7.979 0.033 17893 4965 1 16 . 1 1 60 60 ILE N N 60 119.519 119.519 117.251 2.268 17893 4966 1 16 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.720 -0.177 17893 4967 1 16 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.617 0.289 17893 4968 1 16 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.964 0.452 17893 4969 1 16 . 1 1 60 60 ILE H H 60 8.210 8.210 7.171 1.039 17893 4970 1 16 . 1 1 61 61 PHE N N 61 116.030 116.030 118.742 -2.712 17893 4971 1 16 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.599 -0.153 17893 4972 1 16 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.837 -0.017 17893 4973 1 16 . 1 1 61 61 PHE CB C 61 41.965 41.965 39.968 1.998 17893 4974 1 16 . 1 1 61 61 PHE H H 61 8.530 8.530 8.562 -0.032 17893 4975 1 16 . 1 1 62 62 GLN N N 62 116.829 116.829 121.412 -4.583 17893 4976 1 16 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.897 0.160 17893 4977 1 16 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.679 0.310 17893 4978 1 16 . 1 1 62 62 GLN CB C 62 31.828 31.828 30.931 0.897 17893 4979 1 16 . 1 1 62 62 GLN H H 62 8.737 8.737 8.974 -0.237 17893 4980 1 16 . 1 1 63 63 TRP N N 63 125.623 125.623 124.141 1.482 17893 4981 1 16 . 1 1 63 63 TRP HA H 63 5.207 5.207 4.775 0.432 17893 4982 1 16 . 1 1 63 63 TRP CA C 63 56.531 56.531 57.196 -0.665 17893 4983 1 16 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.452 0.252 17893 4984 1 16 . 1 1 63 63 TRP H H 63 9.464 9.464 8.641 0.823 17893 4985 1 16 . 1 1 64 64 GLN N N 64 127.029 127.029 123.100 3.929 17893 4986 1 16 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.351 -0.153 17893 4987 1 16 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.847 -1.345 17893 4988 1 16 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.507 1.166 17893 4989 1 16 . 1 1 64 64 GLN H H 64 7.977 7.977 8.150 -0.173 17893 4990 1 16 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.430 0.250 17893 4991 1 16 . 1 1 65 65 PRO CA C 65 61.655 61.655 64.306 -2.651 17893 4992 1 16 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.220 -0.720 17893 4993 1 17 . 1 1 2 2 ILE N N 2 123.389 123.389 120.824 2.565 17893 4994 1 17 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.072 0.049 17893 4995 1 17 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.099 1.074 17893 4996 1 17 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.543 -0.411 17893 4997 1 17 . 1 1 2 2 ILE H H 2 9.112 9.112 7.824 1.288 17893 4998 1 17 . 1 1 3 3 ILE N N 3 108.863 108.863 128.556 -19.693 17893 4999 1 17 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.220 0.213 17893 5000 1 17 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.215 -0.061 17893 5001 1 17 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.824 -1.169 17893 5002 1 17 . 1 1 3 3 ILE H H 3 9.418 9.418 9.203 0.215 17893 5003 1 17 . 1 1 4 4 ASN N N 4 123.919 123.919 125.981 -2.062 17893 5004 1 17 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.598 1.034 17893 5005 1 17 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.136 -0.758 17893 5006 1 17 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.917 2.120 17893 5007 1 17 . 1 1 4 4 ASN H H 4 9.056 9.056 8.878 0.178 17893 5008 1 17 . 1 1 5 5 ASN N N 5 120.944 120.944 123.660 -2.716 17893 5009 1 17 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.763 0.680 17893 5010 1 17 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.911 -1.496 17893 5011 1 17 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.744 1.069 17893 5012 1 17 . 1 1 5 5 ASN H H 5 9.383 9.383 9.018 0.365 17893 5013 1 17 . 1 1 6 6 LEU N N 6 120.594 120.594 122.920 -2.326 17893 5014 1 17 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.880 -0.113 17893 5015 1 17 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.104 0.595 17893 5016 1 17 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.600 -0.795 17893 5017 1 17 . 1 1 6 6 LEU H H 6 8.531 8.531 9.152 -0.621 17893 5018 1 17 . 1 1 7 7 LYS N N 7 118.212 118.212 117.779 0.433 17893 5019 1 17 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.026 -0.093 17893 5020 1 17 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.069 1.194 17893 5021 1 17 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.458 0.845 17893 5022 1 17 . 1 1 7 7 LYS H H 7 8.933 8.933 8.111 0.822 17893 5023 1 17 . 1 1 8 8 LEU N N 8 116.414 116.414 120.670 -4.256 17893 5024 1 17 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.011 0.162 17893 5025 1 17 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.422 -0.032 17893 5026 1 17 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.831 0.197 17893 5027 1 17 . 1 1 8 8 LEU H H 8 7.667 7.667 7.542 0.125 17893 5028 1 17 . 1 1 9 9 ILE N N 9 119.134 119.134 118.954 0.180 17893 5029 1 17 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.573 0.241 17893 5030 1 17 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.423 -2.567 17893 5031 1 17 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.564 -1.102 17893 5032 1 17 . 1 1 9 9 ILE H H 9 8.226 8.226 8.589 -0.363 17893 5033 1 17 . 1 1 10 10 ARG N N 10 120.162 120.162 120.163 -0.001 17893 5034 1 17 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.907 -0.006 17893 5035 1 17 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.033 0.694 17893 5036 1 17 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.084 -1.585 17893 5037 1 17 . 1 1 10 10 ARG H H 10 9.260 9.260 8.892 0.368 17893 5038 1 17 . 1 1 11 11 GLU N N 11 115.948 115.948 117.928 -1.980 17893 5039 1 17 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.139 0.034 17893 5040 1 17 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.852 0.534 17893 5041 1 17 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.128 -0.214 17893 5042 1 17 . 1 1 11 11 GLU H H 11 8.701 8.701 8.267 0.434 17893 5043 1 17 . 1 1 12 12 LYS N N 12 122.900 122.900 119.923 2.977 17893 5044 1 17 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.063 0.159 17893 5045 1 17 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.220 0.196 17893 5046 1 17 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.700 -0.702 17893 5047 1 17 . 1 1 12 12 LYS H H 12 8.254 8.254 7.991 0.263 17893 5048 1 17 . 1 1 13 13 LYS N N 13 116.385 116.385 114.548 1.837 17893 5049 1 17 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.360 -0.063 17893 5050 1 17 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.606 -0.575 17893 5051 1 17 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.607 -1.058 17893 5052 1 17 . 1 1 13 13 LYS H H 13 7.809 7.809 7.720 0.089 17893 5053 1 17 . 1 1 14 14 LYS N N 14 115.317 115.317 117.157 -1.840 17893 5054 1 17 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.899 0.083 17893 5055 1 17 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.846 0.042 17893 5056 1 17 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.811 -1.525 17893 5057 1 17 . 1 1 14 14 LYS H H 14 8.069 8.069 7.652 0.417 17893 5058 1 17 . 1 1 15 15 ILE N N 15 118.431 118.431 121.133 -2.702 17893 5059 1 17 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.155 0.468 17893 5060 1 17 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.637 -0.438 17893 5061 1 17 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.341 2.555 17893 5062 1 17 . 1 1 15 15 ILE H H 15 7.569 7.569 8.115 -0.546 17893 5063 1 17 . 1 1 16 16 SER N N 16 125.034 125.034 123.015 2.019 17893 5064 1 17 . 1 1 16 16 SER HA H 16 4.585 4.585 4.773 -0.188 17893 5065 1 17 . 1 1 16 16 SER CA C 16 57.004 57.004 57.613 -0.609 17893 5066 1 17 . 1 1 16 16 SER CB C 16 64.914 64.914 64.605 0.310 17893 5067 1 17 . 1 1 16 16 SER H H 16 9.440 9.440 9.318 0.122 17893 5068 1 17 . 1 1 17 17 GLN N N 17 120.228 120.228 122.354 -2.126 17893 5069 1 17 . 1 1 17 17 GLN HA H 17 3.787 3.787 3.935 -0.148 17893 5070 1 17 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.756 1.760 17893 5071 1 17 . 1 1 17 17 GLN CB C 17 29.051 29.051 27.730 1.321 17893 5072 1 17 . 1 1 17 17 GLN H H 17 9.527 9.527 9.063 0.464 17893 5073 1 17 . 1 1 18 18 SER N N 18 112.979 112.979 116.576 -3.597 17893 5074 1 17 . 1 1 18 18 SER HA H 18 4.531 4.531 4.042 0.489 17893 5075 1 17 . 1 1 18 18 SER CA C 18 62.872 62.872 61.680 1.192 17893 5076 1 17 . 1 1 18 18 SER CB C 18 65.338 65.338 62.402 2.936 17893 5077 1 17 . 1 1 18 18 SER H H 18 8.949 8.949 8.716 0.233 17893 5078 1 17 . 1 1 19 19 GLU N N 19 124.147 124.147 121.976 2.171 17893 5079 1 17 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.135 -0.028 17893 5080 1 17 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.734 -0.121 17893 5081 1 17 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.914 0.625 17893 5082 1 17 . 1 1 19 19 GLU H H 19 8.331 8.331 8.429 -0.098 17893 5083 1 17 . 1 1 20 20 LEU N N 20 119.943 119.943 122.415 -2.472 17893 5084 1 17 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.949 0.205 17893 5085 1 17 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.678 -0.104 17893 5086 1 17 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.334 -0.329 17893 5087 1 17 . 1 1 20 20 LEU H H 20 8.314 8.314 8.344 -0.030 17893 5088 1 17 . 1 1 21 21 ALA N N 21 119.877 119.877 121.674 -1.797 17893 5089 1 17 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.953 -0.229 17893 5090 1 17 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.242 0.212 17893 5091 1 17 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.068 -1.207 17893 5092 1 17 . 1 1 21 21 ALA H H 21 8.588 8.588 8.960 -0.371 17893 5093 1 17 . 1 1 22 22 ALA N N 22 117.330 117.330 121.785 -4.455 17893 5094 1 17 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.983 0.281 17893 5095 1 17 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.818 -0.209 17893 5096 1 17 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.496 -0.840 17893 5097 1 17 . 1 1 22 22 ALA H H 22 7.813 7.813 7.897 -0.084 17893 5098 1 17 . 1 1 23 23 LEU N N 23 118.586 118.586 118.448 0.138 17893 5099 1 17 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.658 0.303 17893 5100 1 17 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.186 -0.086 17893 5101 1 17 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.099 0.325 17893 5102 1 17 . 1 1 23 23 LEU H H 23 7.538 7.538 8.468 -0.930 17893 5103 1 17 . 1 1 24 24 LEU N N 24 114.488 114.488 115.444 -0.956 17893 5104 1 17 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.461 -0.197 17893 5105 1 17 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.613 -0.819 17893 5106 1 17 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.067 1.366 17893 5107 1 17 . 1 1 24 24 LEU H H 24 7.449 7.449 8.110 -0.661 17893 5108 1 17 . 1 1 25 25 GLU N N 25 114.895 114.895 114.685 0.210 17893 5109 1 17 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.084 -0.118 17893 5110 1 17 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.334 -0.186 17893 5111 1 17 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.258 -0.265 17893 5112 1 17 . 1 1 25 25 GLU H H 25 8.029 8.029 7.581 0.448 17893 5113 1 17 . 1 1 26 26 VAL N N 26 109.738 109.738 110.826 -1.088 17893 5114 1 17 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.685 0.205 17893 5115 1 17 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.479 -1.198 17893 5116 1 17 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.184 0.110 17893 5117 1 17 . 1 1 26 26 VAL H H 26 7.989 7.989 7.993 -0.004 17893 5118 1 17 . 1 1 27 27 SER N N 27 114.381 114.381 115.811 -1.430 17893 5119 1 17 . 1 1 27 27 SER HA H 27 4.644 4.644 4.527 0.117 17893 5120 1 17 . 1 1 27 27 SER CA C 27 56.445 56.445 58.401 -1.956 17893 5121 1 17 . 1 1 27 27 SER CB C 27 62.251 62.251 64.266 -2.015 17893 5122 1 17 . 1 1 27 27 SER H H 27 8.618 8.618 8.665 -0.047 17893 5123 1 17 . 1 1 28 28 ARG N N 28 115.323 115.323 123.896 -8.573 17893 5124 1 17 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.977 -0.229 17893 5125 1 17 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.463 -0.544 17893 5126 1 17 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.903 -0.853 17893 5127 1 17 . 1 1 28 28 ARG H H 28 8.242 8.242 8.960 -0.718 17893 5128 1 17 . 1 1 29 29 GLN N N 29 117.343 117.343 117.735 -0.392 17893 5129 1 17 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.063 0.111 17893 5130 1 17 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.911 0.174 17893 5131 1 17 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.694 -0.126 17893 5132 1 17 . 1 1 29 29 GLN H H 29 8.827 8.827 8.858 -0.031 17893 5133 1 17 . 1 1 30 30 THR N N 30 119.996 119.996 117.128 2.868 17893 5134 1 17 . 1 1 30 30 THR HA H 30 4.434 4.434 4.283 0.151 17893 5135 1 17 . 1 1 30 30 THR CA C 30 67.621 67.621 65.424 2.197 17893 5136 1 17 . 1 1 30 30 THR CB C 30 66.513 66.513 68.382 -1.869 17893 5137 1 17 . 1 1 30 30 THR H H 30 8.132 8.132 7.854 0.278 17893 5138 1 17 . 1 1 31 31 ILE N N 31 118.828 118.828 123.140 -4.312 17893 5139 1 17 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.807 -0.021 17893 5140 1 17 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.822 -2.793 17893 5141 1 17 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.798 -1.721 17893 5142 1 17 . 1 1 31 31 ILE H H 31 7.163 7.163 7.326 -0.163 17893 5143 1 17 . 1 1 32 32 ASN N N 32 118.098 118.098 119.260 -1.162 17893 5144 1 17 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.400 -0.045 17893 5145 1 17 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.207 0.047 17893 5146 1 17 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.295 0.953 17893 5147 1 17 . 1 1 32 32 ASN H H 32 8.656 8.656 8.997 -0.341 17893 5148 1 17 . 1 1 33 33 GLY N N 33 124.952 124.952 108.963 15.989 17893 5149 1 17 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.872 0.268 17893 5150 1 17 . 1 1 33 33 GLY H H 33 8.643 8.643 8.588 0.055 17893 5151 1 17 . 1 1 34 34 ILE N N 34 122.233 122.233 122.794 -0.561 17893 5152 1 17 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.863 0.441 17893 5153 1 17 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.519 0.285 17893 5154 1 17 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.320 -0.034 17893 5155 1 17 . 1 1 34 34 ILE H H 34 8.203 8.203 7.870 0.333 17893 5156 1 17 . 1 1 35 35 GLU N N 35 120.686 120.686 118.611 2.075 17893 5157 1 17 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.086 0.128 17893 5158 1 17 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.652 1.040 17893 5159 1 17 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.690 -0.838 17893 5160 1 17 . 1 1 35 35 GLU H H 35 8.575 8.575 8.666 -0.091 17893 5161 1 17 . 1 1 36 36 LYS N N 36 116.029 116.029 117.451 -1.422 17893 5162 1 17 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.094 0.427 17893 5163 1 17 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.256 -2.749 17893 5164 1 17 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.264 -1.325 17893 5165 1 17 . 1 1 36 36 LYS H H 36 8.107 8.107 8.470 -0.363 17893 5166 1 17 . 1 1 37 37 ASN N N 37 114.692 114.692 111.501 3.191 17893 5167 1 17 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.630 0.119 17893 5168 1 17 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.521 1.267 17893 5169 1 17 . 1 1 37 37 ASN CB C 37 36.949 36.949 38.597 -1.648 17893 5170 1 17 . 1 1 37 37 ASN H H 37 8.240 8.240 7.877 0.363 17893 5171 1 17 . 1 1 38 38 LYS N N 38 115.098 115.098 120.216 -5.118 17893 5172 1 17 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.335 0.101 17893 5173 1 17 . 1 1 38 38 LYS CA C 38 56.178 56.178 56.982 -0.804 17893 5174 1 17 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.407 -0.171 17893 5175 1 17 . 1 1 38 38 LYS H H 38 8.727 8.727 8.453 0.274 17893 5176 1 17 . 1 1 39 39 TYR N N 39 117.011 117.011 117.127 -0.116 17893 5177 1 17 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.863 -0.234 17893 5178 1 17 . 1 1 39 39 TYR CA C 39 55.559 55.559 56.207 -0.648 17893 5179 1 17 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.269 0.634 17893 5180 1 17 . 1 1 39 39 TYR H H 39 7.087 7.087 7.453 -0.366 17893 5181 1 17 . 1 1 40 40 ASN N N 40 123.595 123.595 120.427 3.168 17893 5182 1 17 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.873 0.380 17893 5183 1 17 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.362 -1.590 17893 5184 1 17 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.092 -0.616 17893 5185 1 17 . 1 1 40 40 ASN H H 40 8.842 8.842 8.536 0.306 17893 5186 1 17 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.410 -0.601 17893 5187 1 17 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.753 -0.224 17893 5188 1 17 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.090 -0.529 17893 5189 1 17 . 1 1 42 42 SER N N 42 125.580 125.580 116.645 8.935 17893 5190 1 17 . 1 1 42 42 SER HA H 42 4.581 4.581 4.317 0.264 17893 5191 1 17 . 1 1 42 42 SER CA C 42 57.380 57.380 58.377 -0.997 17893 5192 1 17 . 1 1 42 42 SER CB C 42 64.562 64.562 63.865 0.697 17893 5193 1 17 . 1 1 42 42 SER H H 42 8.033 8.033 8.243 -0.210 17893 5194 1 17 . 1 1 43 43 LEU N N 43 120.759 120.759 125.778 -5.019 17893 5195 1 17 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.019 -0.105 17893 5196 1 17 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.540 -0.195 17893 5197 1 17 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.662 -0.806 17893 5198 1 17 . 1 1 43 43 LEU H H 43 9.289 9.289 8.696 0.593 17893 5199 1 17 . 1 1 44 44 GLN N N 44 115.948 115.948 118.904 -2.956 17893 5200 1 17 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.063 -0.336 17893 5201 1 17 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.374 0.762 17893 5202 1 17 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.225 0.025 17893 5203 1 17 . 1 1 44 44 GLN H H 44 8.906 8.906 8.640 0.266 17893 5204 1 17 . 1 1 45 45 LEU N N 45 119.419 119.419 119.297 0.122 17893 5205 1 17 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.982 -0.057 17893 5206 1 17 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.503 -2.899 17893 5207 1 17 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.477 -0.850 17893 5208 1 17 . 1 1 45 45 LEU H H 45 8.078 8.078 8.010 0.068 17893 5209 1 17 . 1 1 46 46 ALA N N 46 120.544 120.544 122.560 -2.016 17893 5210 1 17 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.941 0.107 17893 5211 1 17 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.328 0.416 17893 5212 1 17 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.980 1.753 17893 5213 1 17 . 1 1 46 46 ALA H H 46 8.518 8.518 8.741 -0.223 17893 5214 1 17 . 1 1 47 47 LEU N N 47 116.461 116.461 118.659 -2.198 17893 5215 1 17 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.813 0.402 17893 5216 1 17 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.067 -0.566 17893 5217 1 17 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.585 -0.499 17893 5218 1 17 . 1 1 47 47 LEU H H 47 8.676 8.676 8.697 -0.021 17893 5219 1 17 . 1 1 48 48 LYS N N 48 120.958 120.958 119.971 0.987 17893 5220 1 17 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.679 -0.079 17893 5221 1 17 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.648 0.281 17893 5222 1 17 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.277 -0.009 17893 5223 1 17 . 1 1 48 48 LYS H H 48 8.036 8.036 8.059 -0.023 17893 5224 1 17 . 1 1 49 49 ILE N N 49 120.407 120.407 120.320 0.087 17893 5225 1 17 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.859 -0.260 17893 5226 1 17 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.678 1.524 17893 5227 1 17 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.962 -0.309 17893 5228 1 17 . 1 1 49 49 ILE H H 49 8.779 8.779 8.483 0.296 17893 5229 1 17 . 1 1 50 50 ALA N N 50 120.480 120.480 123.026 -2.546 17893 5230 1 17 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.017 0.062 17893 5231 1 17 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.221 0.402 17893 5232 1 17 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.087 -0.082 17893 5233 1 17 . 1 1 50 50 ALA H H 50 8.173 8.173 8.481 -0.308 17893 5234 1 17 . 1 1 51 51 TYR N N 51 117.118 117.118 120.116 -2.998 17893 5235 1 17 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.975 0.390 17893 5236 1 17 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.156 -0.723 17893 5237 1 17 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.405 -0.182 17893 5238 1 17 . 1 1 51 51 TYR H H 51 8.169 8.169 8.080 0.089 17893 5239 1 17 . 1 1 52 52 TYR N N 52 118.548 118.548 115.989 2.559 17893 5240 1 17 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.151 0.170 17893 5241 1 17 . 1 1 52 52 TYR CA C 52 62.969 62.969 60.581 2.388 17893 5242 1 17 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.010 -0.532 17893 5243 1 17 . 1 1 52 52 TYR H H 52 9.062 9.062 7.610 1.452 17893 5244 1 17 . 1 1 53 53 LEU N N 53 115.380 115.380 115.038 0.342 17893 5245 1 17 . 1 1 53 53 LEU HA H 53 4.537 4.537 3.984 0.553 17893 5246 1 17 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.502 -2.358 17893 5247 1 17 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.210 -2.114 17893 5248 1 17 . 1 1 53 53 LEU H H 53 8.394 8.394 8.330 0.064 17893 5249 1 17 . 1 1 54 54 ASN N N 54 122.105 122.105 114.402 7.703 17893 5250 1 17 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.319 0.137 17893 5251 1 17 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.226 -0.435 17893 5252 1 17 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.594 0.164 17893 5253 1 17 . 1 1 54 54 ASN H H 54 8.091 8.091 8.134 -0.043 17893 5254 1 17 . 1 1 55 55 THR N N 55 114.964 114.964 114.250 0.714 17893 5255 1 17 . 1 1 55 55 THR HA H 55 4.947 4.947 4.757 0.190 17893 5256 1 17 . 1 1 55 55 THR CA C 55 60.062 60.062 59.279 0.783 17893 5257 1 17 . 1 1 55 55 THR CB C 55 74.945 74.945 70.854 4.091 17893 5258 1 17 . 1 1 55 55 THR H H 55 8.248 8.248 7.888 0.360 17893 5259 1 17 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.552 0.058 17893 5260 1 17 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.801 0.041 17893 5261 1 17 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.525 -0.579 17893 5262 1 17 . 1 1 57 57 LEU N N 57 127.597 127.597 125.216 2.381 17893 5263 1 17 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.084 -0.013 17893 5264 1 17 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.667 1.054 17893 5265 1 17 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.100 -0.607 17893 5266 1 17 . 1 1 57 57 LEU H H 57 9.958 9.958 8.595 1.363 17893 5267 1 17 . 1 1 58 58 GLU N N 58 123.260 123.260 119.001 4.259 17893 5268 1 17 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.330 0.556 17893 5269 1 17 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.017 -0.500 17893 5270 1 17 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.075 -0.017 17893 5271 1 17 . 1 1 58 58 GLU H H 58 9.353 9.353 8.792 0.561 17893 5272 1 17 . 1 1 59 59 ASP N N 59 117.681 117.681 118.772 -1.091 17893 5273 1 17 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.448 0.206 17893 5274 1 17 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.348 -0.725 17893 5275 1 17 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.078 -1.087 17893 5276 1 17 . 1 1 59 59 ASP H H 59 8.012 8.012 7.740 0.272 17893 5277 1 17 . 1 1 60 60 ILE N N 60 119.519 119.519 117.114 2.405 17893 5278 1 17 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.852 -0.309 17893 5279 1 17 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.184 0.722 17893 5280 1 17 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.208 0.208 17893 5281 1 17 . 1 1 60 60 ILE H H 60 8.210 8.210 7.175 1.035 17893 5282 1 17 . 1 1 61 61 PHE N N 61 116.030 116.030 117.776 -1.746 17893 5283 1 17 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.795 -0.349 17893 5284 1 17 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.706 0.114 17893 5285 1 17 . 1 1 61 61 PHE CB C 61 41.965 41.965 42.202 -0.237 17893 5286 1 17 . 1 1 61 61 PHE H H 61 8.530 8.530 8.694 -0.164 17893 5287 1 17 . 1 1 62 62 GLN N N 62 116.829 116.829 120.264 -3.435 17893 5288 1 17 . 1 1 62 62 GLN HA H 62 5.057 5.057 5.029 0.028 17893 5289 1 17 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.765 0.224 17893 5290 1 17 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.024 -0.196 17893 5291 1 17 . 1 1 62 62 GLN H H 62 8.737 8.737 8.966 -0.229 17893 5292 1 17 . 1 1 63 63 TRP N N 63 125.623 125.623 121.851 3.772 17893 5293 1 17 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.608 -0.401 17893 5294 1 17 . 1 1 63 63 TRP CA C 63 56.531 56.531 55.020 1.511 17893 5295 1 17 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.509 0.195 17893 5296 1 17 . 1 1 63 63 TRP H H 63 9.464 9.464 8.861 0.603 17893 5297 1 17 . 1 1 64 64 GLN N N 64 127.029 127.029 121.974 5.055 17893 5298 1 17 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.697 -0.499 17893 5299 1 17 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.177 -0.675 17893 5300 1 17 . 1 1 64 64 GLN CB C 64 30.673 30.673 31.060 -0.387 17893 5301 1 17 . 1 1 64 64 GLN H H 64 7.977 7.977 9.289 -1.312 17893 5302 1 17 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.380 0.300 17893 5303 1 17 . 1 1 65 65 PRO CA C 65 61.655 61.655 64.826 -3.171 17893 5304 1 17 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.126 -0.626 17893 5305 1 18 . 1 1 2 2 ILE N N 2 123.389 123.389 120.521 2.868 17893 5306 1 18 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.957 0.164 17893 5307 1 18 . 1 1 2 2 ILE CA C 2 60.173 60.173 58.983 1.190 17893 5308 1 18 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.332 -0.200 17893 5309 1 18 . 1 1 2 2 ILE H H 2 9.112 9.112 7.674 1.438 17893 5310 1 18 . 1 1 3 3 ILE N N 3 108.863 108.863 128.423 -19.560 17893 5311 1 18 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.169 0.264 17893 5312 1 18 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.603 -0.449 17893 5313 1 18 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.245 -0.590 17893 5314 1 18 . 1 1 3 3 ILE H H 3 9.418 9.418 9.388 0.030 17893 5315 1 18 . 1 1 4 4 ASN N N 4 123.919 123.919 126.388 -2.469 17893 5316 1 18 . 1 1 4 4 ASN HA H 4 5.632 5.632 5.067 0.565 17893 5317 1 18 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.182 -0.804 17893 5318 1 18 . 1 1 4 4 ASN CB C 4 41.037 41.037 39.161 1.876 17893 5319 1 18 . 1 1 4 4 ASN H H 4 9.056 9.056 8.906 0.150 17893 5320 1 18 . 1 1 5 5 ASN N N 5 120.944 120.944 124.046 -3.102 17893 5321 1 18 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.820 0.623 17893 5322 1 18 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.744 -1.329 17893 5323 1 18 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.645 1.168 17893 5324 1 18 . 1 1 5 5 ASN H H 5 9.383 9.383 9.141 0.242 17893 5325 1 18 . 1 1 6 6 LEU N N 6 120.594 120.594 122.988 -2.394 17893 5326 1 18 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.851 -0.084 17893 5327 1 18 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.257 0.442 17893 5328 1 18 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.639 -0.834 17893 5329 1 18 . 1 1 6 6 LEU H H 6 8.531 8.531 9.290 -0.759 17893 5330 1 18 . 1 1 7 7 LYS N N 7 118.212 118.212 118.043 0.169 17893 5331 1 18 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.957 -0.024 17893 5332 1 18 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.401 0.862 17893 5333 1 18 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.292 1.011 17893 5334 1 18 . 1 1 7 7 LYS H H 7 8.933 8.933 8.197 0.736 17893 5335 1 18 . 1 1 8 8 LEU N N 8 116.414 116.414 120.714 -4.300 17893 5336 1 18 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.027 0.146 17893 5337 1 18 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.317 0.073 17893 5338 1 18 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.868 0.160 17893 5339 1 18 . 1 1 8 8 LEU H H 8 7.667 7.667 7.550 0.117 17893 5340 1 18 . 1 1 9 9 ILE N N 9 119.134 119.134 118.526 0.608 17893 5341 1 18 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.535 0.279 17893 5342 1 18 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.278 -2.422 17893 5343 1 18 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.736 -1.274 17893 5344 1 18 . 1 1 9 9 ILE H H 9 8.226 8.226 8.735 -0.509 17893 5345 1 18 . 1 1 10 10 ARG N N 10 120.162 120.162 120.146 0.016 17893 5346 1 18 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.887 0.014 17893 5347 1 18 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.916 0.811 17893 5348 1 18 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.077 -1.578 17893 5349 1 18 . 1 1 10 10 ARG H H 10 9.260 9.260 8.799 0.461 17893 5350 1 18 . 1 1 11 11 GLU N N 11 115.948 115.948 118.483 -2.535 17893 5351 1 18 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.120 0.053 17893 5352 1 18 . 1 1 11 11 GLU CA C 11 59.386 59.386 59.254 0.132 17893 5353 1 18 . 1 1 11 11 GLU CB C 11 28.914 28.914 28.911 0.003 17893 5354 1 18 . 1 1 11 11 GLU H H 11 8.701 8.701 8.317 0.384 17893 5355 1 18 . 1 1 12 12 LYS N N 12 122.900 122.900 118.854 4.046 17893 5356 1 18 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.059 0.163 17893 5357 1 18 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.207 0.209 17893 5358 1 18 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.491 -0.493 17893 5359 1 18 . 1 1 12 12 LYS H H 12 8.254 8.254 7.492 0.762 17893 5360 1 18 . 1 1 13 13 LYS N N 13 116.385 116.385 114.889 1.496 17893 5361 1 18 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.373 -0.076 17893 5362 1 18 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.352 -0.321 17893 5363 1 18 . 1 1 13 13 LYS CB C 13 31.549 31.549 33.067 -1.518 17893 5364 1 18 . 1 1 13 13 LYS H H 13 7.809 7.809 7.513 0.296 17893 5365 1 18 . 1 1 14 14 LYS N N 14 115.317 115.317 117.405 -2.088 17893 5366 1 18 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.967 0.015 17893 5367 1 18 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.777 0.111 17893 5368 1 18 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.530 -1.244 17893 5369 1 18 . 1 1 14 14 LYS H H 14 8.069 8.069 7.864 0.205 17893 5370 1 18 . 1 1 15 15 ILE N N 15 118.431 118.431 119.833 -1.402 17893 5371 1 18 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.213 0.410 17893 5372 1 18 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.057 0.142 17893 5373 1 18 . 1 1 15 15 ILE CB C 15 40.896 40.896 37.484 3.412 17893 5374 1 18 . 1 1 15 15 ILE H H 15 7.569 7.569 8.035 -0.466 17893 5375 1 18 . 1 1 16 16 SER N N 16 125.034 125.034 120.556 4.478 17893 5376 1 18 . 1 1 16 16 SER HA H 16 4.585 4.585 4.469 0.116 17893 5377 1 18 . 1 1 16 16 SER CA C 16 57.004 57.004 57.541 -0.537 17893 5378 1 18 . 1 1 16 16 SER CB C 16 64.914 64.914 64.177 0.737 17893 5379 1 18 . 1 1 16 16 SER H H 16 9.440 9.440 9.578 -0.138 17893 5380 1 18 . 1 1 17 17 GLN N N 17 120.228 120.228 126.406 -6.178 17893 5381 1 18 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.011 -0.224 17893 5382 1 18 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.824 1.692 17893 5383 1 18 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.837 0.214 17893 5384 1 18 . 1 1 17 17 GLN H H 17 9.527 9.527 9.080 0.447 17893 5385 1 18 . 1 1 18 18 SER N N 18 112.979 112.979 114.835 -1.856 17893 5386 1 18 . 1 1 18 18 SER HA H 18 4.531 4.531 4.044 0.487 17893 5387 1 18 . 1 1 18 18 SER CA C 18 62.872 62.872 62.411 0.461 17893 5388 1 18 . 1 1 18 18 SER CB C 18 65.338 65.338 62.730 2.608 17893 5389 1 18 . 1 1 18 18 SER H H 18 8.949 8.949 8.140 0.809 17893 5390 1 18 . 1 1 19 19 GLU N N 19 124.147 124.147 122.216 1.931 17893 5391 1 18 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.073 0.034 17893 5392 1 18 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.559 0.054 17893 5393 1 18 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.371 0.168 17893 5394 1 18 . 1 1 19 19 GLU H H 19 8.331 8.331 7.461 0.870 17893 5395 1 18 . 1 1 20 20 LEU N N 20 119.943 119.943 122.049 -2.106 17893 5396 1 18 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.918 0.236 17893 5397 1 18 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.689 -0.115 17893 5398 1 18 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.401 -0.396 17893 5399 1 18 . 1 1 20 20 LEU H H 20 8.314 8.314 8.550 -0.236 17893 5400 1 18 . 1 1 21 21 ALA N N 21 119.877 119.877 121.495 -1.618 17893 5401 1 18 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.923 -0.199 17893 5402 1 18 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.221 0.232 17893 5403 1 18 . 1 1 21 21 ALA CB C 21 16.861 16.861 17.971 -1.110 17893 5404 1 18 . 1 1 21 21 ALA H H 21 8.588 8.588 8.903 -0.315 17893 5405 1 18 . 1 1 22 22 ALA N N 22 117.330 117.330 121.462 -4.132 17893 5406 1 18 . 1 1 22 22 ALA HA H 22 4.264 4.264 4.012 0.252 17893 5407 1 18 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.512 0.097 17893 5408 1 18 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.474 -0.818 17893 5409 1 18 . 1 1 22 22 ALA H H 22 7.813 7.813 7.695 0.118 17893 5410 1 18 . 1 1 23 23 LEU N N 23 118.586 118.586 117.996 0.590 17893 5411 1 18 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.603 0.358 17893 5412 1 18 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.181 -0.081 17893 5413 1 18 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.276 0.148 17893 5414 1 18 . 1 1 23 23 LEU H H 23 7.538 7.538 7.991 -0.453 17893 5415 1 18 . 1 1 24 24 LEU N N 24 114.488 114.488 115.715 -1.227 17893 5416 1 18 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.271 -0.007 17893 5417 1 18 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.759 -0.965 17893 5418 1 18 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.195 1.238 17893 5419 1 18 . 1 1 24 24 LEU H H 24 7.449 7.449 8.181 -0.732 17893 5420 1 18 . 1 1 25 25 GLU N N 25 114.895 114.895 115.329 -0.434 17893 5421 1 18 . 1 1 25 25 GLU HA H 25 3.966 3.966 3.974 -0.008 17893 5422 1 18 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.224 -0.076 17893 5423 1 18 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.429 -0.436 17893 5424 1 18 . 1 1 25 25 GLU H H 25 8.029 8.029 7.909 0.120 17893 5425 1 18 . 1 1 26 26 VAL N N 26 109.738 109.738 113.038 -3.300 17893 5426 1 18 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.572 0.318 17893 5427 1 18 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.099 -0.818 17893 5428 1 18 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.330 -0.035 17893 5429 1 18 . 1 1 26 26 VAL H H 26 7.989 7.989 7.902 0.087 17893 5430 1 18 . 1 1 27 27 SER N N 27 114.381 114.381 115.441 -1.060 17893 5431 1 18 . 1 1 27 27 SER HA H 27 4.644 4.644 4.502 0.142 17893 5432 1 18 . 1 1 27 27 SER CA C 27 56.445 56.445 57.810 -1.365 17893 5433 1 18 . 1 1 27 27 SER CB C 27 62.251 62.251 64.349 -2.098 17893 5434 1 18 . 1 1 27 27 SER H H 27 8.618 8.618 8.236 0.382 17893 5435 1 18 . 1 1 28 28 ARG N N 28 115.323 115.323 122.992 -7.669 17893 5436 1 18 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.969 -0.221 17893 5437 1 18 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.053 -0.134 17893 5438 1 18 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.975 -0.925 17893 5439 1 18 . 1 1 28 28 ARG H H 28 8.242 8.242 8.854 -0.612 17893 5440 1 18 . 1 1 29 29 GLN N N 29 117.343 117.343 115.571 1.772 17893 5441 1 18 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.123 0.051 17893 5442 1 18 . 1 1 29 29 GLN CA C 29 59.085 59.085 59.120 -0.035 17893 5443 1 18 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.676 -0.108 17893 5444 1 18 . 1 1 29 29 GLN H H 29 8.827 8.827 8.881 -0.054 17893 5445 1 18 . 1 1 30 30 THR N N 30 119.996 119.996 117.386 2.610 17893 5446 1 18 . 1 1 30 30 THR HA H 30 4.434 4.434 4.290 0.144 17893 5447 1 18 . 1 1 30 30 THR CA C 30 67.621 67.621 66.670 0.951 17893 5448 1 18 . 1 1 30 30 THR CB C 30 66.513 66.513 68.347 -1.834 17893 5449 1 18 . 1 1 30 30 THR H H 30 8.132 8.132 7.662 0.470 17893 5450 1 18 . 1 1 31 31 ILE N N 31 118.828 118.828 121.407 -2.579 17893 5451 1 18 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.774 0.012 17893 5452 1 18 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.675 -2.646 17893 5453 1 18 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.746 -1.669 17893 5454 1 18 . 1 1 31 31 ILE H H 31 7.163 7.163 7.406 -0.243 17893 5455 1 18 . 1 1 32 32 ASN N N 32 118.098 118.098 119.063 -0.965 17893 5456 1 18 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.438 -0.083 17893 5457 1 18 . 1 1 32 32 ASN CA C 32 57.254 57.254 57.153 0.101 17893 5458 1 18 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.484 0.763 17893 5459 1 18 . 1 1 32 32 ASN H H 32 8.656 8.656 8.656 -0.000 17893 5460 1 18 . 1 1 33 33 GLY N N 33 124.952 124.952 108.940 16.012 17893 5461 1 18 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.956 0.183 17893 5462 1 18 . 1 1 33 33 GLY H H 33 8.643 8.643 8.867 -0.224 17893 5463 1 18 . 1 1 34 34 ILE N N 34 122.233 122.233 123.109 -0.876 17893 5464 1 18 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.952 0.352 17893 5465 1 18 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.506 0.298 17893 5466 1 18 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.156 0.130 17893 5467 1 18 . 1 1 34 34 ILE H H 34 8.203 8.203 7.619 0.584 17893 5468 1 18 . 1 1 35 35 GLU N N 35 120.686 120.686 119.854 0.832 17893 5469 1 18 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.050 0.164 17893 5470 1 18 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.844 0.848 17893 5471 1 18 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.329 -0.477 17893 5472 1 18 . 1 1 35 35 GLU H H 35 8.575 8.575 8.050 0.525 17893 5473 1 18 . 1 1 36 36 LYS N N 36 116.029 116.029 117.104 -1.075 17893 5474 1 18 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.287 0.234 17893 5475 1 18 . 1 1 36 36 LYS CA C 36 55.507 55.507 55.174 0.333 17893 5476 1 18 . 1 1 36 36 LYS CB C 36 31.939 31.939 31.342 0.597 17893 5477 1 18 . 1 1 36 36 LYS H H 36 8.107 8.107 8.240 -0.133 17893 5478 1 18 . 1 1 37 37 ASN N N 37 114.692 114.692 113.145 1.547 17893 5479 1 18 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.257 0.492 17893 5480 1 18 . 1 1 37 37 ASN CA C 37 54.788 54.788 54.554 0.234 17893 5481 1 18 . 1 1 37 37 ASN CB C 37 36.949 36.949 36.502 0.447 17893 5482 1 18 . 1 1 37 37 ASN H H 37 8.240 8.240 7.789 0.451 17893 5483 1 18 . 1 1 38 38 LYS N N 38 115.098 115.098 116.960 -1.862 17893 5484 1 18 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.043 0.393 17893 5485 1 18 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.683 -2.505 17893 5486 1 18 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.020 0.216 17893 5487 1 18 . 1 1 38 38 LYS H H 38 8.727 8.727 8.259 0.468 17893 5488 1 18 . 1 1 39 39 TYR N N 39 117.011 117.011 113.083 3.928 17893 5489 1 18 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.752 -0.123 17893 5490 1 18 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.664 -0.105 17893 5491 1 18 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.038 0.865 17893 5492 1 18 . 1 1 39 39 TYR H H 39 7.087 7.087 7.009 0.078 17893 5493 1 18 . 1 1 40 40 ASN N N 40 123.595 123.595 120.951 2.644 17893 5494 1 18 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.854 0.399 17893 5495 1 18 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.077 -1.305 17893 5496 1 18 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.026 -0.550 17893 5497 1 18 . 1 1 40 40 ASN H H 40 8.842 8.842 8.479 0.363 17893 5498 1 18 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.434 -0.625 17893 5499 1 18 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.672 -0.143 17893 5500 1 18 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.224 -0.663 17893 5501 1 18 . 1 1 42 42 SER N N 42 125.580 125.580 116.015 9.565 17893 5502 1 18 . 1 1 42 42 SER HA H 42 4.581 4.581 4.250 0.331 17893 5503 1 18 . 1 1 42 42 SER CA C 42 57.380 57.380 57.861 -0.481 17893 5504 1 18 . 1 1 42 42 SER CB C 42 64.562 64.562 63.956 0.606 17893 5505 1 18 . 1 1 42 42 SER H H 42 8.033 8.033 8.188 -0.155 17893 5506 1 18 . 1 1 43 43 LEU N N 43 120.759 120.759 124.482 -3.723 17893 5507 1 18 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.041 -0.127 17893 5508 1 18 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.441 -0.096 17893 5509 1 18 . 1 1 43 43 LEU CB C 43 40.856 40.856 40.983 -0.127 17893 5510 1 18 . 1 1 43 43 LEU H H 43 9.289 9.289 8.720 0.569 17893 5511 1 18 . 1 1 44 44 GLN N N 44 115.948 115.948 118.862 -2.914 17893 5512 1 18 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.130 -0.403 17893 5513 1 18 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.191 0.945 17893 5514 1 18 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.435 -0.185 17893 5515 1 18 . 1 1 44 44 GLN H H 44 8.906 8.906 8.612 0.294 17893 5516 1 18 . 1 1 45 45 LEU N N 45 119.419 119.419 119.540 -0.121 17893 5517 1 18 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.054 -0.129 17893 5518 1 18 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.414 -2.810 17893 5519 1 18 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.441 -0.814 17893 5520 1 18 . 1 1 45 45 LEU H H 45 8.078 8.078 7.986 0.092 17893 5521 1 18 . 1 1 46 46 ALA N N 46 120.544 120.544 122.140 -1.596 17893 5522 1 18 . 1 1 46 46 ALA HA H 46 4.048 4.048 4.039 0.009 17893 5523 1 18 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.341 0.403 17893 5524 1 18 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.236 1.497 17893 5525 1 18 . 1 1 46 46 ALA H H 46 8.518 8.518 8.798 -0.280 17893 5526 1 18 . 1 1 47 47 LEU N N 47 116.461 116.461 118.983 -2.522 17893 5527 1 18 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.898 0.317 17893 5528 1 18 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.072 -0.571 17893 5529 1 18 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.630 -0.544 17893 5530 1 18 . 1 1 47 47 LEU H H 47 8.676 8.676 8.313 0.363 17893 5531 1 18 . 1 1 48 48 LYS N N 48 120.958 120.958 120.274 0.684 17893 5532 1 18 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.990 -0.390 17893 5533 1 18 . 1 1 48 48 LYS CA C 48 59.929 59.929 60.054 -0.125 17893 5534 1 18 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.462 -0.194 17893 5535 1 18 . 1 1 48 48 LYS H H 48 8.036 8.036 8.478 -0.442 17893 5536 1 18 . 1 1 49 49 ILE N N 49 120.407 120.407 120.238 0.169 17893 5537 1 18 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.873 -0.274 17893 5538 1 18 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.306 1.896 17893 5539 1 18 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.820 -0.167 17893 5540 1 18 . 1 1 49 49 ILE H H 49 8.779 8.779 8.647 0.132 17893 5541 1 18 . 1 1 50 50 ALA N N 50 120.480 120.480 124.045 -3.565 17893 5542 1 18 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.131 -0.052 17893 5543 1 18 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.222 0.401 17893 5544 1 18 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.291 -0.286 17893 5545 1 18 . 1 1 50 50 ALA H H 50 8.173 8.173 8.358 -0.185 17893 5546 1 18 . 1 1 51 51 TYR N N 51 117.118 117.118 120.235 -3.117 17893 5547 1 18 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.982 0.383 17893 5548 1 18 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.078 -0.645 17893 5549 1 18 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.401 -0.178 17893 5550 1 18 . 1 1 51 51 TYR H H 51 8.169 8.169 8.566 -0.397 17893 5551 1 18 . 1 1 52 52 TYR N N 52 118.548 118.548 116.523 2.025 17893 5552 1 18 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.111 0.210 17893 5553 1 18 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.629 1.340 17893 5554 1 18 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.378 -0.900 17893 5555 1 18 . 1 1 52 52 TYR H H 52 9.062 9.062 8.251 0.811 17893 5556 1 18 . 1 1 53 53 LEU N N 53 115.380 115.380 116.368 -0.988 17893 5557 1 18 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.082 0.455 17893 5558 1 18 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.448 -2.304 17893 5559 1 18 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.271 -2.175 17893 5560 1 18 . 1 1 53 53 LEU H H 53 8.394 8.394 8.664 -0.270 17893 5561 1 18 . 1 1 54 54 ASN N N 54 122.105 122.105 114.377 7.728 17893 5562 1 18 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.334 0.122 17893 5563 1 18 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.329 -0.538 17893 5564 1 18 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.272 0.486 17893 5565 1 18 . 1 1 54 54 ASN H H 54 8.091 8.091 8.089 0.002 17893 5566 1 18 . 1 1 55 55 THR N N 55 114.964 114.964 114.935 0.029 17893 5567 1 18 . 1 1 55 55 THR HA H 55 4.947 4.947 4.746 0.201 17893 5568 1 18 . 1 1 55 55 THR CA C 55 60.062 60.062 60.007 0.055 17893 5569 1 18 . 1 1 55 55 THR CB C 55 74.945 74.945 71.238 3.707 17893 5570 1 18 . 1 1 55 55 THR H H 55 8.248 8.248 8.215 0.033 17893 5571 1 18 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.612 -0.002 17893 5572 1 18 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.677 0.165 17893 5573 1 18 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.501 -0.555 17893 5574 1 18 . 1 1 57 57 LEU N N 57 127.597 127.597 125.145 2.452 17893 5575 1 18 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.131 -0.060 17893 5576 1 18 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.663 1.059 17893 5577 1 18 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.214 -0.721 17893 5578 1 18 . 1 1 57 57 LEU H H 57 9.958 9.958 8.567 1.391 17893 5579 1 18 . 1 1 58 58 GLU N N 58 123.260 123.260 118.686 4.574 17893 5580 1 18 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.332 0.554 17893 5581 1 18 . 1 1 58 58 GLU CA C 58 58.517 58.517 58.916 -0.399 17893 5582 1 18 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.039 0.019 17893 5583 1 18 . 1 1 58 58 GLU H H 58 9.353 9.353 8.848 0.505 17893 5584 1 18 . 1 1 59 59 ASP N N 59 117.681 117.681 117.289 0.392 17893 5585 1 18 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.417 0.237 17893 5586 1 18 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.523 -0.900 17893 5587 1 18 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.931 -0.940 17893 5588 1 18 . 1 1 59 59 ASP H H 59 8.012 8.012 7.938 0.074 17893 5589 1 18 . 1 1 60 60 ILE N N 60 119.519 119.519 117.281 2.238 17893 5590 1 18 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.701 -0.158 17893 5591 1 18 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.502 0.404 17893 5592 1 18 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.577 0.839 17893 5593 1 18 . 1 1 60 60 ILE H H 60 8.210 8.210 7.126 1.084 17893 5594 1 18 . 1 1 61 61 PHE N N 61 116.030 116.030 118.673 -2.643 17893 5595 1 18 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.599 -0.153 17893 5596 1 18 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.621 0.200 17893 5597 1 18 . 1 1 61 61 PHE CB C 61 41.965 41.965 39.811 2.154 17893 5598 1 18 . 1 1 61 61 PHE H H 61 8.530 8.530 8.582 -0.052 17893 5599 1 18 . 1 1 62 62 GLN N N 62 116.829 116.829 122.248 -5.419 17893 5600 1 18 . 1 1 62 62 GLN HA H 62 5.057 5.057 5.018 0.039 17893 5601 1 18 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.819 0.169 17893 5602 1 18 . 1 1 62 62 GLN CB C 62 31.828 31.828 30.956 0.872 17893 5603 1 18 . 1 1 62 62 GLN H H 62 8.737 8.737 9.214 -0.477 17893 5604 1 18 . 1 1 63 63 TRP N N 63 125.623 125.623 123.363 2.260 17893 5605 1 18 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.438 -0.231 17893 5606 1 18 . 1 1 63 63 TRP CA C 63 56.531 56.531 55.319 1.212 17893 5607 1 18 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.427 0.277 17893 5608 1 18 . 1 1 63 63 TRP H H 63 9.464 9.464 8.934 0.530 17893 5609 1 18 . 1 1 64 64 GLN N N 64 127.029 127.029 119.479 7.550 17893 5610 1 18 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.465 -0.267 17893 5611 1 18 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.419 -0.917 17893 5612 1 18 . 1 1 64 64 GLN CB C 64 30.673 30.673 28.252 2.421 17893 5613 1 18 . 1 1 64 64 GLN H H 64 7.977 7.977 8.552 -0.575 17893 5614 1 18 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.000 0.680 17893 5615 1 18 . 1 1 65 65 PRO CA C 65 61.655 61.655 62.752 -1.097 17893 5616 1 18 . 1 1 65 65 PRO CB C 65 31.500 31.500 31.980 -0.480 17893 5617 1 19 . 1 1 2 2 ILE N N 2 123.389 123.389 120.718 2.671 17893 5618 1 19 . 1 1 2 2 ILE HA H 2 5.121 5.121 5.206 -0.085 17893 5619 1 19 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.125 1.048 17893 5620 1 19 . 1 1 2 2 ILE CB C 2 39.132 39.132 39.189 -0.057 17893 5621 1 19 . 1 1 2 2 ILE H H 2 9.112 9.112 7.778 1.334 17893 5622 1 19 . 1 1 3 3 ILE N N 3 108.863 108.863 128.270 -19.407 17893 5623 1 19 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.259 0.174 17893 5624 1 19 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.369 -0.215 17893 5625 1 19 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.625 -0.970 17893 5626 1 19 . 1 1 3 3 ILE H H 3 9.418 9.418 9.228 0.190 17893 5627 1 19 . 1 1 4 4 ASN N N 4 123.919 123.919 125.891 -1.972 17893 5628 1 19 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.984 0.648 17893 5629 1 19 . 1 1 4 4 ASN CA C 4 51.378 51.378 50.851 0.527 17893 5630 1 19 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.641 2.396 17893 5631 1 19 . 1 1 4 4 ASN H H 4 9.056 9.056 8.836 0.220 17893 5632 1 19 . 1 1 5 5 ASN N N 5 120.944 120.944 123.251 -2.307 17893 5633 1 19 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.691 0.752 17893 5634 1 19 . 1 1 5 5 ASN CA C 5 51.415 51.415 53.131 -1.716 17893 5635 1 19 . 1 1 5 5 ASN CB C 5 39.813 39.813 37.606 2.207 17893 5636 1 19 . 1 1 5 5 ASN H H 5 9.383 9.383 9.154 0.229 17893 5637 1 19 . 1 1 6 6 LEU N N 6 120.594 120.594 122.581 -1.987 17893 5638 1 19 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.854 -0.087 17893 5639 1 19 . 1 1 6 6 LEU CA C 6 59.699 59.699 58.583 1.116 17893 5640 1 19 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.597 -0.792 17893 5641 1 19 . 1 1 6 6 LEU H H 6 8.531 8.531 7.667 0.864 17893 5642 1 19 . 1 1 7 7 LYS N N 7 118.212 118.212 118.297 -0.085 17893 5643 1 19 . 1 1 7 7 LYS HA H 7 3.933 3.933 3.974 -0.041 17893 5644 1 19 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.368 0.895 17893 5645 1 19 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.395 0.908 17893 5646 1 19 . 1 1 7 7 LYS H H 7 8.933 8.933 7.646 1.287 17893 5647 1 19 . 1 1 8 8 LEU N N 8 116.414 116.414 120.492 -4.078 17893 5648 1 19 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.045 0.128 17893 5649 1 19 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.238 0.152 17893 5650 1 19 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.897 0.131 17893 5651 1 19 . 1 1 8 8 LEU H H 8 7.667 7.667 7.559 0.108 17893 5652 1 19 . 1 1 9 9 ILE N N 9 119.134 119.134 118.948 0.186 17893 5653 1 19 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.558 0.256 17893 5654 1 19 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.204 -2.348 17893 5655 1 19 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.576 -1.114 17893 5656 1 19 . 1 1 9 9 ILE H H 9 8.226 8.226 8.677 -0.451 17893 5657 1 19 . 1 1 10 10 ARG N N 10 120.162 120.162 120.072 0.090 17893 5658 1 19 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.805 0.096 17893 5659 1 19 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.951 0.776 17893 5660 1 19 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.127 -1.627 17893 5661 1 19 . 1 1 10 10 ARG H H 10 9.260 9.260 8.740 0.520 17893 5662 1 19 . 1 1 11 11 GLU N N 11 115.948 115.948 118.104 -2.156 17893 5663 1 19 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.071 0.102 17893 5664 1 19 . 1 1 11 11 GLU CA C 11 59.386 59.386 59.418 -0.032 17893 5665 1 19 . 1 1 11 11 GLU CB C 11 28.914 28.914 28.994 -0.080 17893 5666 1 19 . 1 1 11 11 GLU H H 11 8.701 8.701 7.849 0.852 17893 5667 1 19 . 1 1 12 12 LYS N N 12 122.900 122.900 119.491 3.409 17893 5668 1 19 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.060 0.162 17893 5669 1 19 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.381 0.035 17893 5670 1 19 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.334 -0.336 17893 5671 1 19 . 1 1 12 12 LYS H H 12 8.254 8.254 7.441 0.813 17893 5672 1 19 . 1 1 13 13 LYS N N 13 116.385 116.385 115.372 1.013 17893 5673 1 19 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.307 -0.010 17893 5674 1 19 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.474 -0.443 17893 5675 1 19 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.532 -0.983 17893 5676 1 19 . 1 1 13 13 LYS H H 13 7.809 7.809 7.612 0.197 17893 5677 1 19 . 1 1 14 14 LYS N N 14 115.317 115.317 116.562 -1.245 17893 5678 1 19 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.923 0.059 17893 5679 1 19 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.734 0.154 17893 5680 1 19 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.811 -1.525 17893 5681 1 19 . 1 1 14 14 LYS H H 14 8.069 8.069 7.291 0.778 17893 5682 1 19 . 1 1 15 15 ILE N N 15 118.431 118.431 120.465 -2.034 17893 5683 1 19 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.202 0.421 17893 5684 1 19 . 1 1 15 15 ILE CA C 15 59.199 59.199 60.084 -0.885 17893 5685 1 19 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.624 2.272 17893 5686 1 19 . 1 1 15 15 ILE H H 15 7.569 7.569 8.245 -0.676 17893 5687 1 19 . 1 1 16 16 SER N N 16 125.034 125.034 121.505 3.529 17893 5688 1 19 . 1 1 16 16 SER HA H 16 4.585 4.585 4.465 0.120 17893 5689 1 19 . 1 1 16 16 SER CA C 16 57.004 57.004 57.953 -0.949 17893 5690 1 19 . 1 1 16 16 SER CB C 16 64.914 64.914 64.562 0.352 17893 5691 1 19 . 1 1 16 16 SER H H 16 9.440 9.440 9.367 0.073 17893 5692 1 19 . 1 1 17 17 GLN N N 17 120.228 120.228 124.519 -4.291 17893 5693 1 19 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.068 -0.281 17893 5694 1 19 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.677 1.839 17893 5695 1 19 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.854 0.197 17893 5696 1 19 . 1 1 17 17 GLN H H 17 9.527 9.527 8.989 0.538 17893 5697 1 19 . 1 1 18 18 SER N N 18 112.979 112.979 115.299 -2.320 17893 5698 1 19 . 1 1 18 18 SER HA H 18 4.531 4.531 4.038 0.493 17893 5699 1 19 . 1 1 18 18 SER CA C 18 62.872 62.872 61.853 1.018 17893 5700 1 19 . 1 1 18 18 SER CB C 18 65.338 65.338 62.394 2.944 17893 5701 1 19 . 1 1 18 18 SER H H 18 8.949 8.949 8.007 0.942 17893 5702 1 19 . 1 1 19 19 GLU N N 19 124.147 124.147 122.341 1.806 17893 5703 1 19 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.072 0.035 17893 5704 1 19 . 1 1 19 19 GLU CA C 19 58.613 58.613 59.730 -1.117 17893 5705 1 19 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.301 0.238 17893 5706 1 19 . 1 1 19 19 GLU H H 19 8.331 8.331 8.048 0.283 17893 5707 1 19 . 1 1 20 20 LEU N N 20 119.943 119.943 120.741 -0.798 17893 5708 1 19 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.952 0.202 17893 5709 1 19 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.958 -0.383 17893 5710 1 19 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.542 -0.537 17893 5711 1 19 . 1 1 20 20 LEU H H 20 8.314 8.314 8.444 -0.130 17893 5712 1 19 . 1 1 21 21 ALA N N 21 119.877 119.877 122.183 -2.306 17893 5713 1 19 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.951 -0.227 17893 5714 1 19 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.279 0.175 17893 5715 1 19 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.060 -1.199 17893 5716 1 19 . 1 1 21 21 ALA H H 21 8.588 8.588 8.938 -0.350 17893 5717 1 19 . 1 1 22 22 ALA N N 22 117.330 117.330 121.694 -4.364 17893 5718 1 19 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.958 0.306 17893 5719 1 19 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.903 -0.294 17893 5720 1 19 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.553 -0.897 17893 5721 1 19 . 1 1 22 22 ALA H H 22 7.813 7.813 8.244 -0.431 17893 5722 1 19 . 1 1 23 23 LEU N N 23 118.586 118.586 118.598 -0.012 17893 5723 1 19 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.569 0.392 17893 5724 1 19 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.207 -0.107 17893 5725 1 19 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.249 0.175 17893 5726 1 19 . 1 1 23 23 LEU H H 23 7.538 7.538 8.457 -0.919 17893 5727 1 19 . 1 1 24 24 LEU N N 24 114.488 114.488 117.005 -2.517 17893 5728 1 19 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.435 -0.171 17893 5729 1 19 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.590 -0.796 17893 5730 1 19 . 1 1 24 24 LEU CB C 24 43.433 43.433 41.952 1.481 17893 5731 1 19 . 1 1 24 24 LEU H H 24 7.449 7.449 8.499 -1.050 17893 5732 1 19 . 1 1 25 25 GLU N N 25 114.895 114.895 114.541 0.354 17893 5733 1 19 . 1 1 25 25 GLU HA H 25 3.966 3.966 3.986 -0.020 17893 5734 1 19 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.548 -0.401 17893 5735 1 19 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.137 -0.143 17893 5736 1 19 . 1 1 25 25 GLU H H 25 8.029 8.029 7.656 0.373 17893 5737 1 19 . 1 1 26 26 VAL N N 26 109.738 109.738 111.596 -1.858 17893 5738 1 19 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.769 0.121 17893 5739 1 19 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.548 -1.267 17893 5740 1 19 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.042 0.253 17893 5741 1 19 . 1 1 26 26 VAL H H 26 7.989 7.989 8.024 -0.035 17893 5742 1 19 . 1 1 27 27 SER N N 27 114.381 114.381 115.997 -1.616 17893 5743 1 19 . 1 1 27 27 SER HA H 27 4.644 4.644 4.477 0.167 17893 5744 1 19 . 1 1 27 27 SER CA C 27 56.445 56.445 58.084 -1.639 17893 5745 1 19 . 1 1 27 27 SER CB C 27 62.251 62.251 64.108 -1.857 17893 5746 1 19 . 1 1 27 27 SER H H 27 8.618 8.618 8.368 0.250 17893 5747 1 19 . 1 1 28 28 ARG N N 28 115.323 115.323 123.859 -8.536 17893 5748 1 19 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.964 -0.216 17893 5749 1 19 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.286 -0.367 17893 5750 1 19 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.875 -0.825 17893 5751 1 19 . 1 1 28 28 ARG H H 28 8.242 8.242 8.944 -0.702 17893 5752 1 19 . 1 1 29 29 GLN N N 29 117.343 117.343 115.740 1.603 17893 5753 1 19 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.237 -0.063 17893 5754 1 19 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.869 0.216 17893 5755 1 19 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.782 -0.214 17893 5756 1 19 . 1 1 29 29 GLN H H 29 8.827 8.827 8.807 0.020 17893 5757 1 19 . 1 1 30 30 THR N N 30 119.996 119.996 116.685 3.311 17893 5758 1 19 . 1 1 30 30 THR HA H 30 4.434 4.434 4.290 0.144 17893 5759 1 19 . 1 1 30 30 THR CA C 30 67.621 67.621 65.536 2.085 17893 5760 1 19 . 1 1 30 30 THR CB C 30 66.513 66.513 68.293 -1.780 17893 5761 1 19 . 1 1 30 30 THR H H 30 8.132 8.132 7.644 0.488 17893 5762 1 19 . 1 1 31 31 ILE N N 31 118.828 118.828 123.172 -4.344 17893 5763 1 19 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.815 -0.029 17893 5764 1 19 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.273 -2.244 17893 5765 1 19 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.719 -1.642 17893 5766 1 19 . 1 1 31 31 ILE H H 31 7.163 7.163 7.538 -0.375 17893 5767 1 19 . 1 1 32 32 ASN N N 32 118.098 118.098 118.814 -0.716 17893 5768 1 19 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.391 -0.036 17893 5769 1 19 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.178 1.075 17893 5770 1 19 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.440 0.809 17893 5771 1 19 . 1 1 32 32 ASN H H 32 8.656 8.656 8.812 -0.156 17893 5772 1 19 . 1 1 33 33 GLY N N 33 124.952 124.952 106.932 18.020 17893 5773 1 19 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.830 0.310 17893 5774 1 19 . 1 1 33 33 GLY H H 33 8.643 8.643 8.619 0.024 17893 5775 1 19 . 1 1 34 34 ILE N N 34 122.233 122.233 120.730 1.503 17893 5776 1 19 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.744 0.560 17893 5777 1 19 . 1 1 34 34 ILE CA C 34 64.804 64.804 63.755 1.049 17893 5778 1 19 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.138 0.148 17893 5779 1 19 . 1 1 34 34 ILE H H 34 8.203 8.203 7.730 0.473 17893 5780 1 19 . 1 1 35 35 GLU N N 35 120.686 120.686 117.857 2.829 17893 5781 1 19 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.012 0.202 17893 5782 1 19 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.191 0.501 17893 5783 1 19 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.881 -1.029 17893 5784 1 19 . 1 1 35 35 GLU H H 35 8.575 8.575 7.895 0.680 17893 5785 1 19 . 1 1 36 36 LYS N N 36 116.029 116.029 117.085 -1.056 17893 5786 1 19 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.147 0.374 17893 5787 1 19 . 1 1 36 36 LYS CA C 36 55.507 55.507 58.160 -2.653 17893 5788 1 19 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.739 -1.800 17893 5789 1 19 . 1 1 36 36 LYS H H 36 8.107 8.107 7.839 0.268 17893 5790 1 19 . 1 1 37 37 ASN N N 37 114.692 114.692 114.748 -0.056 17893 5791 1 19 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.807 -0.058 17893 5792 1 19 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.209 1.579 17893 5793 1 19 . 1 1 37 37 ASN CB C 37 36.949 36.949 40.121 -3.172 17893 5794 1 19 . 1 1 37 37 ASN H H 37 8.240 8.240 8.407 -0.167 17893 5795 1 19 . 1 1 38 38 LYS N N 38 115.098 115.098 121.960 -6.862 17893 5796 1 19 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.424 0.012 17893 5797 1 19 . 1 1 38 38 LYS CA C 38 56.178 56.178 56.931 -0.753 17893 5798 1 19 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.742 -0.506 17893 5799 1 19 . 1 1 38 38 LYS H H 38 8.727 8.727 8.383 0.344 17893 5800 1 19 . 1 1 39 39 TYR N N 39 117.011 117.011 117.005 0.006 17893 5801 1 19 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.809 -0.180 17893 5802 1 19 . 1 1 39 39 TYR CA C 39 55.559 55.559 56.219 -0.660 17893 5803 1 19 . 1 1 39 39 TYR CB C 39 39.903 39.903 38.982 0.921 17893 5804 1 19 . 1 1 39 39 TYR H H 39 7.087 7.087 7.492 -0.405 17893 5805 1 19 . 1 1 40 40 ASN N N 40 123.595 123.595 121.216 2.379 17893 5806 1 19 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.791 0.462 17893 5807 1 19 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.539 -1.767 17893 5808 1 19 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.119 -0.643 17893 5809 1 19 . 1 1 40 40 ASN H H 40 8.842 8.842 8.495 0.347 17893 5810 1 19 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.568 -0.759 17893 5811 1 19 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.746 -0.217 17893 5812 1 19 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.149 -0.588 17893 5813 1 19 . 1 1 42 42 SER N N 42 125.580 125.580 116.250 9.330 17893 5814 1 19 . 1 1 42 42 SER HA H 42 4.581 4.581 4.266 0.315 17893 5815 1 19 . 1 1 42 42 SER CA C 42 57.380 57.380 58.187 -0.807 17893 5816 1 19 . 1 1 42 42 SER CB C 42 64.562 64.562 64.016 0.546 17893 5817 1 19 . 1 1 42 42 SER H H 42 8.033 8.033 8.241 -0.208 17893 5818 1 19 . 1 1 43 43 LEU N N 43 120.759 120.759 125.431 -4.672 17893 5819 1 19 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.001 -0.087 17893 5820 1 19 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.494 -0.149 17893 5821 1 19 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.496 -0.640 17893 5822 1 19 . 1 1 43 43 LEU H H 43 9.289 9.289 8.774 0.515 17893 5823 1 19 . 1 1 44 44 GLN N N 44 115.948 115.948 118.814 -2.866 17893 5824 1 19 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.073 -0.346 17893 5825 1 19 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.386 0.750 17893 5826 1 19 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.177 0.073 17893 5827 1 19 . 1 1 44 44 GLN H H 44 8.906 8.906 8.653 0.253 17893 5828 1 19 . 1 1 45 45 LEU N N 45 119.419 119.419 119.433 -0.014 17893 5829 1 19 . 1 1 45 45 LEU HA H 45 3.925 3.925 3.983 -0.058 17893 5830 1 19 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.551 -2.947 17893 5831 1 19 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.492 -0.865 17893 5832 1 19 . 1 1 45 45 LEU H H 45 8.078 8.078 7.996 0.082 17893 5833 1 19 . 1 1 46 46 ALA N N 46 120.544 120.544 122.451 -1.907 17893 5834 1 19 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.980 0.068 17893 5835 1 19 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.304 0.440 17893 5836 1 19 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.027 1.706 17893 5837 1 19 . 1 1 46 46 ALA H H 46 8.518 8.518 8.876 -0.358 17893 5838 1 19 . 1 1 47 47 LEU N N 47 116.461 116.461 118.747 -2.286 17893 5839 1 19 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.847 0.368 17893 5840 1 19 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.064 -0.563 17893 5841 1 19 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.579 -0.493 17893 5842 1 19 . 1 1 47 47 LEU H H 47 8.676 8.676 8.678 -0.002 17893 5843 1 19 . 1 1 48 48 LYS N N 48 120.958 120.958 120.134 0.824 17893 5844 1 19 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.788 -0.188 17893 5845 1 19 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.834 0.096 17893 5846 1 19 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.322 -0.054 17893 5847 1 19 . 1 1 48 48 LYS H H 48 8.036 8.036 8.014 0.022 17893 5848 1 19 . 1 1 49 49 ILE N N 49 120.407 120.407 120.389 0.018 17893 5849 1 19 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.921 -0.322 17893 5850 1 19 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.398 1.804 17893 5851 1 19 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.880 -0.227 17893 5852 1 19 . 1 1 49 49 ILE H H 49 8.779 8.779 8.484 0.295 17893 5853 1 19 . 1 1 50 50 ALA N N 50 120.480 120.480 122.984 -2.504 17893 5854 1 19 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.079 -0.000 17893 5855 1 19 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.222 0.401 17893 5856 1 19 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.175 -0.170 17893 5857 1 19 . 1 1 50 50 ALA H H 50 8.173 8.173 8.569 -0.396 17893 5858 1 19 . 1 1 51 51 TYR N N 51 117.118 117.118 120.443 -3.325 17893 5859 1 19 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.981 0.384 17893 5860 1 19 . 1 1 51 51 TYR CA C 51 61.433 61.433 61.947 -0.514 17893 5861 1 19 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.304 -0.081 17893 5862 1 19 . 1 1 51 51 TYR H H 51 8.169 8.169 8.328 -0.159 17893 5863 1 19 . 1 1 52 52 TYR N N 52 118.548 118.548 115.987 2.561 17893 5864 1 19 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.046 0.275 17893 5865 1 19 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.069 1.900 17893 5866 1 19 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.180 -0.702 17893 5867 1 19 . 1 1 52 52 TYR H H 52 9.062 9.062 8.174 0.888 17893 5868 1 19 . 1 1 53 53 LEU N N 53 115.380 115.380 116.658 -1.278 17893 5869 1 19 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.071 0.466 17893 5870 1 19 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.560 -2.416 17893 5871 1 19 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.376 -2.280 17893 5872 1 19 . 1 1 53 53 LEU H H 53 8.394 8.394 8.604 -0.210 17893 5873 1 19 . 1 1 54 54 ASN N N 54 122.105 122.105 115.188 6.917 17893 5874 1 19 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.308 0.148 17893 5875 1 19 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.212 -0.421 17893 5876 1 19 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.295 0.463 17893 5877 1 19 . 1 1 54 54 ASN H H 54 8.091 8.091 8.167 -0.076 17893 5878 1 19 . 1 1 55 55 THR N N 55 114.964 114.964 115.204 -0.240 17893 5879 1 19 . 1 1 55 55 THR HA H 55 4.947 4.947 4.598 0.349 17893 5880 1 19 . 1 1 55 55 THR CA C 55 60.062 60.062 60.986 -0.924 17893 5881 1 19 . 1 1 55 55 THR CB C 55 74.945 74.945 71.525 3.420 17893 5882 1 19 . 1 1 55 55 THR H H 55 8.248 8.248 7.965 0.283 17893 5883 1 19 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.580 0.030 17893 5884 1 19 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.556 0.286 17893 5885 1 19 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.436 -0.490 17893 5886 1 19 . 1 1 57 57 LEU N N 57 127.597 127.597 125.987 1.610 17893 5887 1 19 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.060 0.011 17893 5888 1 19 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.827 0.895 17893 5889 1 19 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.172 -0.679 17893 5890 1 19 . 1 1 57 57 LEU H H 57 9.958 9.958 8.605 1.353 17893 5891 1 19 . 1 1 58 58 GLU N N 58 123.260 123.260 117.419 5.841 17893 5892 1 19 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.343 0.543 17893 5893 1 19 . 1 1 58 58 GLU CA C 58 58.517 58.517 58.951 -0.434 17893 5894 1 19 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.215 -0.157 17893 5895 1 19 . 1 1 58 58 GLU H H 58 9.353 9.353 8.626 0.727 17893 5896 1 19 . 1 1 59 59 ASP N N 59 117.681 117.681 118.760 -1.079 17893 5897 1 19 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.480 0.174 17893 5898 1 19 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.592 -0.969 17893 5899 1 19 . 1 1 59 59 ASP CB C 59 39.991 39.991 41.192 -1.201 17893 5900 1 19 . 1 1 59 59 ASP H H 59 8.012 8.012 7.878 0.134 17893 5901 1 19 . 1 1 60 60 ILE N N 60 119.519 119.519 115.530 3.989 17893 5902 1 19 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.695 -0.152 17893 5903 1 19 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.068 0.838 17893 5904 1 19 . 1 1 60 60 ILE CB C 60 39.416 39.416 38.915 0.501 17893 5905 1 19 . 1 1 60 60 ILE H H 60 8.210 8.210 7.138 1.072 17893 5906 1 19 . 1 1 61 61 PHE N N 61 116.030 116.030 117.866 -1.836 17893 5907 1 19 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.544 -0.098 17893 5908 1 19 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.903 -0.082 17893 5909 1 19 . 1 1 61 61 PHE CB C 61 41.965 41.965 41.353 0.612 17893 5910 1 19 . 1 1 61 61 PHE H H 61 8.530 8.530 8.640 -0.110 17893 5911 1 19 . 1 1 62 62 GLN N N 62 116.829 116.829 120.102 -3.273 17893 5912 1 19 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.847 0.210 17893 5913 1 19 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.698 0.291 17893 5914 1 19 . 1 1 62 62 GLN CB C 62 31.828 31.828 32.327 -0.499 17893 5915 1 19 . 1 1 62 62 GLN H H 62 8.737 8.737 9.124 -0.387 17893 5916 1 19 . 1 1 63 63 TRP N N 63 125.623 125.623 125.330 0.293 17893 5917 1 19 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.049 0.158 17893 5918 1 19 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.999 -0.468 17893 5919 1 19 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.634 0.070 17893 5920 1 19 . 1 1 63 63 TRP H H 63 9.464 9.464 8.743 0.721 17893 5921 1 19 . 1 1 64 64 GLN N N 64 127.029 127.029 126.066 0.963 17893 5922 1 19 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.262 -0.064 17893 5923 1 19 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.242 -0.741 17893 5924 1 19 . 1 1 64 64 GLN CB C 64 30.673 30.673 28.948 1.726 17893 5925 1 19 . 1 1 64 64 GLN H H 64 7.977 7.977 8.251 -0.274 17893 5926 1 19 . 1 1 65 65 PRO HA H 65 4.680 4.680 3.030 1.650 17893 5927 1 19 . 1 1 65 65 PRO CA C 65 61.655 61.655 62.993 -1.338 17893 5928 1 19 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.465 -0.965 17893 5929 1 20 . 1 1 2 2 ILE N N 2 123.389 123.389 120.981 2.408 17893 5930 1 20 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.785 0.336 17893 5931 1 20 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.754 0.419 17893 5932 1 20 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.188 0.944 17893 5933 1 20 . 1 1 2 2 ILE H H 2 9.112 9.112 7.830 1.282 17893 5934 1 20 . 1 1 3 3 ILE N N 3 108.863 108.863 129.205 -20.342 17893 5935 1 20 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.212 0.221 17893 5936 1 20 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.577 -0.423 17893 5937 1 20 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.182 -0.527 17893 5938 1 20 . 1 1 3 3 ILE H H 3 9.418 9.418 9.417 0.001 17893 5939 1 20 . 1 1 4 4 ASN N N 4 123.919 123.919 126.327 -2.408 17893 5940 1 20 . 1 1 4 4 ASN HA H 4 5.632 5.632 5.063 0.569 17893 5941 1 20 . 1 1 4 4 ASN CA C 4 51.378 51.378 51.205 0.173 17893 5942 1 20 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.451 2.586 17893 5943 1 20 . 1 1 4 4 ASN H H 4 9.056 9.056 8.883 0.173 17893 5944 1 20 . 1 1 5 5 ASN N N 5 120.944 120.944 121.679 -0.735 17893 5945 1 20 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.749 0.694 17893 5946 1 20 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.730 -1.315 17893 5947 1 20 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.125 1.688 17893 5948 1 20 . 1 1 5 5 ASN H H 5 9.383 9.383 9.163 0.220 17893 5949 1 20 . 1 1 6 6 LEU N N 6 120.594 120.594 122.720 -2.126 17893 5950 1 20 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.829 -0.062 17893 5951 1 20 . 1 1 6 6 LEU CA C 6 59.699 59.699 58.896 0.803 17893 5952 1 20 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.579 -0.774 17893 5953 1 20 . 1 1 6 6 LEU H H 6 8.531 8.531 7.814 0.717 17893 5954 1 20 . 1 1 7 7 LYS N N 7 118.212 118.212 118.101 0.111 17893 5955 1 20 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.145 -0.212 17893 5956 1 20 . 1 1 7 7 LYS CA C 7 60.263 60.263 58.894 1.369 17893 5957 1 20 . 1 1 7 7 LYS CB C 7 32.303 32.303 30.744 1.559 17893 5958 1 20 . 1 1 7 7 LYS H H 7 8.933 8.933 8.270 0.663 17893 5959 1 20 . 1 1 8 8 LEU N N 8 116.414 116.414 121.072 -4.658 17893 5960 1 20 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.042 0.131 17893 5961 1 20 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.452 -0.062 17893 5962 1 20 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.859 0.169 17893 5963 1 20 . 1 1 8 8 LEU H H 8 7.667 7.667 7.562 0.105 17893 5964 1 20 . 1 1 9 9 ILE N N 9 119.134 119.134 118.473 0.661 17893 5965 1 20 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.572 0.242 17893 5966 1 20 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.129 -2.273 17893 5967 1 20 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.638 -1.176 17893 5968 1 20 . 1 1 9 9 ILE H H 9 8.226 8.226 8.606 -0.380 17893 5969 1 20 . 1 1 10 10 ARG N N 10 120.162 120.162 120.218 -0.056 17893 5970 1 20 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.840 0.061 17893 5971 1 20 . 1 1 10 10 ARG CA C 10 60.727 60.727 59.849 0.878 17893 5972 1 20 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.144 -1.645 17893 5973 1 20 . 1 1 10 10 ARG H H 10 9.260 9.260 8.668 0.592 17893 5974 1 20 . 1 1 11 11 GLU N N 11 115.948 115.948 117.327 -1.379 17893 5975 1 20 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.151 0.022 17893 5976 1 20 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.769 0.617 17893 5977 1 20 . 1 1 11 11 GLU CB C 11 28.914 28.914 28.985 -0.071 17893 5978 1 20 . 1 1 11 11 GLU H H 11 8.701 8.701 8.725 -0.024 17893 5979 1 20 . 1 1 12 12 LYS N N 12 122.900 122.900 119.886 3.014 17893 5980 1 20 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.085 0.137 17893 5981 1 20 . 1 1 12 12 LYS CA C 12 59.416 59.416 58.839 0.577 17893 5982 1 20 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.431 -0.433 17893 5983 1 20 . 1 1 12 12 LYS H H 12 8.254 8.254 7.516 0.738 17893 5984 1 20 . 1 1 13 13 LYS N N 13 116.385 116.385 114.929 1.456 17893 5985 1 20 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.424 -0.127 17893 5986 1 20 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.310 -0.279 17893 5987 1 20 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.826 -1.277 17893 5988 1 20 . 1 1 13 13 LYS H H 13 7.809 7.809 7.584 0.225 17893 5989 1 20 . 1 1 14 14 LYS N N 14 115.317 115.317 117.693 -2.376 17893 5990 1 20 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.908 0.075 17893 5991 1 20 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.870 0.018 17893 5992 1 20 . 1 1 14 14 LYS CB C 14 28.286 28.286 30.069 -1.783 17893 5993 1 20 . 1 1 14 14 LYS H H 14 8.069 8.069 7.741 0.328 17893 5994 1 20 . 1 1 15 15 ILE N N 15 118.431 118.431 120.628 -2.197 17893 5995 1 20 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.189 0.434 17893 5996 1 20 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.541 -0.342 17893 5997 1 20 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.657 2.239 17893 5998 1 20 . 1 1 15 15 ILE H H 15 7.569 7.569 8.098 -0.529 17893 5999 1 20 . 1 1 16 16 SER N N 16 125.034 125.034 123.490 1.544 17893 6000 1 20 . 1 1 16 16 SER HA H 16 4.585 4.585 4.639 -0.054 17893 6001 1 20 . 1 1 16 16 SER CA C 16 57.004 57.004 57.689 -0.685 17893 6002 1 20 . 1 1 16 16 SER CB C 16 64.914 64.914 64.774 0.140 17893 6003 1 20 . 1 1 16 16 SER H H 16 9.440 9.440 8.633 0.807 17893 6004 1 20 . 1 1 17 17 GLN N N 17 120.228 120.228 121.203 -0.975 17893 6005 1 20 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.027 -0.240 17893 6006 1 20 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.471 2.045 17893 6007 1 20 . 1 1 17 17 GLN CB C 17 29.051 29.051 27.878 1.173 17893 6008 1 20 . 1 1 17 17 GLN H H 17 9.527 9.527 8.895 0.632 17893 6009 1 20 . 1 1 18 18 SER N N 18 112.979 112.979 114.469 -1.490 17893 6010 1 20 . 1 1 18 18 SER HA H 18 4.531 4.531 4.073 0.458 17893 6011 1 20 . 1 1 18 18 SER CA C 18 62.872 62.872 61.992 0.880 17893 6012 1 20 . 1 1 18 18 SER CB C 18 65.338 65.338 62.762 2.576 17893 6013 1 20 . 1 1 18 18 SER H H 18 8.949 8.949 8.741 0.208 17893 6014 1 20 . 1 1 19 19 GLU N N 19 124.147 124.147 121.838 2.309 17893 6015 1 20 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.041 0.066 17893 6016 1 20 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.590 0.023 17893 6017 1 20 . 1 1 19 19 GLU CB C 19 29.539 29.539 28.892 0.647 17893 6018 1 20 . 1 1 19 19 GLU H H 19 8.331 8.331 8.001 0.330 17893 6019 1 20 . 1 1 20 20 LEU N N 20 119.943 119.943 121.404 -1.461 17893 6020 1 20 . 1 1 20 20 LEU HA H 20 4.154 4.154 4.007 0.147 17893 6021 1 20 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.742 -0.168 17893 6022 1 20 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.433 -0.428 17893 6023 1 20 . 1 1 20 20 LEU H H 20 8.314 8.314 7.639 0.675 17893 6024 1 20 . 1 1 21 21 ALA N N 21 119.877 119.877 121.658 -1.781 17893 6025 1 20 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.979 -0.255 17893 6026 1 20 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.137 0.317 17893 6027 1 20 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.093 -1.232 17893 6028 1 20 . 1 1 21 21 ALA H H 21 8.588 8.588 8.791 -0.203 17893 6029 1 20 . 1 1 22 22 ALA N N 22 117.330 117.330 121.933 -4.603 17893 6030 1 20 . 1 1 22 22 ALA HA H 22 4.264 4.264 4.005 0.259 17893 6031 1 20 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.721 -0.112 17893 6032 1 20 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.500 -0.844 17893 6033 1 20 . 1 1 22 22 ALA H H 22 7.813 7.813 8.212 -0.399 17893 6034 1 20 . 1 1 23 23 LEU N N 23 118.586 118.586 117.805 0.781 17893 6035 1 20 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.664 0.297 17893 6036 1 20 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.137 -0.037 17893 6037 1 20 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.372 0.052 17893 6038 1 20 . 1 1 23 23 LEU H H 23 7.538 7.538 8.190 -0.652 17893 6039 1 20 . 1 1 24 24 LEU N N 24 114.488 114.488 117.359 -2.871 17893 6040 1 20 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.400 -0.136 17893 6041 1 20 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.759 -0.965 17893 6042 1 20 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.381 1.052 17893 6043 1 20 . 1 1 24 24 LEU H H 24 7.449 7.449 7.754 -0.305 17893 6044 1 20 . 1 1 25 25 GLU N N 25 114.895 114.895 115.534 -0.639 17893 6045 1 20 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.013 -0.047 17893 6046 1 20 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.357 -0.209 17893 6047 1 20 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.628 -0.635 17893 6048 1 20 . 1 1 25 25 GLU H H 25 8.029 8.029 7.639 0.390 17893 6049 1 20 . 1 1 26 26 VAL N N 26 109.738 109.738 111.676 -1.938 17893 6050 1 20 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.797 0.093 17893 6051 1 20 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.151 -0.870 17893 6052 1 20 . 1 1 26 26 VAL CB C 26 35.295 35.295 34.306 0.989 17893 6053 1 20 . 1 1 26 26 VAL H H 26 7.989 7.989 8.087 -0.098 17893 6054 1 20 . 1 1 27 27 SER N N 27 114.381 114.381 114.920 -0.539 17893 6055 1 20 . 1 1 27 27 SER HA H 27 4.644 4.644 4.586 0.058 17893 6056 1 20 . 1 1 27 27 SER CA C 27 56.445 56.445 57.062 -0.617 17893 6057 1 20 . 1 1 27 27 SER CB C 27 62.251 62.251 64.886 -2.635 17893 6058 1 20 . 1 1 27 27 SER H H 27 8.618 8.618 8.265 0.353 17893 6059 1 20 . 1 1 28 28 ARG N N 28 115.323 115.323 123.302 -7.979 17893 6060 1 20 . 1 1 28 28 ARG HA H 28 3.748 3.748 4.039 -0.291 17893 6061 1 20 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.298 -0.379 17893 6062 1 20 . 1 1 28 28 ARG CB C 28 29.050 29.050 30.224 -1.174 17893 6063 1 20 . 1 1 28 28 ARG H H 28 8.242 8.242 8.895 -0.653 17893 6064 1 20 . 1 1 29 29 GLN N N 29 117.343 117.343 117.502 -0.159 17893 6065 1 20 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.107 0.067 17893 6066 1 20 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.796 0.289 17893 6067 1 20 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.766 -0.198 17893 6068 1 20 . 1 1 29 29 GLN H H 29 8.827 8.827 8.119 0.708 17893 6069 1 20 . 1 1 30 30 THR N N 30 119.996 119.996 117.846 2.150 17893 6070 1 20 . 1 1 30 30 THR HA H 30 4.434 4.434 4.390 0.044 17893 6071 1 20 . 1 1 30 30 THR CA C 30 67.621 67.621 65.561 2.060 17893 6072 1 20 . 1 1 30 30 THR CB C 30 66.513 66.513 68.498 -1.985 17893 6073 1 20 . 1 1 30 30 THR H H 30 8.132 8.132 7.685 0.447 17893 6074 1 20 . 1 1 31 31 ILE N N 31 118.828 118.828 121.920 -3.092 17893 6075 1 20 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.811 -0.025 17893 6076 1 20 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.444 -2.415 17893 6077 1 20 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.379 -1.302 17893 6078 1 20 . 1 1 31 31 ILE H H 31 7.163 7.163 7.462 -0.299 17893 6079 1 20 . 1 1 32 32 ASN N N 32 118.098 118.098 119.065 -0.967 17893 6080 1 20 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.472 -0.117 17893 6081 1 20 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.905 0.349 17893 6082 1 20 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.219 1.028 17893 6083 1 20 . 1 1 32 32 ASN H H 32 8.656 8.656 9.170 -0.514 17893 6084 1 20 . 1 1 33 33 GLY N N 33 124.952 124.952 108.749 16.203 17893 6085 1 20 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.722 0.418 17893 6086 1 20 . 1 1 33 33 GLY H H 33 8.643 8.643 8.698 -0.055 17893 6087 1 20 . 1 1 34 34 ILE N N 34 122.233 122.233 121.617 0.616 17893 6088 1 20 . 1 1 34 34 ILE HA H 34 4.304 4.304 4.178 0.126 17893 6089 1 20 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.391 0.413 17893 6090 1 20 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.270 0.016 17893 6091 1 20 . 1 1 34 34 ILE H H 34 8.203 8.203 7.400 0.803 17893 6092 1 20 . 1 1 35 35 GLU N N 35 120.686 120.686 117.766 2.920 17893 6093 1 20 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.156 0.058 17893 6094 1 20 . 1 1 35 35 GLU CA C 35 59.692 59.692 59.045 0.647 17893 6095 1 20 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.899 -1.047 17893 6096 1 20 . 1 1 35 35 GLU H H 35 8.575 8.575 8.312 0.263 17893 6097 1 20 . 1 1 36 36 LYS N N 36 116.029 116.029 119.014 -2.985 17893 6098 1 20 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.114 0.407 17893 6099 1 20 . 1 1 36 36 LYS CA C 36 55.507 55.507 57.968 -2.461 17893 6100 1 20 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.300 -1.361 17893 6101 1 20 . 1 1 36 36 LYS H H 36 8.107 8.107 8.597 -0.490 17893 6102 1 20 . 1 1 37 37 ASN N N 37 114.692 114.692 113.824 0.868 17893 6103 1 20 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.717 0.032 17893 6104 1 20 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.255 1.533 17893 6105 1 20 . 1 1 37 37 ASN CB C 37 36.949 36.949 38.124 -1.175 17893 6106 1 20 . 1 1 37 37 ASN H H 37 8.240 8.240 7.794 0.446 17893 6107 1 20 . 1 1 38 38 LYS N N 38 115.098 115.098 119.875 -4.777 17893 6108 1 20 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.524 -0.088 17893 6109 1 20 . 1 1 38 38 LYS CA C 38 56.178 56.178 56.849 -0.671 17893 6110 1 20 . 1 1 38 38 LYS CB C 38 33.236 33.236 35.171 -1.935 17893 6111 1 20 . 1 1 38 38 LYS H H 38 8.727 8.727 8.512 0.215 17893 6112 1 20 . 1 1 39 39 TYR N N 39 117.011 117.011 116.408 0.603 17893 6113 1 20 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.825 -0.196 17893 6114 1 20 . 1 1 39 39 TYR CA C 39 55.559 55.559 56.089 -0.530 17893 6115 1 20 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.374 0.529 17893 6116 1 20 . 1 1 39 39 TYR H H 39 7.087 7.087 7.048 0.039 17893 6117 1 20 . 1 1 40 40 ASN N N 40 123.595 123.595 119.820 3.775 17893 6118 1 20 . 1 1 40 40 ASN HA H 40 5.253 5.253 5.031 0.222 17893 6119 1 20 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.181 -1.409 17893 6120 1 20 . 1 1 40 40 ASN CB C 40 38.476 38.476 40.392 -1.916 17893 6121 1 20 . 1 1 40 40 ASN H H 40 8.842 8.842 8.550 0.292 17893 6122 1 20 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.462 -0.653 17893 6123 1 20 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.416 0.113 17893 6124 1 20 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.120 -0.559 17893 6125 1 20 . 1 1 42 42 SER N N 42 125.580 125.580 115.333 10.247 17893 6126 1 20 . 1 1 42 42 SER HA H 42 4.581 4.581 4.274 0.307 17893 6127 1 20 . 1 1 42 42 SER CA C 42 57.380 57.380 57.806 -0.426 17893 6128 1 20 . 1 1 42 42 SER CB C 42 64.562 64.562 63.512 1.050 17893 6129 1 20 . 1 1 42 42 SER H H 42 8.033 8.033 8.226 -0.193 17893 6130 1 20 . 1 1 43 43 LEU N N 43 120.759 120.759 124.959 -4.200 17893 6131 1 20 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.033 -0.119 17893 6132 1 20 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.626 -0.281 17893 6133 1 20 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.679 -0.823 17893 6134 1 20 . 1 1 43 43 LEU H H 43 9.289 9.289 8.631 0.658 17893 6135 1 20 . 1 1 44 44 GLN N N 44 115.948 115.948 118.908 -2.960 17893 6136 1 20 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.071 -0.344 17893 6137 1 20 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.360 0.776 17893 6138 1 20 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.242 0.008 17893 6139 1 20 . 1 1 44 44 GLN H H 44 8.906 8.906 8.597 0.309 17893 6140 1 20 . 1 1 45 45 LEU N N 45 119.419 119.419 119.552 -0.133 17893 6141 1 20 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.042 -0.117 17893 6142 1 20 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.285 -2.681 17893 6143 1 20 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.379 -0.752 17893 6144 1 20 . 1 1 45 45 LEU H H 45 8.078 8.078 7.982 0.096 17893 6145 1 20 . 1 1 46 46 ALA N N 46 120.544 120.544 122.548 -2.004 17893 6146 1 20 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.954 0.094 17893 6147 1 20 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.369 0.375 17893 6148 1 20 . 1 1 46 46 ALA CB C 46 19.733 19.733 17.959 1.774 17893 6149 1 20 . 1 1 46 46 ALA H H 46 8.518 8.518 8.900 -0.382 17893 6150 1 20 . 1 1 47 47 LEU N N 47 116.461 116.461 118.738 -2.277 17893 6151 1 20 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.862 0.353 17893 6152 1 20 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.064 -0.563 17893 6153 1 20 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.565 -0.479 17893 6154 1 20 . 1 1 47 47 LEU H H 47 8.676 8.676 8.527 0.149 17893 6155 1 20 . 1 1 48 48 LYS N N 48 120.958 120.958 120.255 0.703 17893 6156 1 20 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.676 -0.077 17893 6157 1 20 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.797 0.133 17893 6158 1 20 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.284 -0.016 17893 6159 1 20 . 1 1 48 48 LYS H H 48 8.036 8.036 8.247 -0.211 17893 6160 1 20 . 1 1 49 49 ILE N N 49 120.407 120.407 120.207 0.200 17893 6161 1 20 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.931 -0.332 17893 6162 1 20 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.768 1.434 17893 6163 1 20 . 1 1 49 49 ILE CB C 49 37.653 37.653 38.046 -0.393 17893 6164 1 20 . 1 1 49 49 ILE H H 49 8.779 8.779 8.640 0.139 17893 6165 1 20 . 1 1 50 50 ALA N N 50 120.480 120.480 123.143 -2.663 17893 6166 1 20 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.093 -0.014 17893 6167 1 20 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.273 0.350 17893 6168 1 20 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.362 -0.357 17893 6169 1 20 . 1 1 50 50 ALA H H 50 8.173 8.173 8.528 -0.355 17893 6170 1 20 . 1 1 51 51 TYR N N 51 117.118 117.118 120.320 -3.202 17893 6171 1 20 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.979 0.386 17893 6172 1 20 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.270 -0.837 17893 6173 1 20 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.485 -0.262 17893 6174 1 20 . 1 1 51 51 TYR H H 51 8.169 8.169 8.535 -0.366 17893 6175 1 20 . 1 1 52 52 TYR N N 52 118.548 118.548 116.236 2.312 17893 6176 1 20 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.183 0.138 17893 6177 1 20 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.200 1.769 17893 6178 1 20 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.024 -0.546 17893 6179 1 20 . 1 1 52 52 TYR H H 52 9.062 9.062 8.083 0.979 17893 6180 1 20 . 1 1 53 53 LEU N N 53 115.380 115.380 115.977 -0.597 17893 6181 1 20 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.101 0.436 17893 6182 1 20 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.248 -2.104 17893 6183 1 20 . 1 1 53 53 LEU CB C 53 40.096 40.096 41.826 -1.730 17893 6184 1 20 . 1 1 53 53 LEU H H 53 8.394 8.394 8.224 0.170 17893 6185 1 20 . 1 1 54 54 ASN N N 54 122.105 122.105 113.199 8.906 17893 6186 1 20 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.335 0.121 17893 6187 1 20 . 1 1 54 54 ASN CA C 54 53.791 53.791 53.602 0.189 17893 6188 1 20 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.006 0.752 17893 6189 1 20 . 1 1 54 54 ASN H H 54 8.091 8.091 7.758 0.333 17893 6190 1 20 . 1 1 55 55 THR N N 55 114.964 114.964 114.694 0.270 17893 6191 1 20 . 1 1 55 55 THR HA H 55 4.947 4.947 4.782 0.165 17893 6192 1 20 . 1 1 55 55 THR CA C 55 60.062 60.062 59.691 0.371 17893 6193 1 20 . 1 1 55 55 THR CB C 55 74.945 74.945 70.411 4.534 17893 6194 1 20 . 1 1 55 55 THR H H 55 8.248 8.248 7.856 0.392 17893 6195 1 20 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.510 0.100 17893 6196 1 20 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.360 0.482 17893 6197 1 20 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.548 -0.602 17893 6198 1 20 . 1 1 57 57 LEU N N 57 127.597 127.597 125.857 1.740 17893 6199 1 20 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.090 -0.019 17893 6200 1 20 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.949 0.773 17893 6201 1 20 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.160 -0.667 17893 6202 1 20 . 1 1 57 57 LEU H H 57 9.958 9.958 8.613 1.345 17893 6203 1 20 . 1 1 58 58 GLU N N 58 123.260 123.260 117.502 5.758 17893 6204 1 20 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.383 0.503 17893 6205 1 20 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.131 -0.614 17893 6206 1 20 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.059 -0.001 17893 6207 1 20 . 1 1 58 58 GLU H H 58 9.353 9.353 8.672 0.680 17893 6208 1 20 . 1 1 59 59 ASP N N 59 117.681 117.681 118.236 -0.555 17893 6209 1 20 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.482 0.172 17893 6210 1 20 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.197 -0.574 17893 6211 1 20 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.834 -0.843 17893 6212 1 20 . 1 1 59 59 ASP H H 59 8.012 8.012 7.623 0.389 17893 6213 1 20 . 1 1 60 60 ILE N N 60 119.519 119.519 117.856 1.663 17893 6214 1 20 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.744 -0.201 17893 6215 1 20 . 1 1 60 60 ILE CA C 60 63.906 63.906 64.025 -0.119 17893 6216 1 20 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.309 0.107 17893 6217 1 20 . 1 1 60 60 ILE H H 60 8.210 8.210 7.391 0.819 17893 6218 1 20 . 1 1 61 61 PHE N N 61 116.030 116.030 118.146 -2.116 17893 6219 1 20 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.558 -0.112 17893 6220 1 20 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.599 0.222 17893 6221 1 20 . 1 1 61 61 PHE CB C 61 41.965 41.965 39.675 2.290 17893 6222 1 20 . 1 1 61 61 PHE H H 61 8.530 8.530 8.766 -0.236 17893 6223 1 20 . 1 1 62 62 GLN N N 62 116.829 116.829 122.031 -5.202 17893 6224 1 20 . 1 1 62 62 GLN HA H 62 5.057 5.057 5.049 0.008 17893 6225 1 20 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.788 0.201 17893 6226 1 20 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.294 0.534 17893 6227 1 20 . 1 1 62 62 GLN H H 62 8.737 8.737 9.137 -0.400 17893 6228 1 20 . 1 1 63 63 TRP N N 63 125.623 125.623 122.277 3.346 17893 6229 1 20 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.338 -0.131 17893 6230 1 20 . 1 1 63 63 TRP CA C 63 56.531 56.531 55.564 0.967 17893 6231 1 20 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.479 0.225 17893 6232 1 20 . 1 1 63 63 TRP H H 63 9.464 9.464 8.907 0.557 17893 6233 1 20 . 1 1 64 64 GLN N N 64 127.029 127.029 119.467 7.562 17893 6234 1 20 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.261 -0.063 17893 6235 1 20 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.147 -0.645 17893 6236 1 20 . 1 1 64 64 GLN CB C 64 30.673 30.673 30.023 0.650 17893 6237 1 20 . 1 1 64 64 GLN H H 64 7.977 7.977 8.192 -0.215 17893 6238 1 20 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.548 0.132 17893 6239 1 20 . 1 1 65 65 PRO CA C 65 61.655 61.655 64.453 -2.798 17893 6240 1 20 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.246 -0.746 17893 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 61 4.833 0.487 4.848 17893 2 1 1 "Average Difference" HA 65 0.269 -0.101 0.252 17893 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17893 4 1 1 "Average Difference" CA 64 1.096 0.062 1.103 17893 5 1 1 "Average Difference" CB 63 1.156 0.139 1.157 17893 6 1 1 "Average Difference" HN 61 0.534 -0.163 0.513 17893 7 1 2 "Average Difference" N 61 4.621 0.257 4.652 17893 8 1 2 "Average Difference" HA 65 0.327 -0.114 0.309 17893 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17893 10 1 2 "Average Difference" CA 64 1.174 0.246 1.157 17893 11 1 2 "Average Difference" CB 63 1.135 0.127 1.137 17893 12 1 2 "Average Difference" HN 61 0.554 -0.152 0.537 17893 13 1 3 "Average Difference" N 61 4.545 0.324 4.571 17893 14 1 3 "Average Difference" HA 65 0.309 -0.117 0.289 17893 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17893 16 1 3 "Average Difference" CA 64 1.095 0.231 1.079 17893 17 1 3 "Average Difference" CB 63 1.108 0.123 1.110 17893 18 1 3 "Average Difference" HN 61 0.549 -0.137 0.536 17893 19 1 4 "Average Difference" N 61 4.638 0.545 4.644 17893 20 1 4 "Average Difference" HA 65 0.303 -0.121 0.280 17893 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17893 22 1 4 "Average Difference" CA 64 1.114 0.172 1.109 17893 23 1 4 "Average Difference" CB 63 1.132 0.038 1.141 17893 24 1 4 "Average Difference" HN 61 0.563 -0.206 0.528 17893 25 1 5 "Average Difference" N 61 4.531 0.447 4.546 17893 26 1 5 "Average Difference" HA 65 0.303 -0.116 0.282 17893 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17893 28 1 5 "Average Difference" CA 64 1.160 0.236 1.144 17893 29 1 5 "Average Difference" CB 63 1.203 0.171 1.200 17893 30 1 5 "Average Difference" HN 61 0.538 -0.186 0.509 17893 31 1 6 "Average Difference" N 61 4.882 0.370 4.908 17893 32 1 6 "Average Difference" HA 65 0.288 -0.108 0.269 17893 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17893 34 1 6 "Average Difference" CA 64 1.143 0.097 1.148 17893 35 1 6 "Average Difference" CB 63 1.320 0.104 1.326 17893 36 1 6 "Average Difference" HN 61 0.550 -0.175 0.525 17893 37 1 7 "Average Difference" N 61 4.584 0.480 4.596 17893 38 1 7 "Average Difference" HA 65 0.342 -0.129 0.319 17893 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17893 40 1 7 "Average Difference" CA 64 1.206 0.214 1.196 17893 41 1 7 "Average Difference" CB 63 1.167 0.029 1.176 17893 42 1 7 "Average Difference" HN 61 0.508 -0.126 0.496 17893 43 1 8 "Average Difference" N 61 4.672 0.559 4.677 17893 44 1 8 "Average Difference" HA 65 0.285 -0.120 0.260 17893 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17893 46 1 8 "Average Difference" CA 64 1.126 0.206 1.116 17893 47 1 8 "Average Difference" CB 63 1.206 0.044 1.215 17893 48 1 8 "Average Difference" HN 61 0.519 -0.128 0.507 17893 49 1 9 "Average Difference" N 61 4.447 0.392 4.466 17893 50 1 9 "Average Difference" HA 65 0.291 -0.103 0.274 17893 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17893 52 1 9 "Average Difference" CA 64 1.094 0.242 1.076 17893 53 1 9 "Average Difference" CB 63 1.201 0.100 1.207 17893 54 1 9 "Average Difference" HN 61 0.535 -0.141 0.520 17893 55 1 10 "Average Difference" N 61 4.525 0.544 4.530 17893 56 1 10 "Average Difference" HA 65 0.303 -0.107 0.286 17893 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17893 58 1 10 "Average Difference" CA 64 1.026 0.186 1.017 17893 59 1 10 "Average Difference" CB 63 1.196 0.109 1.200 17893 60 1 10 "Average Difference" HN 61 0.528 -0.104 0.522 17893 61 1 11 "Average Difference" N 61 4.599 0.444 4.615 17893 62 1 11 "Average Difference" HA 65 0.309 -0.122 0.286 17893 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17893 64 1 11 "Average Difference" CA 64 1.163 0.243 1.146 17893 65 1 11 "Average Difference" CB 63 1.195 0.066 1.203 17893 66 1 11 "Average Difference" HN 61 0.510 -0.075 0.509 17893 67 1 12 "Average Difference" N 61 4.683 0.471 4.698 17893 68 1 12 "Average Difference" HA 65 0.290 -0.106 0.272 17893 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17893 70 1 12 "Average Difference" CA 64 1.192 0.229 1.179 17893 71 1 12 "Average Difference" CB 63 1.105 0.156 1.103 17893 72 1 12 "Average Difference" HN 61 0.544 -0.134 0.531 17893 73 1 13 "Average Difference" N 61 4.639 0.406 4.660 17893 74 1 13 "Average Difference" HA 65 0.296 -0.103 0.280 17893 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17893 76 1 13 "Average Difference" CA 64 1.071 0.144 1.070 17893 77 1 13 "Average Difference" CB 63 1.170 0.063 1.178 17893 78 1 13 "Average Difference" HN 61 0.556 -0.215 0.517 17893 79 1 14 "Average Difference" N 61 4.550 0.417 4.568 17893 80 1 14 "Average Difference" HA 65 0.278 -0.092 0.265 17893 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17893 82 1 14 "Average Difference" CA 64 1.150 0.247 1.132 17893 83 1 14 "Average Difference" CB 63 1.141 0.145 1.141 17893 84 1 14 "Average Difference" HN 61 0.506 -0.129 0.493 17893 85 1 15 "Average Difference" N 61 4.637 0.554 4.642 17893 86 1 15 "Average Difference" HA 65 0.282 -0.112 0.260 17893 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17893 88 1 15 "Average Difference" CA 64 1.086 0.166 1.082 17893 89 1 15 "Average Difference" CB 63 1.198 0.089 1.204 17893 90 1 15 "Average Difference" HN 61 0.544 -0.153 0.526 17893 91 1 16 "Average Difference" N 61 4.573 0.410 4.593 17893 92 1 16 "Average Difference" HA 65 0.308 -0.129 0.282 17893 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17893 94 1 16 "Average Difference" CA 64 1.195 0.292 1.168 17893 95 1 16 "Average Difference" CB 63 1.191 0.046 1.200 17893 96 1 16 "Average Difference" HN 61 0.519 -0.138 0.505 17893 97 1 17 "Average Difference" N 61 4.468 0.361 4.491 17893 98 1 17 "Average Difference" HA 65 0.302 -0.090 0.290 17893 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17893 100 1 17 "Average Difference" CA 64 1.203 0.169 1.200 17893 101 1 17 "Average Difference" CB 63 1.167 0.152 1.167 17893 102 1 17 "Average Difference" HN 61 0.508 -0.100 0.502 17893 103 1 18 "Average Difference" N 61 4.564 0.265 4.594 17893 104 1 18 "Average Difference" HA 65 0.293 -0.114 0.272 17893 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17893 106 1 18 "Average Difference" CA 64 0.988 0.146 0.985 17893 107 1 18 "Average Difference" CB 63 1.193 -0.024 1.203 17893 108 1 18 "Average Difference" HN 61 0.503 -0.144 0.486 17893 109 1 19 "Average Difference" N 61 4.576 0.445 4.592 17893 110 1 19 "Average Difference" HA 65 0.348 -0.130 0.325 17893 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17893 112 1 19 "Average Difference" CA 64 1.127 0.184 1.121 17893 113 1 19 "Average Difference" CB 63 1.231 0.147 1.232 17893 114 1 19 "Average Difference" HN 61 0.560 -0.177 0.535 17893 115 1 20 "Average Difference" N 61 4.629 0.267 4.659 17893 116 1 20 "Average Difference" HA 65 0.273 -0.084 0.262 17893 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17893 118 1 20 "Average Difference" CA 64 1.057 0.092 1.061 17893 119 1 20 "Average Difference" CB 63 1.304 0.080 1.312 17893 120 1 20 "Average Difference" HN 61 0.505 -0.192 0.471 17893 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 17893 _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 ILE N N 2 123.389 123.389 121.006 2.383 17893 2 1 . 1 1 2 2 ILE HA H 2 5.121 5.121 4.994 0.127 17893 3 1 . 1 1 2 2 ILE CA C 2 60.173 60.173 59.335 0.838 17893 4 1 . 1 1 2 2 ILE CB C 2 39.132 39.132 38.977 0.155 17893 5 1 . 1 1 2 2 ILE H H 2 9.112 9.112 7.763 1.349 17893 6 1 . 1 1 3 3 ILE N N 3 108.863 108.863 128.508 -19.645 17893 7 1 . 1 1 3 3 ILE HA H 3 4.433 4.433 4.188 0.245 17893 8 1 . 1 1 3 3 ILE CA C 3 60.154 60.154 60.471 -0.317 17893 9 1 . 1 1 3 3 ILE CB C 3 38.655 38.655 39.525 -0.870 17893 10 1 . 1 1 3 3 ILE H H 3 9.418 9.418 9.226 0.192 17893 11 1 . 1 1 4 4 ASN N N 4 123.919 123.919 126.129 -2.210 17893 12 1 . 1 1 4 4 ASN HA H 4 5.632 5.632 4.819 0.813 17893 13 1 . 1 1 4 4 ASN CA C 4 51.378 51.378 52.007 -0.629 17893 14 1 . 1 1 4 4 ASN CB C 4 41.037 41.037 38.976 2.061 17893 15 1 . 1 1 4 4 ASN H H 4 9.056 9.056 8.873 0.183 17893 16 1 . 1 1 5 5 ASN N N 5 120.944 120.944 124.355 -3.411 17893 17 1 . 1 1 5 5 ASN HA H 5 5.443 5.443 4.784 0.659 17893 18 1 . 1 1 5 5 ASN CA C 5 51.415 51.415 52.890 -1.475 17893 19 1 . 1 1 5 5 ASN CB C 5 39.813 39.813 38.619 1.194 17893 20 1 . 1 1 5 5 ASN H H 5 9.383 9.383 9.102 0.281 17893 21 1 . 1 1 6 6 LEU N N 6 120.594 120.594 123.031 -2.438 17893 22 1 . 1 1 6 6 LEU HA H 6 3.767 3.767 3.860 -0.093 17893 23 1 . 1 1 6 6 LEU CA C 6 59.699 59.699 59.131 0.568 17893 24 1 . 1 1 6 6 LEU CB C 6 40.805 40.805 41.618 -0.813 17893 25 1 . 1 1 6 6 LEU H H 6 8.531 8.531 9.048 -0.517 17893 26 1 . 1 1 7 7 LYS N N 7 118.212 118.212 118.001 0.211 17893 27 1 . 1 1 7 7 LYS HA H 7 3.933 3.933 4.019 -0.086 17893 28 1 . 1 1 7 7 LYS CA C 7 60.263 60.263 59.218 1.045 17893 29 1 . 1 1 7 7 LYS CB C 7 32.303 32.303 31.346 0.957 17893 30 1 . 1 1 7 7 LYS H H 7 8.933 8.933 7.961 0.972 17893 31 1 . 1 1 8 8 LEU N N 8 116.414 116.414 120.696 -4.282 17893 32 1 . 1 1 8 8 LEU HA H 8 4.173 4.173 4.047 0.126 17893 33 1 . 1 1 8 8 LEU CA C 8 57.390 57.390 57.339 0.051 17893 34 1 . 1 1 8 8 LEU CB C 8 42.028 42.028 41.878 0.150 17893 35 1 . 1 1 8 8 LEU H H 8 7.667 7.667 7.550 0.117 17893 36 1 . 1 1 9 9 ILE N N 9 119.134 119.134 118.865 0.269 17893 37 1 . 1 1 9 9 ILE HA H 9 3.814 3.814 3.562 0.252 17893 38 1 . 1 1 9 9 ILE CA C 9 62.856 62.856 65.254 -2.398 17893 39 1 . 1 1 9 9 ILE CB C 9 36.462 36.462 37.555 -1.092 17893 40 1 . 1 1 9 9 ILE H H 9 8.226 8.226 8.683 -0.457 17893 41 1 . 1 1 10 10 ARG N N 10 120.162 120.162 120.045 0.116 17893 42 1 . 1 1 10 10 ARG HA H 10 3.901 3.901 3.870 0.031 17893 43 1 . 1 1 10 10 ARG CA C 10 60.727 60.727 60.037 0.690 17893 44 1 . 1 1 10 10 ARG CB C 10 28.499 28.499 30.123 -1.624 17893 45 1 . 1 1 10 10 ARG H H 10 9.260 9.260 8.728 0.532 17893 46 1 . 1 1 11 11 GLU N N 11 115.948 115.948 118.193 -2.245 17893 47 1 . 1 1 11 11 GLU HA H 11 4.173 4.173 4.123 0.050 17893 48 1 . 1 1 11 11 GLU CA C 11 59.386 59.386 58.912 0.474 17893 49 1 . 1 1 11 11 GLU CB C 11 28.914 28.914 29.076 -0.162 17893 50 1 . 1 1 11 11 GLU H H 11 8.701 8.701 8.132 0.569 17893 51 1 . 1 1 12 12 LYS N N 12 122.900 122.900 119.562 3.338 17893 52 1 . 1 1 12 12 LYS HA H 12 4.222 4.222 4.057 0.165 17893 53 1 . 1 1 12 12 LYS CA C 12 59.416 59.416 59.099 0.317 17893 54 1 . 1 1 12 12 LYS CB C 12 31.998 31.998 32.619 -0.621 17893 55 1 . 1 1 12 12 LYS H H 12 8.254 8.254 7.845 0.409 17893 56 1 . 1 1 13 13 LYS N N 13 116.385 116.385 114.922 1.463 17893 57 1 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.362 -0.065 17893 58 1 . 1 1 13 13 LYS CA C 13 55.031 55.031 55.644 -0.613 17893 59 1 . 1 1 13 13 LYS CB C 13 31.549 31.549 32.773 -1.224 17893 60 1 . 1 1 13 13 LYS H H 13 7.809 7.809 7.663 0.146 17893 61 1 . 1 1 14 14 LYS N N 14 115.317 115.317 116.632 -1.315 17893 62 1 . 1 1 14 14 LYS HA H 14 3.982 3.982 3.928 0.054 17893 63 1 . 1 1 14 14 LYS CA C 14 56.888 56.888 56.798 0.090 17893 64 1 . 1 1 14 14 LYS CB C 14 28.286 28.286 29.716 -1.430 17893 65 1 . 1 1 14 14 LYS H H 14 8.069 8.069 7.799 0.270 17893 66 1 . 1 1 15 15 ILE N N 15 118.431 118.431 120.696 -2.265 17893 67 1 . 1 1 15 15 ILE HA H 15 4.623 4.623 4.169 0.454 17893 68 1 . 1 1 15 15 ILE CA C 15 59.199 59.199 59.837 -0.638 17893 69 1 . 1 1 15 15 ILE CB C 15 40.896 40.896 38.707 2.189 17893 70 1 . 1 1 15 15 ILE H H 15 7.569 7.569 8.188 -0.619 17893 71 1 . 1 1 16 16 SER N N 16 125.034 125.034 122.305 2.729 17893 72 1 . 1 1 16 16 SER HA H 16 4.585 4.585 4.590 -0.005 17893 73 1 . 1 1 16 16 SER CA C 16 57.004 57.004 57.728 -0.724 17893 74 1 . 1 1 16 16 SER CB C 16 64.914 64.914 64.537 0.377 17893 75 1 . 1 1 16 16 SER H H 16 9.440 9.440 8.937 0.503 17893 76 1 . 1 1 17 17 GLN N N 17 120.228 120.228 123.612 -3.384 17893 77 1 . 1 1 17 17 GLN HA H 17 3.787 3.787 4.005 -0.218 17893 78 1 . 1 1 17 17 GLN CA C 17 61.516 61.516 59.751 1.765 17893 79 1 . 1 1 17 17 GLN CB C 17 29.051 29.051 28.392 0.659 17893 80 1 . 1 1 17 17 GLN H H 17 9.527 9.527 8.981 0.546 17893 81 1 . 1 1 18 18 SER N N 18 112.979 112.979 115.330 -2.351 17893 82 1 . 1 1 18 18 SER HA H 18 4.531 4.531 4.055 0.476 17893 83 1 . 1 1 18 18 SER CA C 18 62.872 62.872 61.960 0.912 17893 84 1 . 1 1 18 18 SER CB C 18 65.338 65.338 62.455 2.883 17893 85 1 . 1 1 18 18 SER H H 18 8.949 8.949 8.448 0.502 17893 86 1 . 1 1 19 19 GLU N N 19 124.147 124.147 122.087 2.060 17893 87 1 . 1 1 19 19 GLU HA H 19 4.107 4.107 4.087 0.020 17893 88 1 . 1 1 19 19 GLU CA C 19 58.613 58.613 58.811 -0.198 17893 89 1 . 1 1 19 19 GLU CB C 19 29.539 29.539 29.113 0.426 17893 90 1 . 1 1 19 19 GLU H H 19 8.331 8.331 8.062 0.269 17893 91 1 . 1 1 20 20 LEU N N 20 119.943 119.943 121.697 -1.754 17893 92 1 . 1 1 20 20 LEU HA H 20 4.154 4.154 3.939 0.215 17893 93 1 . 1 1 20 20 LEU CA C 20 57.574 57.574 57.782 -0.208 17893 94 1 . 1 1 20 20 LEU CB C 20 41.005 41.005 41.445 -0.440 17893 95 1 . 1 1 20 20 LEU H H 20 8.314 8.314 8.147 0.167 17893 96 1 . 1 1 21 21 ALA N N 21 119.877 119.877 121.678 -1.801 17893 97 1 . 1 1 21 21 ALA HA H 21 3.724 3.724 3.930 -0.206 17893 98 1 . 1 1 21 21 ALA CA C 21 55.454 55.454 55.227 0.227 17893 99 1 . 1 1 21 21 ALA CB C 21 16.861 16.861 18.037 -1.176 17893 100 1 . 1 1 21 21 ALA H H 21 8.588 8.588 8.869 -0.281 17893 101 1 . 1 1 22 22 ALA N N 22 117.330 117.330 121.773 -4.443 17893 102 1 . 1 1 22 22 ALA HA H 22 4.264 4.264 3.987 0.277 17893 103 1 . 1 1 22 22 ALA CA C 22 54.609 54.609 54.749 -0.140 17893 104 1 . 1 1 22 22 ALA CB C 22 17.656 17.656 18.490 -0.834 17893 105 1 . 1 1 22 22 ALA H H 22 7.813 7.813 7.998 -0.185 17893 106 1 . 1 1 23 23 LEU N N 23 118.586 118.586 118.469 0.117 17893 107 1 . 1 1 23 23 LEU HA H 23 3.961 3.961 3.638 0.323 17893 108 1 . 1 1 23 23 LEU CA C 23 57.100 57.100 57.186 -0.086 17893 109 1 . 1 1 23 23 LEU CB C 23 41.424 41.424 41.275 0.149 17893 110 1 . 1 1 23 23 LEU H H 23 7.538 7.538 8.249 -0.711 17893 111 1 . 1 1 24 24 LEU N N 24 114.488 114.488 115.952 -1.464 17893 112 1 . 1 1 24 24 LEU HA H 24 4.264 4.264 4.318 -0.054 17893 113 1 . 1 1 24 24 LEU CA C 24 54.794 54.794 55.535 -0.741 17893 114 1 . 1 1 24 24 LEU CB C 24 43.433 43.433 42.003 1.430 17893 115 1 . 1 1 24 24 LEU H H 24 7.449 7.449 8.083 -0.634 17893 116 1 . 1 1 25 25 GLU N N 25 114.895 114.895 115.214 -0.319 17893 117 1 . 1 1 25 25 GLU HA H 25 3.966 3.966 4.018 -0.052 17893 118 1 . 1 1 25 25 GLU CA C 25 57.148 57.148 57.378 -0.230 17893 119 1 . 1 1 25 25 GLU CB C 25 26.993 26.993 27.261 -0.268 17893 120 1 . 1 1 25 25 GLU H H 25 8.029 8.029 7.697 0.332 17893 121 1 . 1 1 26 26 VAL N N 26 109.738 109.738 112.166 -2.428 17893 122 1 . 1 1 26 26 VAL HA H 26 4.890 4.890 4.668 0.222 17893 123 1 . 1 1 26 26 VAL CA C 26 58.281 58.281 59.326 -1.045 17893 124 1 . 1 1 26 26 VAL CB C 26 35.295 35.295 35.010 0.285 17893 125 1 . 1 1 26 26 VAL H H 26 7.989 7.989 7.995 -0.006 17893 126 1 . 1 1 27 27 SER N N 27 114.381 114.381 115.926 -1.545 17893 127 1 . 1 1 27 27 SER HA H 27 4.644 4.644 4.497 0.147 17893 128 1 . 1 1 27 27 SER CA C 27 56.445 56.445 58.073 -1.628 17893 129 1 . 1 1 27 27 SER CB C 27 62.251 62.251 64.261 -2.010 17893 130 1 . 1 1 27 27 SER H H 27 8.618 8.618 8.469 0.149 17893 131 1 . 1 1 28 28 ARG N N 28 115.323 115.323 124.511 -9.188 17893 132 1 . 1 1 28 28 ARG HA H 28 3.748 3.748 3.973 -0.225 17893 133 1 . 1 1 28 28 ARG CA C 28 59.919 59.919 60.213 -0.295 17893 134 1 . 1 1 28 28 ARG CB C 28 29.050 29.050 29.996 -0.946 17893 135 1 . 1 1 28 28 ARG H H 28 8.242 8.242 8.926 -0.684 17893 136 1 . 1 1 29 29 GLN N N 29 117.343 117.343 116.620 0.723 17893 137 1 . 1 1 29 29 GLN HA H 29 4.174 4.174 4.090 0.084 17893 138 1 . 1 1 29 29 GLN CA C 29 59.085 59.085 58.972 0.113 17893 139 1 . 1 1 29 29 GLN CB C 29 27.568 27.568 27.638 -0.070 17893 140 1 . 1 1 29 29 GLN H H 29 8.827 8.827 8.725 0.102 17893 141 1 . 1 1 30 30 THR N N 30 119.996 119.996 117.264 2.731 17893 142 1 . 1 1 30 30 THR HA H 30 4.434 4.434 4.266 0.168 17893 143 1 . 1 1 30 30 THR CA C 30 67.621 67.621 65.822 1.799 17893 144 1 . 1 1 30 30 THR CB C 30 66.513 66.513 68.457 -1.944 17893 145 1 . 1 1 30 30 THR H H 30 8.132 8.132 7.708 0.424 17893 146 1 . 1 1 31 31 ILE N N 31 118.828 118.828 122.507 -3.678 17893 147 1 . 1 1 31 31 ILE HA H 31 3.786 3.786 3.790 -0.004 17893 148 1 . 1 1 31 31 ILE CA C 31 61.029 61.029 63.532 -2.503 17893 149 1 . 1 1 31 31 ILE CB C 31 35.077 35.077 36.693 -1.616 17893 150 1 . 1 1 31 31 ILE H H 31 7.163 7.163 7.524 -0.361 17893 151 1 . 1 1 32 32 ASN N N 32 118.098 118.098 118.988 -0.890 17893 152 1 . 1 1 32 32 ASN HA H 32 4.355 4.355 4.458 -0.103 17893 153 1 . 1 1 32 32 ASN CA C 32 57.254 57.254 56.771 0.483 17893 154 1 . 1 1 32 32 ASN CB C 32 39.248 39.248 38.356 0.892 17893 155 1 . 1 1 32 32 ASN H H 32 8.656 8.656 8.875 -0.219 17893 156 1 . 1 1 33 33 GLY N N 33 124.952 124.952 108.577 16.375 17893 157 1 . 1 1 33 33 GLY CA C 33 47.140 47.140 46.791 0.348 17893 158 1 . 1 1 33 33 GLY H H 33 8.643 8.643 8.579 0.064 17893 159 1 . 1 1 34 34 ILE N N 34 122.233 122.233 122.666 -0.433 17893 160 1 . 1 1 34 34 ILE HA H 34 4.304 4.304 3.948 0.356 17893 161 1 . 1 1 34 34 ILE CA C 34 64.804 64.804 64.452 0.352 17893 162 1 . 1 1 34 34 ILE CB C 34 38.286 38.286 38.212 0.074 17893 163 1 . 1 1 34 34 ILE H H 34 8.203 8.203 7.600 0.603 17893 164 1 . 1 1 35 35 GLU N N 35 120.686 120.686 118.236 2.450 17893 165 1 . 1 1 35 35 GLU HA H 35 4.214 4.214 4.061 0.153 17893 166 1 . 1 1 35 35 GLU CA C 35 59.692 59.692 58.770 0.922 17893 167 1 . 1 1 35 35 GLU CB C 35 28.852 28.852 29.550 -0.698 17893 168 1 . 1 1 35 35 GLU H H 35 8.575 8.575 8.337 0.238 17893 169 1 . 1 1 36 36 LYS N N 36 116.029 116.029 118.097 -2.068 17893 170 1 . 1 1 36 36 LYS HA H 36 4.521 4.521 4.174 0.347 17893 171 1 . 1 1 36 36 LYS CA C 36 55.507 55.507 57.319 -1.812 17893 172 1 . 1 1 36 36 LYS CB C 36 31.939 31.939 33.117 -1.178 17893 173 1 . 1 1 36 36 LYS H H 36 8.107 8.107 8.036 0.071 17893 174 1 . 1 1 37 37 ASN N N 37 114.692 114.692 112.795 1.897 17893 175 1 . 1 1 37 37 ASN HA H 37 4.749 4.749 4.602 0.147 17893 176 1 . 1 1 37 37 ASN CA C 37 54.788 54.788 53.572 1.216 17893 177 1 . 1 1 37 37 ASN CB C 37 36.949 36.949 37.896 -0.947 17893 178 1 . 1 1 37 37 ASN H H 37 8.240 8.240 8.187 0.053 17893 179 1 . 1 1 38 38 LYS N N 38 115.098 115.098 120.338 -5.240 17893 180 1 . 1 1 38 38 LYS HA H 38 4.436 4.436 4.116 0.320 17893 181 1 . 1 1 38 38 LYS CA C 38 56.178 56.178 58.549 -2.371 17893 182 1 . 1 1 38 38 LYS CB C 38 33.236 33.236 33.175 0.061 17893 183 1 . 1 1 38 38 LYS H H 38 8.727 8.727 8.261 0.465 17893 184 1 . 1 1 39 39 TYR N N 39 117.011 117.011 113.059 3.952 17893 185 1 . 1 1 39 39 TYR HA H 39 4.629 4.629 4.774 -0.145 17893 186 1 . 1 1 39 39 TYR CA C 39 55.559 55.559 55.671 -0.112 17893 187 1 . 1 1 39 39 TYR CB C 39 39.903 39.903 39.111 0.792 17893 188 1 . 1 1 39 39 TYR H H 39 7.087 7.087 7.170 -0.083 17893 189 1 . 1 1 40 40 ASN N N 40 123.595 123.595 120.546 3.049 17893 190 1 . 1 1 40 40 ASN HA H 40 5.253 5.253 4.882 0.371 17893 191 1 . 1 1 40 40 ASN CA C 40 49.772 49.772 51.345 -1.573 17893 192 1 . 1 1 40 40 ASN CB C 40 38.476 38.476 39.179 -0.703 17893 193 1 . 1 1 40 40 ASN H H 40 8.842 8.842 8.518 0.324 17893 194 1 . 1 1 41 41 PRO HA H 41 3.809 3.809 4.536 -0.727 17893 195 1 . 1 1 41 41 PRO CA C 41 62.529 62.529 62.583 -0.054 17893 196 1 . 1 1 41 41 PRO CB C 41 31.561 31.561 32.225 -0.664 17893 197 1 . 1 1 42 42 SER N N 42 125.580 125.580 115.607 9.973 17893 198 1 . 1 1 42 42 SER HA H 42 4.581 4.581 4.278 0.303 17893 199 1 . 1 1 42 42 SER CA C 42 57.380 57.380 57.944 -0.564 17893 200 1 . 1 1 42 42 SER CB C 42 64.562 64.562 63.978 0.584 17893 201 1 . 1 1 42 42 SER H H 42 8.033 8.033 8.183 -0.150 17893 202 1 . 1 1 43 43 LEU N N 43 120.759 120.759 124.460 -3.701 17893 203 1 . 1 1 43 43 LEU HA H 43 3.914 3.914 4.011 -0.097 17893 204 1 . 1 1 43 43 LEU CA C 43 58.345 58.345 58.443 -0.098 17893 205 1 . 1 1 43 43 LEU CB C 43 40.856 40.856 41.433 -0.577 17893 206 1 . 1 1 43 43 LEU H H 43 9.289 9.289 8.729 0.560 17893 207 1 . 1 1 44 44 GLN N N 44 115.948 115.948 118.676 -2.728 17893 208 1 . 1 1 44 44 GLN HA H 44 3.727 3.727 4.081 -0.354 17893 209 1 . 1 1 44 44 GLN CA C 44 60.136 60.136 59.264 0.872 17893 210 1 . 1 1 44 44 GLN CB C 44 28.250 28.250 28.161 0.089 17893 211 1 . 1 1 44 44 GLN H H 44 8.906 8.906 8.605 0.301 17893 212 1 . 1 1 45 45 LEU N N 45 119.419 119.419 119.818 -0.399 17893 213 1 . 1 1 45 45 LEU HA H 45 3.925 3.925 4.010 -0.085 17893 214 1 . 1 1 45 45 LEU CA C 45 54.604 54.604 57.444 -2.840 17893 215 1 . 1 1 45 45 LEU CB C 45 40.627 40.627 41.482 -0.855 17893 216 1 . 1 1 45 45 LEU H H 45 8.078 8.078 7.991 0.087 17893 217 1 . 1 1 46 46 ALA N N 46 120.544 120.544 122.388 -1.844 17893 218 1 . 1 1 46 46 ALA HA H 46 4.048 4.048 3.969 0.079 17893 219 1 . 1 1 46 46 ALA CA C 46 55.744 55.744 55.314 0.430 17893 220 1 . 1 1 46 46 ALA CB C 46 19.733 19.733 18.015 1.718 17893 221 1 . 1 1 46 46 ALA H H 46 8.518 8.518 8.803 -0.285 17893 222 1 . 1 1 47 47 LEU N N 47 116.461 116.461 118.824 -2.363 17893 223 1 . 1 1 47 47 LEU HA H 47 4.215 4.215 3.863 0.352 17893 224 1 . 1 1 47 47 LEU CA C 47 57.501 57.501 58.091 -0.590 17893 225 1 . 1 1 47 47 LEU CB C 47 41.086 41.086 41.606 -0.520 17893 226 1 . 1 1 47 47 LEU H H 47 8.676 8.676 8.504 0.172 17893 227 1 . 1 1 48 48 LYS N N 48 120.958 120.958 120.075 0.883 17893 228 1 . 1 1 48 48 LYS HA H 48 3.600 3.600 3.903 -0.303 17893 229 1 . 1 1 48 48 LYS CA C 48 59.929 59.929 59.901 0.028 17893 230 1 . 1 1 48 48 LYS CB C 48 32.268 32.268 32.368 -0.100 17893 231 1 . 1 1 48 48 LYS H H 48 8.036 8.036 8.135 -0.099 17893 232 1 . 1 1 49 49 ILE N N 49 120.407 120.407 120.393 0.014 17893 233 1 . 1 1 49 49 ILE HA H 49 3.599 3.599 3.871 -0.272 17893 234 1 . 1 1 49 49 ILE CA C 49 67.202 67.202 65.692 1.510 17893 235 1 . 1 1 49 49 ILE CB C 49 37.653 37.653 37.952 -0.299 17893 236 1 . 1 1 49 49 ILE H H 49 8.779 8.779 8.510 0.269 17893 237 1 . 1 1 50 50 ALA N N 50 120.480 120.480 123.425 -2.945 17893 238 1 . 1 1 50 50 ALA HA H 50 4.079 4.079 4.103 -0.024 17893 239 1 . 1 1 50 50 ALA CA C 50 55.623 55.623 55.230 0.393 17893 240 1 . 1 1 50 50 ALA CB C 50 18.005 18.005 18.291 -0.286 17893 241 1 . 1 1 50 50 ALA H H 50 8.173 8.173 8.525 -0.352 17893 242 1 . 1 1 51 51 TYR N N 51 117.118 117.118 120.274 -3.156 17893 243 1 . 1 1 51 51 TYR HA H 51 4.365 4.365 3.990 0.375 17893 244 1 . 1 1 51 51 TYR CA C 51 61.433 61.433 62.111 -0.678 17893 245 1 . 1 1 51 51 TYR CB C 51 38.223 38.223 38.408 -0.185 17893 246 1 . 1 1 51 51 TYR H H 51 8.169 8.169 8.398 -0.229 17893 247 1 . 1 1 52 52 TYR N N 52 118.548 118.548 116.320 2.228 17893 248 1 . 1 1 52 52 TYR HA H 52 4.321 4.321 4.119 0.202 17893 249 1 . 1 1 52 52 TYR CA C 52 62.969 62.969 61.372 1.597 17893 250 1 . 1 1 52 52 TYR CB C 52 37.478 37.478 38.354 -0.876 17893 251 1 . 1 1 52 52 TYR H H 52 9.062 9.062 8.075 0.987 17893 252 1 . 1 1 53 53 LEU N N 53 115.380 115.380 116.532 -1.152 17893 253 1 . 1 1 53 53 LEU HA H 53 4.537 4.537 4.064 0.473 17893 254 1 . 1 1 53 53 LEU CA C 53 54.144 54.144 56.502 -2.357 17893 255 1 . 1 1 53 53 LEU CB C 53 40.096 40.096 42.198 -2.102 17893 256 1 . 1 1 53 53 LEU H H 53 8.394 8.394 8.538 -0.144 17893 257 1 . 1 1 54 54 ASN N N 54 122.105 122.105 114.554 7.551 17893 258 1 . 1 1 54 54 ASN HA H 54 4.456 4.456 4.338 0.118 17893 259 1 . 1 1 54 54 ASN CA C 54 53.791 53.791 54.009 -0.218 17893 260 1 . 1 1 54 54 ASN CB C 54 37.758 37.758 37.374 0.384 17893 261 1 . 1 1 54 54 ASN H H 54 8.091 8.091 8.165 -0.074 17893 262 1 . 1 1 55 55 THR N N 55 114.964 114.964 115.025 -0.061 17893 263 1 . 1 1 55 55 THR HA H 55 4.947 4.947 4.754 0.192 17893 264 1 . 1 1 55 55 THR CA C 55 60.062 60.062 59.965 0.097 17893 265 1 . 1 1 55 55 THR CB C 55 74.945 74.945 70.936 4.009 17893 266 1 . 1 1 55 55 THR H H 55 8.248 8.248 7.947 0.301 17893 267 1 . 1 1 56 56 PRO HA H 56 4.610 4.610 4.576 0.034 17893 268 1 . 1 1 56 56 PRO CA C 56 62.842 62.842 62.653 0.189 17893 269 1 . 1 1 56 56 PRO CB C 56 31.946 31.946 32.586 -0.640 17893 270 1 . 1 1 57 57 LEU N N 57 127.597 127.597 125.258 2.339 17893 271 1 . 1 1 57 57 LEU HA H 57 4.071 4.071 4.094 -0.023 17893 272 1 . 1 1 57 57 LEU CA C 57 59.722 59.722 58.785 0.937 17893 273 1 . 1 1 57 57 LEU CB C 57 41.493 41.493 42.118 -0.625 17893 274 1 . 1 1 57 57 LEU H H 57 9.958 9.958 8.616 1.342 17893 275 1 . 1 1 58 58 GLU N N 58 123.260 123.260 118.466 4.794 17893 276 1 . 1 1 58 58 GLU HA H 58 4.886 4.886 4.335 0.551 17893 277 1 . 1 1 58 58 GLU CA C 58 58.517 58.517 59.046 -0.529 17893 278 1 . 1 1 58 58 GLU CB C 58 29.058 29.058 29.089 -0.031 17893 279 1 . 1 1 58 58 GLU H H 58 9.353 9.353 8.730 0.623 17893 280 1 . 1 1 59 59 ASP N N 59 117.681 117.681 118.259 -0.578 17893 281 1 . 1 1 59 59 ASP HA H 59 4.654 4.654 4.450 0.204 17893 282 1 . 1 1 59 59 ASP CA C 59 55.623 55.623 56.468 -0.845 17893 283 1 . 1 1 59 59 ASP CB C 59 39.991 39.991 40.990 -0.999 17893 284 1 . 1 1 59 59 ASP H H 59 8.012 8.012 7.848 0.164 17893 285 1 . 1 1 60 60 ILE N N 60 119.519 119.519 116.845 2.674 17893 286 1 . 1 1 60 60 ILE HA H 60 3.543 3.543 3.765 -0.222 17893 287 1 . 1 1 60 60 ILE CA C 60 63.906 63.906 63.639 0.267 17893 288 1 . 1 1 60 60 ILE CB C 60 39.416 39.416 39.018 0.398 17893 289 1 . 1 1 60 60 ILE H H 60 8.210 8.210 7.223 0.987 17893 290 1 . 1 1 61 61 PHE N N 61 116.030 116.030 118.183 -2.153 17893 291 1 . 1 1 61 61 PHE HA H 61 5.446 5.446 5.627 -0.181 17893 292 1 . 1 1 61 61 PHE CA C 61 55.821 55.821 55.772 0.049 17893 293 1 . 1 1 61 61 PHE CB C 61 41.965 41.965 40.875 1.090 17893 294 1 . 1 1 61 61 PHE H H 61 8.530 8.530 8.722 -0.192 17893 295 1 . 1 1 62 62 GLN N N 62 116.829 116.829 120.973 -4.144 17893 296 1 . 1 1 62 62 GLN HA H 62 5.057 5.057 4.931 0.126 17893 297 1 . 1 1 62 62 GLN CA C 62 53.989 53.989 53.705 0.284 17893 298 1 . 1 1 62 62 GLN CB C 62 31.828 31.828 31.762 0.066 17893 299 1 . 1 1 62 62 GLN H H 62 8.737 8.737 9.035 -0.298 17893 300 1 . 1 1 63 63 TRP N N 63 125.623 125.623 125.385 0.238 17893 301 1 . 1 1 63 63 TRP HA H 63 5.207 5.207 5.227 -0.020 17893 302 1 . 1 1 63 63 TRP CA C 63 56.531 56.531 56.544 -0.013 17893 303 1 . 1 1 63 63 TRP CB C 63 30.704 30.704 30.738 -0.034 17893 304 1 . 1 1 63 63 TRP H H 63 9.464 9.464 8.833 0.631 17893 305 1 . 1 1 64 64 GLN N N 64 127.029 127.029 123.317 3.712 17893 306 1 . 1 1 64 64 GLN HA H 64 4.198 4.198 4.228 -0.030 17893 307 1 . 1 1 64 64 GLN CA C 64 51.502 51.502 52.138 -0.636 17893 308 1 . 1 1 64 64 GLN CB C 64 30.673 30.673 29.589 1.084 17893 309 1 . 1 1 64 64 GLN H H 64 7.977 7.977 8.575 -0.598 17893 310 1 . 1 1 65 65 PRO HA H 65 4.680 4.680 4.285 0.395 17893 311 1 . 1 1 65 65 PRO CA C 65 61.655 61.655 63.529 -1.874 17893 312 1 . 1 1 65 65 PRO CB C 65 31.500 31.500 32.188 -0.688 17893 stop_ save_