data_17635 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17635 _Entry.PDB_ID 2LCW 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 17635 _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 GLN N N 2 121.692 121.692 120.123 1.569 17635 2 1 1 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.129 0.137 17635 3 1 1 . 1 1 2 2 GLN C C 2 175.248 175.248 174.696 0.552 17635 4 1 1 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.078 -0.082 17635 5 1 1 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.177 1.462 17635 6 1 1 . 1 1 2 2 GLN H H 2 8.621 8.621 8.360 0.261 17635 7 1 1 . 1 1 3 3 ASP N N 3 121.801 121.801 119.819 1.982 17635 8 1 1 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.271 0.297 17635 9 1 1 . 1 1 3 3 ASP C C 3 174.336 174.336 174.794 -0.458 17635 10 1 1 . 1 1 3 3 ASP CA C 3 54.062 54.062 55.094 -1.032 17635 11 1 1 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.377 0.694 17635 12 1 1 . 1 1 3 3 ASP H H 3 8.436 8.436 8.622 -0.186 17635 13 1 1 . 1 1 4 4 ASN N N 4 120.292 120.292 119.156 1.136 17635 14 1 1 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.738 -0.101 17635 15 1 1 . 1 1 4 4 ASN C C 4 174.415 174.415 174.367 0.048 17635 16 1 1 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.784 1.077 17635 17 1 1 . 1 1 4 4 ASN CB C 4 38.534 38.534 39.450 -0.916 17635 18 1 1 . 1 1 4 4 ASN H H 4 8.528 8.528 8.118 0.410 17635 19 1 1 . 1 1 5 5 SER N N 5 117.091 117.091 117.737 -0.646 17635 20 1 1 . 1 1 5 5 SER HA H 5 4.163 4.163 4.514 -0.351 17635 21 1 1 . 1 1 5 5 SER C C 5 176.370 176.370 173.303 3.067 17635 22 1 1 . 1 1 5 5 SER CA C 5 60.846 60.846 58.255 2.591 17635 23 1 1 . 1 1 5 5 SER CB C 5 63.136 63.136 63.748 -0.612 17635 24 1 1 . 1 1 5 5 SER H H 5 8.470 8.470 8.598 -0.128 17635 25 1 1 . 1 1 6 6 ASP N N 6 119.436 119.436 120.934 -1.498 17635 26 1 1 . 1 1 6 6 ASP HA H 6 4.695 4.695 3.794 0.901 17635 27 1 1 . 1 1 6 6 ASP C C 6 175.048 175.048 174.885 0.163 17635 28 1 1 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.128 -0.034 17635 29 1 1 . 1 1 6 6 ASP CB C 6 40.935 40.935 39.552 1.383 17635 30 1 1 . 1 1 6 6 ASP H H 6 8.218 8.218 8.050 0.168 17635 31 1 1 . 1 1 7 7 ASN N N 7 119.696 119.696 116.892 2.804 17635 32 1 1 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.582 0.046 17635 33 1 1 . 1 1 7 7 ASN C C 7 176.539 176.539 176.311 0.228 17635 34 1 1 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.670 -0.512 17635 35 1 1 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.215 0.644 17635 36 1 1 . 1 1 7 7 ASN H H 7 7.734 7.734 7.471 0.263 17635 37 1 1 . 1 1 8 8 ASN N N 8 119.436 119.436 117.996 1.440 17635 38 1 1 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.515 0.353 17635 39 1 1 . 1 1 8 8 ASN C C 8 175.327 175.327 175.094 0.233 17635 40 1 1 . 1 1 8 8 ASN CA C 8 53.204 53.204 55.074 -1.870 17635 41 1 1 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.253 0.242 17635 42 1 1 . 1 1 8 8 ASN H H 8 8.350 8.350 8.870 -0.520 17635 43 1 1 . 1 1 9 9 THR N N 9 118.650 118.650 115.210 3.440 17635 44 1 1 . 1 1 9 9 THR HA H 9 5.557 5.557 4.419 1.138 17635 45 1 1 . 1 1 9 9 THR C C 9 177.117 177.117 174.339 2.778 17635 46 1 1 . 1 1 9 9 THR CA C 9 62.314 62.314 63.333 -1.019 17635 47 1 1 . 1 1 9 9 THR CB C 9 71.225 71.225 69.247 1.978 17635 48 1 1 . 1 1 9 9 THR H H 9 8.428 8.428 7.527 0.901 17635 49 1 1 . 1 1 10 10 ILE N N 10 118.556 118.556 120.346 -1.790 17635 50 1 1 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.927 0.238 17635 51 1 1 . 1 1 10 10 ILE C C 10 176.837 176.837 174.523 2.314 17635 52 1 1 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.225 1.073 17635 53 1 1 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.090 -1.210 17635 54 1 1 . 1 1 10 10 ILE H H 10 8.770 8.770 8.734 0.036 17635 55 1 1 . 1 1 11 11 PHE N N 11 123.798 123.798 119.846 3.952 17635 56 1 1 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.745 0.675 17635 57 1 1 . 1 1 11 11 PHE C C 11 177.066 177.066 174.512 2.554 17635 58 1 1 . 1 1 11 11 PHE CA C 11 55.362 55.362 56.914 -1.552 17635 59 1 1 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.752 0.116 17635 60 1 1 . 1 1 11 11 PHE H H 11 9.548 9.548 8.034 1.514 17635 61 1 1 . 1 1 12 12 VAL N N 12 127.993 127.993 125.230 2.763 17635 62 1 1 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.624 0.334 17635 63 1 1 . 1 1 12 12 VAL C C 12 176.965 176.965 174.684 2.281 17635 64 1 1 . 1 1 12 12 VAL CA C 12 59.835 59.835 60.076 -0.241 17635 65 1 1 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.462 2.338 17635 66 1 1 . 1 1 12 12 VAL H H 12 8.940 8.940 8.783 0.157 17635 67 1 1 . 1 1 13 13 GLN N N 13 122.289 122.289 126.691 -4.402 17635 68 1 1 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.595 0.184 17635 69 1 1 . 1 1 13 13 GLN C C 13 175.631 175.631 175.552 0.079 17635 70 1 1 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.957 -0.847 17635 71 1 1 . 1 1 13 13 GLN CB C 13 34.132 34.132 32.423 1.709 17635 72 1 1 . 1 1 13 13 GLN H H 13 8.747 8.747 8.238 0.509 17635 73 1 1 . 1 1 14 14 GLY N N 14 109.212 109.212 114.109 -4.897 17635 74 1 1 . 1 1 14 14 GLY C C 14 175.436 175.436 172.869 2.567 17635 75 1 1 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.263 0.167 17635 76 1 1 . 1 1 14 14 GLY H H 14 8.236 8.236 8.776 -0.540 17635 77 1 1 . 1 1 15 15 LEU N N 15 117.824 117.824 121.199 -3.375 17635 78 1 1 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.209 -0.503 17635 79 1 1 . 1 1 15 15 LEU C C 15 174.111 174.111 176.509 -2.398 17635 80 1 1 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.286 0.431 17635 81 1 1 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.029 1.404 17635 82 1 1 . 1 1 15 15 LEU H H 15 8.442 8.442 7.534 0.908 17635 83 1 1 . 1 1 16 16 GLY N N 16 105.063 105.063 104.077 0.986 17635 84 1 1 . 1 1 16 16 GLY C C 16 177.771 177.771 174.121 3.650 17635 85 1 1 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.352 -0.258 17635 86 1 1 . 1 1 16 16 GLY H H 16 8.006 8.006 7.751 0.255 17635 87 1 1 . 1 1 17 17 GLU N N 17 113.781 113.781 118.344 -4.563 17635 88 1 1 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.740 0.379 17635 89 1 1 . 1 1 17 17 GLU C C 17 173.937 173.937 175.644 -1.707 17635 90 1 1 . 1 1 17 17 GLU CA C 17 57.281 57.281 57.259 0.022 17635 91 1 1 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.229 1.207 17635 92 1 1 . 1 1 17 17 GLU H H 17 8.134 8.134 8.702 -0.568 17635 93 1 1 . 1 1 18 18 ASN N N 18 116.660 116.660 112.637 4.023 17635 94 1 1 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.684 0.257 17635 95 1 1 . 1 1 18 18 ASN C C 18 175.900 175.900 174.540 1.360 17635 96 1 1 . 1 1 18 18 ASN CA C 18 52.478 52.478 53.187 -0.709 17635 97 1 1 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.888 -1.403 17635 98 1 1 . 1 1 18 18 ASN H H 18 8.407 8.407 8.036 0.371 17635 99 1 1 . 1 1 19 19 VAL N N 19 118.323 118.323 121.749 -3.426 17635 100 1 1 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.657 0.495 17635 101 1 1 . 1 1 19 19 VAL C C 19 177.655 177.655 174.773 2.882 17635 102 1 1 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.302 -1.425 17635 103 1 1 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.659 1.854 17635 104 1 1 . 1 1 19 19 VAL H H 19 6.855 6.855 7.847 -0.992 17635 105 1 1 . 1 1 20 20 THR N N 20 111.636 111.636 119.286 -7.650 17635 106 1 1 . 1 1 20 20 THR HA H 20 4.719 4.719 4.603 0.116 17635 107 1 1 . 1 1 20 20 THR C C 20 175.266 175.266 174.777 0.489 17635 108 1 1 . 1 1 20 20 THR CA C 20 58.698 58.698 59.720 -1.022 17635 109 1 1 . 1 1 20 20 THR CB C 20 72.948 72.948 72.078 0.870 17635 110 1 1 . 1 1 20 20 THR H H 20 7.328 7.328 8.001 -0.673 17635 111 1 1 . 1 1 21 21 ILE N N 21 122.147 122.147 121.669 0.478 17635 112 1 1 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.861 -0.343 17635 113 1 1 . 1 1 21 21 ILE C C 21 173.198 173.198 177.919 -4.721 17635 114 1 1 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.800 0.972 17635 115 1 1 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.348 0.235 17635 116 1 1 . 1 1 21 21 ILE H H 21 9.074 9.074 8.601 0.473 17635 117 1 1 . 1 1 22 22 GLU N N 22 118.154 118.154 120.322 -2.168 17635 118 1 1 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.110 -0.124 17635 119 1 1 . 1 1 22 22 GLU C C 22 171.799 171.799 179.058 -7.259 17635 120 1 1 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.870 0.743 17635 121 1 1 . 1 1 22 22 GLU CB C 22 28.791 28.791 29.280 -0.489 17635 122 1 1 . 1 1 22 22 GLU H H 22 8.814 8.814 8.535 0.279 17635 123 1 1 . 1 1 23 23 SER N N 23 115.921 115.921 114.641 1.280 17635 124 1 1 . 1 1 23 23 SER HA H 23 4.384 4.384 4.317 0.067 17635 125 1 1 . 1 1 23 23 SER C C 23 172.447 172.447 176.833 -4.386 17635 126 1 1 . 1 1 23 23 SER CA C 23 61.239 61.239 61.327 -0.088 17635 127 1 1 . 1 1 23 23 SER CB C 23 62.838 62.838 62.924 -0.086 17635 128 1 1 . 1 1 23 23 SER H H 23 8.236 8.236 8.271 -0.035 17635 129 1 1 . 1 1 24 24 VAL N N 24 124.867 124.867 121.568 3.299 17635 130 1 1 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.310 -0.562 17635 131 1 1 . 1 1 24 24 VAL C C 24 173.016 173.016 177.992 -4.976 17635 132 1 1 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.416 0.838 17635 133 1 1 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.815 -0.282 17635 134 1 1 . 1 1 24 24 VAL H H 24 7.973 7.973 7.964 0.009 17635 135 1 1 . 1 1 25 25 ALA N N 25 123.198 123.198 121.691 1.507 17635 136 1 1 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.154 -0.255 17635 137 1 1 . 1 1 25 25 ALA C C 25 171.061 171.061 178.486 -7.425 17635 138 1 1 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.907 0.787 17635 139 1 1 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.325 -0.587 17635 140 1 1 . 1 1 25 25 ALA H H 25 8.695 8.695 8.411 0.284 17635 141 1 1 . 1 1 26 26 ASP N N 26 115.503 115.503 118.525 -3.022 17635 142 1 1 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.527 -0.204 17635 143 1 1 . 1 1 26 26 ASP C C 26 173.108 173.108 178.133 -5.025 17635 144 1 1 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.766 0.557 17635 145 1 1 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.578 -0.527 17635 146 1 1 . 1 1 26 26 ASP H H 26 8.312 8.312 8.347 -0.035 17635 147 1 1 . 1 1 27 27 TYR N N 27 119.224 119.224 117.824 1.400 17635 148 1 1 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.474 -0.274 17635 149 1 1 . 1 1 27 27 TYR C C 27 172.908 172.908 175.538 -2.630 17635 150 1 1 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.282 2.734 17635 151 1 1 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.184 0.748 17635 152 1 1 . 1 1 27 27 TYR H H 27 7.533 7.533 7.882 -0.349 17635 153 1 1 . 1 1 28 28 PHE N N 28 112.595 112.595 120.215 -7.620 17635 154 1 1 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.155 0.175 17635 155 1 1 . 1 1 28 28 PHE C C 28 173.082 173.082 174.174 -1.092 17635 156 1 1 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.897 5.887 17635 157 1 1 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.480 1.523 17635 158 1 1 . 1 1 28 28 PHE H H 28 7.974 7.974 8.062 -0.088 17635 159 1 1 . 1 1 29 29 LYS N N 29 118.820 118.820 116.854 1.966 17635 160 1 1 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.739 0.178 17635 161 1 1 . 1 1 29 29 LYS C C 29 173.682 173.682 176.522 -2.840 17635 162 1 1 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.376 2.904 17635 163 1 1 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.535 -1.244 17635 164 1 1 . 1 1 29 29 LYS H H 29 8.325 8.325 7.752 0.573 17635 165 1 1 . 1 1 30 30 GLN N N 30 116.232 116.232 119.384 -3.152 17635 166 1 1 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.309 -0.174 17635 167 1 1 . 1 1 30 30 GLN C C 30 173.790 173.790 177.144 -3.354 17635 168 1 1 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.512 0.034 17635 169 1 1 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.334 0.565 17635 170 1 1 . 1 1 30 30 GLN H H 30 7.518 7.518 8.120 -0.602 17635 171 1 1 . 1 1 31 31 ILE N N 31 116.489 116.489 118.912 -2.423 17635 172 1 1 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.106 0.133 17635 173 1 1 . 1 1 31 31 ILE C C 31 175.599 175.599 175.708 -0.109 17635 174 1 1 . 1 1 31 31 ILE CA C 31 58.221 58.221 62.685 -4.464 17635 175 1 1 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.688 1.646 17635 176 1 1 . 1 1 31 31 ILE H H 31 7.809 7.809 8.335 -0.526 17635 177 1 1 . 1 1 32 32 GLY N N 32 107.416 107.416 105.254 2.162 17635 178 1 1 . 1 1 32 32 GLY C C 32 180.182 180.182 172.163 8.019 17635 179 1 1 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.441 0.553 17635 180 1 1 . 1 1 32 32 GLY H H 32 7.344 7.344 7.754 -0.410 17635 181 1 1 . 1 1 33 33 ILE N N 33 117.784 117.784 120.704 -2.920 17635 182 1 1 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.198 -0.109 17635 183 1 1 . 1 1 33 33 ILE C C 33 173.301 173.301 174.737 -1.436 17635 184 1 1 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.264 1.377 17635 185 1 1 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.078 -0.419 17635 186 1 1 . 1 1 33 33 ILE H H 33 8.173 8.173 7.897 0.276 17635 187 1 1 . 1 1 34 34 ILE N N 34 131.781 131.781 126.301 5.480 17635 188 1 1 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.065 -0.278 17635 189 1 1 . 1 1 34 34 ILE C C 34 174.663 174.663 175.668 -1.005 17635 190 1 1 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.369 1.001 17635 191 1 1 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.938 -0.944 17635 192 1 1 . 1 1 34 34 ILE H H 34 8.687 8.687 8.444 0.243 17635 193 1 1 . 1 1 35 35 LYS N N 35 130.372 130.372 128.525 1.847 17635 194 1 1 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.338 -0.254 17635 195 1 1 . 1 1 35 35 LYS C C 35 175.376 175.376 176.361 -0.985 17635 196 1 1 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.169 0.304 17635 197 1 1 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.459 2.205 17635 198 1 1 . 1 1 35 35 LYS H H 35 8.680 8.680 8.677 0.003 17635 199 1 1 . 1 1 36 36 THR N N 36 118.312 118.312 122.968 -4.656 17635 200 1 1 . 1 1 36 36 THR HA H 36 4.415 4.415 4.331 0.084 17635 201 1 1 . 1 1 36 36 THR C C 36 176.394 176.394 174.754 1.640 17635 202 1 1 . 1 1 36 36 THR CA C 36 61.340 61.340 62.577 -1.237 17635 203 1 1 . 1 1 36 36 THR CB C 36 70.809 70.809 69.384 1.425 17635 204 1 1 . 1 1 36 36 THR H H 36 8.456 8.456 8.081 0.375 17635 205 1 1 . 1 1 37 37 ASN N N 37 124.092 124.092 123.527 0.565 17635 206 1 1 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.921 -0.391 17635 207 1 1 . 1 1 37 37 ASN C C 37 174.235 174.235 175.506 -1.271 17635 208 1 1 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.593 1.471 17635 209 1 1 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.772 -0.845 17635 210 1 1 . 1 1 37 37 ASN H H 37 8.794 8.794 9.114 -0.320 17635 211 1 1 . 1 1 38 38 LYS N N 38 127.969 127.969 120.739 7.230 17635 212 1 1 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.332 -0.328 17635 213 1 1 . 1 1 38 38 LYS C C 38 172.702 172.702 176.797 -4.095 17635 214 1 1 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.076 0.382 17635 215 1 1 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.650 0.517 17635 216 1 1 . 1 1 38 38 LYS H H 38 8.962 8.962 8.699 0.263 17635 217 1 1 . 1 1 39 39 LYS N N 39 117.413 117.413 118.942 -1.529 17635 218 1 1 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.293 -0.035 17635 219 1 1 . 1 1 39 39 LYS C C 39 172.261 172.261 177.561 -5.300 17635 220 1 1 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.375 -0.056 17635 221 1 1 . 1 1 39 39 LYS CB C 39 32.797 32.797 31.995 0.802 17635 222 1 1 . 1 1 39 39 LYS H H 39 8.314 8.314 8.068 0.246 17635 223 1 1 . 1 1 40 40 THR N N 40 105.547 105.547 108.203 -2.656 17635 224 1 1 . 1 1 40 40 THR HA H 40 4.465 4.465 4.479 -0.014 17635 225 1 1 . 1 1 40 40 THR C C 40 174.021 174.021 175.781 -1.760 17635 226 1 1 . 1 1 40 40 THR CA C 40 61.260 61.260 61.123 0.137 17635 227 1 1 . 1 1 40 40 THR CB C 40 70.997 70.997 68.776 2.220 17635 228 1 1 . 1 1 40 40 THR H H 40 7.422 7.422 7.518 -0.096 17635 229 1 1 . 1 1 41 41 GLY N N 41 111.631 111.631 111.782 -0.151 17635 230 1 1 . 1 1 41 41 GLY C C 41 176.727 176.727 173.646 3.081 17635 231 1 1 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.593 0.138 17635 232 1 1 . 1 1 41 41 GLY H H 41 8.644 8.644 8.108 0.536 17635 233 1 1 . 1 1 42 42 GLN N N 42 118.894 118.894 117.685 1.209 17635 234 1 1 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.844 -0.175 17635 235 1 1 . 1 1 42 42 GLN C C 42 177.178 177.178 173.313 3.865 17635 236 1 1 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.272 1.309 17635 237 1 1 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.096 0.134 17635 238 1 1 . 1 1 42 42 GLN H H 42 7.662 7.662 7.630 0.032 17635 239 1 1 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.238 0.357 17635 240 1 1 . 1 1 43 43 PRO C C 43 172.629 172.629 176.052 -3.423 17635 241 1 1 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.682 -0.860 17635 242 1 1 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.161 0.535 17635 243 1 1 . 1 1 44 44 MET N N 44 124.162 124.162 121.058 3.104 17635 244 1 1 . 1 1 44 44 MET HA H 44 4.432 4.432 4.712 -0.280 17635 245 1 1 . 1 1 44 44 MET C C 44 176.474 176.474 174.292 2.182 17635 246 1 1 . 1 1 44 44 MET CA C 44 55.419 55.419 54.052 1.367 17635 247 1 1 . 1 1 44 44 MET CB C 44 30.555 30.555 35.669 -5.114 17635 248 1 1 . 1 1 44 44 MET H H 44 8.874 8.874 8.609 0.265 17635 249 1 1 . 1 1 45 45 ILE N N 45 126.237 126.237 122.241 3.996 17635 250 1 1 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.428 0.374 17635 251 1 1 . 1 1 45 45 ILE C C 45 176.415 176.415 174.271 2.144 17635 252 1 1 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.160 -0.944 17635 253 1 1 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.438 -0.212 17635 254 1 1 . 1 1 45 45 ILE H H 45 7.730 7.730 8.411 -0.681 17635 255 1 1 . 1 1 46 46 ASN N N 46 124.735 124.735 124.057 0.678 17635 256 1 1 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.798 0.143 17635 257 1 1 . 1 1 46 46 ASN C C 46 176.836 176.836 173.859 2.977 17635 258 1 1 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.542 -0.981 17635 259 1 1 . 1 1 46 46 ASN CB C 46 40.470 40.470 39.546 0.924 17635 260 1 1 . 1 1 46 46 ASN H H 46 8.384 8.384 8.815 -0.431 17635 261 1 1 . 1 1 47 47 LEU N N 47 122.487 122.487 123.689 -1.202 17635 262 1 1 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.861 -0.146 17635 263 1 1 . 1 1 47 47 LEU C C 47 174.190 174.190 175.908 -1.718 17635 264 1 1 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.586 -0.254 17635 265 1 1 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.413 -2.135 17635 266 1 1 . 1 1 47 47 LEU H H 47 8.594 8.594 7.991 0.603 17635 267 1 1 . 1 1 48 48 TYR N N 48 121.842 121.842 122.353 -0.511 17635 268 1 1 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.758 0.009 17635 269 1 1 . 1 1 48 48 TYR C C 48 173.649 173.649 174.777 -1.128 17635 270 1 1 . 1 1 48 48 TYR CA C 48 57.894 57.894 57.386 0.507 17635 271 1 1 . 1 1 48 48 TYR CB C 48 39.199 39.199 39.723 -0.524 17635 272 1 1 . 1 1 48 48 TYR H H 48 7.666 7.666 8.513 -0.847 17635 273 1 1 . 1 1 49 49 THR N N 49 116.554 116.554 114.440 2.114 17635 274 1 1 . 1 1 49 49 THR HA H 49 4.806 4.806 4.667 0.139 17635 275 1 1 . 1 1 49 49 THR C C 49 176.654 176.654 173.671 2.983 17635 276 1 1 . 1 1 49 49 THR CA C 49 60.693 60.693 59.164 1.528 17635 277 1 1 . 1 1 49 49 THR CB C 49 71.437 71.437 71.279 0.158 17635 278 1 1 . 1 1 49 49 THR H H 49 8.965 8.965 8.329 0.636 17635 279 1 1 . 1 1 50 50 ASP N N 50 123.826 123.826 122.685 1.141 17635 280 1 1 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.824 -0.200 17635 281 1 1 . 1 1 50 50 ASP C C 50 173.380 173.380 176.269 -2.889 17635 282 1 1 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.706 -0.618 17635 283 1 1 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.912 -0.045 17635 284 1 1 . 1 1 50 50 ASP H H 50 8.939 8.939 8.775 0.164 17635 285 1 1 . 1 1 51 51 ARG N N 51 127.794 127.794 123.144 4.650 17635 286 1 1 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.375 -0.330 17635 287 1 1 . 1 1 51 51 ARG C C 51 173.101 173.101 177.211 -4.110 17635 288 1 1 . 1 1 51 51 ARG CA C 51 58.562 58.562 57.517 1.045 17635 289 1 1 . 1 1 51 51 ARG CB C 51 30.167 30.167 30.093 0.074 17635 290 1 1 . 1 1 51 51 ARG H H 51 8.958 8.958 8.600 0.358 17635 291 1 1 . 1 1 52 52 GLU N N 52 117.542 117.542 120.710 -3.168 17635 292 1 1 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.184 0.094 17635 293 1 1 . 1 1 52 52 GLU C C 52 172.201 172.201 177.558 -5.357 17635 294 1 1 . 1 1 52 52 GLU CA C 52 58.524 58.524 58.106 0.418 17635 295 1 1 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.393 0.885 17635 296 1 1 . 1 1 52 52 GLU H H 52 8.561 8.561 8.453 0.108 17635 297 1 1 . 1 1 53 53 THR N N 53 107.065 107.065 110.961 -3.896 17635 298 1 1 . 1 1 53 53 THR HA H 53 4.436 4.436 4.385 0.051 17635 299 1 1 . 1 1 53 53 THR C C 53 173.851 173.851 173.988 -0.137 17635 300 1 1 . 1 1 53 53 THR CA C 53 61.944 61.944 61.746 0.198 17635 301 1 1 . 1 1 53 53 THR CB C 53 71.197 71.197 69.521 1.676 17635 302 1 1 . 1 1 53 53 THR H H 53 8.087 8.087 7.841 0.246 17635 303 1 1 . 1 1 54 54 GLY N N 54 111.295 111.295 110.095 1.200 17635 304 1 1 . 1 1 54 54 GLY C C 54 176.747 176.747 173.693 3.054 17635 305 1 1 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.277 0.426 17635 306 1 1 . 1 1 54 54 GLY H H 54 8.423 8.423 7.997 0.426 17635 307 1 1 . 1 1 55 55 LYS N N 55 119.673 119.673 117.501 2.172 17635 308 1 1 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.756 -0.403 17635 309 1 1 . 1 1 55 55 LYS C C 55 173.854 173.854 175.138 -1.284 17635 310 1 1 . 1 1 55 55 LYS CA C 55 55.842 55.842 54.095 1.747 17635 311 1 1 . 1 1 55 55 LYS CB C 55 33.821 33.821 35.383 -1.562 17635 312 1 1 . 1 1 55 55 LYS H H 55 7.767 7.767 7.347 0.420 17635 313 1 1 . 1 1 56 56 LEU N N 56 122.426 122.426 120.214 2.212 17635 314 1 1 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.490 -0.134 17635 315 1 1 . 1 1 56 56 LEU C C 56 172.534 172.534 176.792 -4.258 17635 316 1 1 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.323 1.932 17635 317 1 1 . 1 1 56 56 LEU CB C 56 41.654 41.654 43.360 -1.706 17635 318 1 1 . 1 1 56 56 LEU H H 56 8.768 8.768 8.190 0.578 17635 319 1 1 . 1 1 57 57 LYS N N 57 118.264 118.264 118.618 -0.354 17635 320 1 1 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.475 -0.187 17635 321 1 1 . 1 1 57 57 LYS C C 57 173.648 173.648 177.634 -3.986 17635 322 1 1 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.316 -0.052 17635 323 1 1 . 1 1 57 57 LYS CB C 57 34.062 34.062 34.035 0.027 17635 324 1 1 . 1 1 57 57 LYS H H 57 8.012 8.012 8.545 -0.533 17635 325 1 1 . 1 1 58 58 GLY N N 58 108.514 108.514 107.804 0.710 17635 326 1 1 . 1 1 58 58 GLY C C 58 177.876 177.876 172.215 5.661 17635 327 1 1 . 1 1 58 58 GLY CA C 58 46.364 46.364 44.885 1.479 17635 328 1 1 . 1 1 58 58 GLY H H 58 8.334 8.334 8.261 0.073 17635 329 1 1 . 1 1 59 59 GLU N N 59 116.119 116.119 119.210 -3.091 17635 330 1 1 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.055 0.466 17635 331 1 1 . 1 1 59 59 GLU C C 59 173.860 173.860 173.399 0.461 17635 332 1 1 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.956 -1.931 17635 333 1 1 . 1 1 59 59 GLU CB C 59 34.304 34.304 32.930 1.374 17635 334 1 1 . 1 1 59 59 GLU H H 59 7.202 7.202 7.797 -0.595 17635 335 1 1 . 1 1 60 60 ALA N N 60 123.607 123.607 126.960 -3.353 17635 336 1 1 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.200 0.407 17635 337 1 1 . 1 1 60 60 ALA C C 60 173.923 173.923 175.114 -1.191 17635 338 1 1 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.574 -0.631 17635 339 1 1 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.046 1.013 17635 340 1 1 . 1 1 60 60 ALA H H 60 8.930 8.930 9.162 -0.232 17635 341 1 1 . 1 1 61 61 THR N N 61 108.384 108.384 114.495 -6.111 17635 342 1 1 . 1 1 61 61 THR HA H 61 5.743 5.743 4.424 1.319 17635 343 1 1 . 1 1 61 61 THR C C 61 176.172 176.172 173.845 2.327 17635 344 1 1 . 1 1 61 61 THR CA C 61 59.625 59.625 60.190 -0.565 17635 345 1 1 . 1 1 61 61 THR CB C 61 71.224 71.224 69.642 1.582 17635 346 1 1 . 1 1 61 61 THR H H 61 8.452 8.452 8.746 -0.294 17635 347 1 1 . 1 1 62 62 VAL N N 62 120.200 120.200 125.675 -5.475 17635 348 1 1 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.151 0.093 17635 349 1 1 . 1 1 62 62 VAL C C 62 175.994 175.994 175.111 0.883 17635 350 1 1 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.278 0.148 17635 351 1 1 . 1 1 62 62 VAL CB C 62 34.685 34.685 33.350 1.335 17635 352 1 1 . 1 1 62 62 VAL H H 62 8.071 8.071 8.032 0.039 17635 353 1 1 . 1 1 63 63 SER N N 63 121.689 121.689 122.995 -1.306 17635 354 1 1 . 1 1 63 63 SER HA H 63 5.261 5.261 4.764 0.497 17635 355 1 1 . 1 1 63 63 SER C C 63 177.943 177.943 173.514 4.429 17635 356 1 1 . 1 1 63 63 SER CA C 63 57.662 57.662 58.405 -0.743 17635 357 1 1 . 1 1 63 63 SER CB C 63 64.427 64.427 64.547 -0.120 17635 358 1 1 . 1 1 63 63 SER H H 63 7.695 7.695 8.208 -0.513 17635 359 1 1 . 1 1 64 64 PHE N N 64 122.640 122.640 122.518 0.122 17635 360 1 1 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.804 0.050 17635 361 1 1 . 1 1 64 64 PHE C C 64 174.605 174.605 175.496 -0.891 17635 362 1 1 . 1 1 64 64 PHE CA C 64 58.204 58.204 56.600 1.604 17635 363 1 1 . 1 1 64 64 PHE CB C 64 41.976 41.976 43.032 -1.056 17635 364 1 1 . 1 1 64 64 PHE H H 64 9.025 9.025 8.872 0.153 17635 365 1 1 . 1 1 65 65 ASP N N 65 119.943 119.943 120.931 -0.988 17635 366 1 1 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.587 -0.152 17635 367 1 1 . 1 1 65 65 ASP C C 65 174.396 174.396 175.864 -1.468 17635 368 1 1 . 1 1 65 65 ASP CA C 65 57.442 57.442 56.020 1.421 17635 369 1 1 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.704 0.330 17635 370 1 1 . 1 1 65 65 ASP H H 65 8.512 8.512 8.542 -0.030 17635 371 1 1 . 1 1 66 66 ASP N N 66 116.125 116.125 119.544 -3.419 17635 372 1 1 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.115 0.284 17635 373 1 1 . 1 1 66 66 ASP C C 66 175.936 175.936 174.782 1.154 17635 374 1 1 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.110 -0.317 17635 375 1 1 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.954 -0.035 17635 376 1 1 . 1 1 66 66 ASP H H 66 8.323 8.323 7.669 0.654 17635 377 1 1 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.686 -0.236 17635 378 1 1 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.479 0.445 17635 379 1 1 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.709 -0.879 17635 380 1 1 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.466 -0.047 17635 381 1 1 . 1 1 68 68 PRO C C 68 171.345 171.345 179.212 -7.867 17635 382 1 1 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.172 0.063 17635 383 1 1 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.091 -0.094 17635 384 1 1 . 1 1 69 69 SER N N 69 114.544 114.544 114.012 0.532 17635 385 1 1 . 1 1 69 69 SER HA H 69 4.036 4.036 4.294 -0.258 17635 386 1 1 . 1 1 69 69 SER C C 69 176.535 176.535 176.347 0.188 17635 387 1 1 . 1 1 69 69 SER CA C 69 61.837 61.837 61.223 0.614 17635 388 1 1 . 1 1 69 69 SER CB C 69 62.773 62.773 62.960 -0.187 17635 389 1 1 . 1 1 69 69 SER H H 69 8.004 8.004 7.926 0.078 17635 390 1 1 . 1 1 70 70 ALA N N 70 122.649 122.649 124.523 -1.874 17635 391 1 1 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.567 0.026 17635 392 1 1 . 1 1 70 70 ALA C C 70 172.686 172.686 179.117 -6.431 17635 393 1 1 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.183 -0.147 17635 394 1 1 . 1 1 70 70 ALA CB C 70 17.864 17.864 17.985 -0.121 17635 395 1 1 . 1 1 70 70 ALA H H 70 7.383 7.383 7.730 -0.347 17635 396 1 1 . 1 1 71 71 LYS N N 71 116.308 116.308 119.124 -2.816 17635 397 1 1 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.497 0.278 17635 398 1 1 . 1 1 71 71 LYS C C 71 172.333 172.333 178.580 -6.247 17635 399 1 1 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.217 0.785 17635 400 1 1 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.133 0.309 17635 401 1 1 . 1 1 71 71 LYS H H 71 7.159 7.159 7.316 -0.157 17635 402 1 1 . 1 1 72 72 ALA N N 72 119.806 119.806 120.157 -0.351 17635 403 1 1 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.086 0.080 17635 404 1 1 . 1 1 72 72 ALA C C 72 170.530 170.530 179.637 -9.107 17635 405 1 1 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.934 -0.219 17635 406 1 1 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.304 -0.484 17635 407 1 1 . 1 1 72 72 ALA H H 72 7.924 7.924 7.786 0.138 17635 408 1 1 . 1 1 73 73 ALA N N 73 120.524 120.524 121.419 -0.895 17635 409 1 1 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.122 0.157 17635 410 1 1 . 1 1 73 73 ALA C C 73 171.039 171.039 179.570 -8.531 17635 411 1 1 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.956 0.423 17635 412 1 1 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.706 0.425 17635 413 1 1 . 1 1 73 73 ALA H H 73 8.104 8.104 7.598 0.506 17635 414 1 1 . 1 1 74 74 ILE N N 74 119.875 119.875 117.877 1.998 17635 415 1 1 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.790 -0.376 17635 416 1 1 . 1 1 74 74 ILE C C 74 172.435 172.435 177.637 -5.202 17635 417 1 1 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.288 0.556 17635 418 1 1 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.720 1.023 17635 419 1 1 . 1 1 74 74 ILE H H 74 7.574 7.574 7.779 -0.205 17635 420 1 1 . 1 1 75 75 ASP N N 75 117.867 117.867 118.081 -0.214 17635 421 1 1 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.470 -0.159 17635 422 1 1 . 1 1 75 75 ASP C C 75 172.054 172.054 176.732 -4.678 17635 423 1 1 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.714 0.447 17635 424 1 1 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.372 -0.841 17635 425 1 1 . 1 1 75 75 ASP H H 75 7.937 7.937 7.920 0.017 17635 426 1 1 . 1 1 76 76 TRP N N 76 117.313 117.313 120.845 -3.532 17635 427 1 1 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.487 -0.131 17635 428 1 1 . 1 1 76 76 TRP C C 76 173.272 173.272 176.938 -3.666 17635 429 1 1 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.309 1.153 17635 430 1 1 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.397 1.380 17635 431 1 1 . 1 1 76 76 TRP H H 76 8.475 8.475 7.640 0.835 17635 432 1 1 . 1 1 77 77 PHE N N 77 112.019 112.019 117.528 -5.509 17635 433 1 1 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.008 0.640 17635 434 1 1 . 1 1 77 77 PHE C C 77 173.747 173.747 176.028 -2.281 17635 435 1 1 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.374 -0.453 17635 436 1 1 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.227 2.503 17635 437 1 1 . 1 1 77 77 PHE H H 77 8.488 8.488 7.471 1.017 17635 438 1 1 . 1 1 78 78 ASP N N 78 118.408 118.408 120.137 -1.729 17635 439 1 1 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.527 -0.063 17635 440 1 1 . 1 1 78 78 ASP C C 78 172.542 172.542 176.917 -4.375 17635 441 1 1 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.260 3.430 17635 442 1 1 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.811 2.075 17635 443 1 1 . 1 1 78 78 ASP H H 78 7.978 7.978 8.414 -0.436 17635 444 1 1 . 1 1 79 79 GLY N N 79 115.548 115.548 107.120 8.428 17635 445 1 1 . 1 1 79 79 GLY C C 79 175.680 175.680 174.035 1.645 17635 446 1 1 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.809 1.263 17635 447 1 1 . 1 1 79 79 GLY H H 79 8.615 8.615 8.001 0.614 17635 448 1 1 . 1 1 80 80 LYS N N 80 120.271 120.271 119.390 0.881 17635 449 1 1 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.533 -0.071 17635 450 1 1 . 1 1 80 80 LYS C C 80 175.853 175.853 175.820 0.033 17635 451 1 1 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.342 -0.192 17635 452 1 1 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.545 -1.119 17635 453 1 1 . 1 1 80 80 LYS H H 80 8.013 8.013 7.834 0.179 17635 454 1 1 . 1 1 81 81 GLU N N 81 115.765 115.765 117.345 -1.580 17635 455 1 1 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.011 -0.313 17635 456 1 1 . 1 1 81 81 GLU C C 81 173.263 173.263 175.777 -2.514 17635 457 1 1 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.145 0.779 17635 458 1 1 . 1 1 81 81 GLU CB C 81 32.042 32.042 32.028 0.014 17635 459 1 1 . 1 1 81 81 GLU H H 81 8.201 8.201 8.412 -0.211 17635 460 1 1 . 1 1 82 82 PHE N N 82 127.080 127.080 125.307 1.773 17635 461 1 1 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.349 0.147 17635 462 1 1 . 1 1 82 82 PHE C C 82 175.349 175.349 175.780 -0.431 17635 463 1 1 . 1 1 82 82 PHE CA C 82 56.716 56.716 57.156 -0.440 17635 464 1 1 . 1 1 82 82 PHE CB C 82 41.994 41.994 40.163 1.831 17635 465 1 1 . 1 1 82 82 PHE H H 82 9.162 9.162 9.091 0.071 17635 466 1 1 . 1 1 83 83 SER N N 83 125.136 125.136 120.993 4.143 17635 467 1 1 . 1 1 83 83 SER HA H 83 3.803 3.803 4.045 -0.242 17635 468 1 1 . 1 1 83 83 SER C C 83 175.543 175.543 174.758 0.785 17635 469 1 1 . 1 1 83 83 SER CA C 83 58.371 58.371 59.455 -1.084 17635 470 1 1 . 1 1 83 83 SER CB C 83 62.519 62.519 61.940 0.579 17635 471 1 1 . 1 1 83 83 SER H H 83 9.193 9.193 9.192 0.001 17635 472 1 1 . 1 1 84 84 GLY N N 84 103.581 103.581 105.985 -2.404 17635 473 1 1 . 1 1 84 84 GLY C C 84 177.188 177.188 173.895 3.293 17635 474 1 1 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.938 0.114 17635 475 1 1 . 1 1 84 84 GLY H H 84 8.446 8.446 8.187 0.259 17635 476 1 1 . 1 1 85 85 ASN N N 85 119.051 119.051 121.390 -2.339 17635 477 1 1 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.090 0.244 17635 478 1 1 . 1 1 85 85 ASN C C 85 178.020 178.020 172.987 5.033 17635 479 1 1 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.439 -0.968 17635 480 1 1 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.591 2.526 17635 481 1 1 . 1 1 85 85 ASN H H 85 7.762 7.762 8.157 -0.395 17635 482 1 1 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.647 -0.980 17635 483 1 1 . 1 1 86 86 PRO C C 86 173.474 173.474 176.011 -2.537 17635 484 1 1 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.197 0.513 17635 485 1 1 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.189 -1.319 17635 486 1 1 . 1 1 87 87 ILE N N 87 117.270 117.270 115.010 2.260 17635 487 1 1 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.428 -0.282 17635 488 1 1 . 1 1 87 87 ILE C C 87 174.495 174.495 174.379 0.116 17635 489 1 1 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.566 0.925 17635 490 1 1 . 1 1 87 87 ILE CB C 87 41.671 41.671 43.043 -1.372 17635 491 1 1 . 1 1 87 87 ILE H H 87 8.469 8.469 9.173 -0.704 17635 492 1 1 . 1 1 88 88 LYS N N 88 122.271 122.271 122.216 0.055 17635 493 1 1 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.832 0.360 17635 494 1 1 . 1 1 88 88 LYS C C 88 174.393 174.393 175.408 -1.015 17635 495 1 1 . 1 1 88 88 LYS CA C 88 54.138 54.138 53.793 0.345 17635 496 1 1 . 1 1 88 88 LYS CB C 88 35.049 35.049 33.274 1.775 17635 497 1 1 . 1 1 88 88 LYS H H 88 8.353 8.353 8.307 0.046 17635 498 1 1 . 1 1 89 89 VAL N N 89 125.661 125.661 125.886 -0.225 17635 499 1 1 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.711 0.252 17635 500 1 1 . 1 1 89 89 VAL C C 89 177.160 177.160 176.413 0.747 17635 501 1 1 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.249 0.112 17635 502 1 1 . 1 1 89 89 VAL CB C 89 34.770 34.770 31.636 3.135 17635 503 1 1 . 1 1 89 89 VAL H H 89 9.414 9.414 8.715 0.699 17635 504 1 1 . 1 1 90 90 SER N N 90 119.538 119.538 122.390 -2.852 17635 505 1 1 . 1 1 90 90 SER HA H 90 4.710 4.710 4.804 -0.094 17635 506 1 1 . 1 1 90 90 SER C C 90 176.533 176.533 174.084 2.449 17635 507 1 1 . 1 1 90 90 SER CA C 90 56.936 56.936 56.614 0.322 17635 508 1 1 . 1 1 90 90 SER CB C 90 66.470 66.470 65.918 0.552 17635 509 1 1 . 1 1 90 90 SER H H 90 8.945 8.945 8.343 0.602 17635 510 1 1 . 1 1 91 91 PHE N N 91 120.115 120.115 122.258 -2.143 17635 511 1 1 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.571 0.102 17635 512 1 1 . 1 1 91 91 PHE C C 91 173.349 173.349 175.035 -1.686 17635 513 1 1 . 1 1 91 91 PHE CA C 91 61.155 61.155 55.625 5.530 17635 514 1 1 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.821 1.682 17635 515 1 1 . 1 1 91 91 PHE H H 91 8.919 8.919 8.637 0.282 17635 516 1 1 . 1 1 92 92 ALA N N 92 124.386 124.386 123.234 1.152 17635 517 1 1 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.161 0.195 17635 518 1 1 . 1 1 92 92 ALA C C 92 172.984 172.984 176.829 -3.845 17635 519 1 1 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.829 -0.731 17635 520 1 1 . 1 1 92 92 ALA CB C 92 19.406 19.406 16.732 2.674 17635 521 1 1 . 1 1 92 92 ALA H H 92 8.563 8.563 7.750 0.813 17635 522 1 1 . 1 1 93 93 THR N N 93 116.073 116.073 112.364 3.709 17635 523 1 1 . 1 1 93 93 THR HA H 93 4.208 4.208 4.071 0.137 17635 524 1 1 . 1 1 93 93 THR C C 93 176.032 176.032 174.683 1.349 17635 525 1 1 . 1 1 93 93 THR CA C 93 62.255 62.255 62.075 0.180 17635 526 1 1 . 1 1 93 93 THR CB C 93 69.708 69.708 69.612 0.096 17635 527 1 1 . 1 1 93 93 THR H H 93 8.312 8.312 7.703 0.609 17635 528 1 1 . 1 1 94 94 ARG N N 94 124.359 124.359 121.597 2.762 17635 529 1 1 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.346 -0.009 17635 530 1 1 . 1 1 94 94 ARG C C 94 174.426 174.426 176.430 -2.004 17635 531 1 1 . 1 1 94 94 ARG CA C 94 56.055 56.055 55.846 0.209 17635 532 1 1 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.593 0.318 17635 533 1 1 . 1 1 94 94 ARG H H 94 8.493 8.493 8.468 0.025 17635 534 1 1 . 1 1 95 95 ARG N N 95 122.515 122.515 124.107 -1.592 17635 535 1 1 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.647 -0.419 17635 536 1 1 . 1 1 95 95 ARG C C 95 174.306 174.306 175.592 -1.286 17635 537 1 1 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.092 0.050 17635 538 1 1 . 1 1 95 95 ARG CB C 95 30.966 30.966 30.219 0.747 17635 539 1 1 . 1 1 95 95 ARG H H 95 8.343 8.343 8.743 -0.400 17635 540 1 1 . 1 1 96 96 ALA N N 96 125.127 125.127 127.372 -2.245 17635 541 1 1 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.448 -0.239 17635 542 1 1 . 1 1 96 96 ALA C C 96 173.226 173.226 175.868 -2.642 17635 543 1 1 . 1 1 96 96 ALA CA C 96 52.770 52.770 51.472 1.298 17635 544 1 1 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.884 -0.691 17635 545 1 1 . 1 1 96 96 ALA H H 96 8.402 8.402 8.321 0.081 17635 546 1 1 . 1 1 97 97 ASP N N 97 118.483 118.483 118.708 -0.225 17635 547 1 1 . 1 1 97 97 ASP HA H 97 4.498 4.498 5.291 -0.793 17635 548 1 1 . 1 1 97 97 ASP C C 97 174.302 174.302 175.566 -1.264 17635 549 1 1 . 1 1 97 97 ASP CA C 97 54.091 54.091 53.587 0.504 17635 550 1 1 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.430 -0.523 17635 551 1 1 . 1 1 97 97 ASP H H 97 8.206 8.206 8.651 -0.445 17635 552 1 1 . 1 1 98 98 PHE N N 98 120.321 120.321 119.422 0.899 17635 553 1 1 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.131 0.359 17635 554 1 1 . 1 1 98 98 PHE C C 98 174.878 174.878 173.879 0.999 17635 555 1 1 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.545 -0.385 17635 556 1 1 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.356 0.947 17635 557 1 1 . 1 1 98 98 PHE H H 98 7.990 7.990 8.446 -0.456 17635 558 1 1 . 1 1 99 99 ASN N N 99 120.016 120.016 123.714 -3.698 17635 559 1 1 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.831 -0.222 17635 560 1 1 . 1 1 99 99 ASN C C 99 175.348 175.348 174.817 0.531 17635 561 1 1 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.593 -0.280 17635 562 1 1 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.790 -1.063 17635 563 1 1 . 1 1 99 99 ASN H H 99 8.336 8.336 8.370 -0.034 17635 564 1 1 . 1 1 100 100 ARG N N 100 121.374 121.374 121.589 -0.215 17635 565 1 1 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.167 0.106 17635 566 1 1 . 1 1 100 100 ARG C C 100 173.627 173.627 174.878 -1.251 17635 567 1 1 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.443 0.049 17635 568 1 1 . 1 1 100 100 ARG CB C 100 30.519 30.519 29.623 0.896 17635 569 1 1 . 1 1 100 100 ARG H H 100 8.181 8.181 8.758 -0.577 17635 570 1 1 . 1 1 101 101 GLY N N 101 109.586 109.586 106.675 2.911 17635 571 1 1 . 1 1 101 101 GLY C C 101 175.739 175.739 172.251 3.488 17635 572 1 1 . 1 1 101 101 GLY CA C 101 45.380 45.380 45.095 0.285 17635 573 1 1 . 1 1 101 101 GLY H H 101 8.413 8.413 7.625 0.788 17635 574 1 1 . 1 1 102 102 GLY N N 102 108.692 108.692 110.109 -1.417 17635 575 1 1 . 1 1 102 102 GLY C C 102 176.286 176.286 174.559 1.727 17635 576 1 1 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.882 -0.544 17635 577 1 1 . 1 1 102 102 GLY H H 102 8.281 8.281 7.869 0.412 17635 578 1 1 . 1 1 103 103 GLY N N 103 108.844 108.844 110.730 -1.886 17635 579 1 1 . 1 1 103 103 GLY C C 103 175.798 175.798 175.263 0.535 17635 580 1 1 . 1 1 103 103 GLY CA C 103 45.346 45.346 45.484 -0.138 17635 581 1 1 . 1 1 103 103 GLY H H 103 8.364 8.364 8.931 -0.567 17635 582 1 1 . 1 1 104 104 ASN N N 104 118.527 118.527 117.457 1.070 17635 583 1 1 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.860 -0.142 17635 584 1 1 . 1 1 104 104 ASN C C 104 174.547 174.547 175.564 -1.017 17635 585 1 1 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.633 0.576 17635 586 1 1 . 1 1 104 104 ASN CB C 104 38.879 38.879 40.223 -1.344 17635 587 1 1 . 1 1 104 104 ASN H H 104 8.438 8.438 8.180 0.258 17635 588 1 1 . 1 1 105 105 GLY N N 105 109.166 109.166 106.623 2.543 17635 589 1 1 . 1 1 105 105 GLY C C 105 176.074 176.074 174.818 1.256 17635 590 1 1 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.700 0.902 17635 591 1 1 . 1 1 105 105 GLY H H 105 8.477 8.477 8.653 -0.176 17635 592 1 1 . 1 1 106 106 ARG N N 106 120.341 120.341 121.167 -0.826 17635 593 1 1 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.307 0.044 17635 594 1 1 . 1 1 106 106 ARG C C 106 173.491 173.491 176.666 -3.175 17635 595 1 1 . 1 1 106 106 ARG CA C 106 56.227 56.227 57.112 -0.885 17635 596 1 1 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.471 0.158 17635 597 1 1 . 1 1 106 106 ARG H H 106 8.244 8.244 8.224 0.020 17635 598 1 1 . 1 1 107 107 GLY N N 107 109.856 109.856 108.019 1.837 17635 599 1 1 . 1 1 107 107 GLY C C 107 175.834 175.834 173.550 2.284 17635 600 1 1 . 1 1 107 107 GLY CA C 107 45.441 45.441 45.151 0.290 17635 601 1 1 . 1 1 107 107 GLY H H 107 8.522 8.522 8.969 -0.447 17635 602 1 2 . 1 1 2 2 GLN N N 2 121.692 121.692 119.914 1.778 17635 603 1 2 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.149 0.117 17635 604 1 2 . 1 1 2 2 GLN C C 2 175.248 175.248 175.045 0.203 17635 605 1 2 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.201 -0.205 17635 606 1 2 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.452 1.187 17635 607 1 2 . 1 1 2 2 GLN H H 2 8.621 8.621 8.470 0.151 17635 608 1 2 . 1 1 3 3 ASP N N 3 121.801 121.801 117.271 4.530 17635 609 1 2 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.541 0.027 17635 610 1 2 . 1 1 3 3 ASP C C 3 174.336 174.336 174.887 -0.551 17635 611 1 2 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.544 -0.482 17635 612 1 2 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.174 -0.103 17635 613 1 2 . 1 1 3 3 ASP H H 3 8.436 8.436 8.375 0.061 17635 614 1 2 . 1 1 4 4 ASN N N 4 120.292 120.292 120.717 -0.425 17635 615 1 2 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.470 0.167 17635 616 1 2 . 1 1 4 4 ASN C C 4 174.415 174.415 175.591 -1.176 17635 617 1 2 . 1 1 4 4 ASN CA C 4 53.861 53.861 54.011 -0.150 17635 618 1 2 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.375 0.159 17635 619 1 2 . 1 1 4 4 ASN H H 4 8.528 8.528 8.298 0.230 17635 620 1 2 . 1 1 5 5 SER N N 5 117.091 117.091 120.739 -3.648 17635 621 1 2 . 1 1 5 5 SER HA H 5 4.163 4.163 4.557 -0.394 17635 622 1 2 . 1 1 5 5 SER C C 5 176.370 176.370 174.433 1.937 17635 623 1 2 . 1 1 5 5 SER CA C 5 60.846 60.846 60.379 0.467 17635 624 1 2 . 1 1 5 5 SER CB C 5 63.136 63.136 63.947 -0.810 17635 625 1 2 . 1 1 5 5 SER H H 5 8.470 8.470 8.458 0.012 17635 626 1 2 . 1 1 6 6 ASP N N 6 119.436 119.436 122.453 -3.017 17635 627 1 2 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.721 -0.026 17635 628 1 2 . 1 1 6 6 ASP C C 6 175.048 175.048 175.736 -0.688 17635 629 1 2 . 1 1 6 6 ASP CA C 6 53.094 53.094 54.699 -1.605 17635 630 1 2 . 1 1 6 6 ASP CB C 6 40.935 40.935 41.612 -0.677 17635 631 1 2 . 1 1 6 6 ASP H H 6 8.218 8.218 8.385 -0.167 17635 632 1 2 . 1 1 7 7 ASN N N 7 119.696 119.696 116.718 2.978 17635 633 1 2 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.670 -0.042 17635 634 1 2 . 1 1 7 7 ASN C C 7 176.539 176.539 175.154 1.385 17635 635 1 2 . 1 1 7 7 ASN CA C 7 53.158 53.158 54.513 -1.355 17635 636 1 2 . 1 1 7 7 ASN CB C 7 38.859 38.859 39.101 -0.242 17635 637 1 2 . 1 1 7 7 ASN H H 7 7.734 7.734 7.721 0.013 17635 638 1 2 . 1 1 8 8 ASN N N 8 119.436 119.436 113.091 6.345 17635 639 1 2 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.552 0.316 17635 640 1 2 . 1 1 8 8 ASN C C 8 175.327 175.327 173.515 1.812 17635 641 1 2 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.339 -1.135 17635 642 1 2 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.430 0.065 17635 643 1 2 . 1 1 8 8 ASN H H 8 8.350 8.350 8.871 -0.521 17635 644 1 2 . 1 1 9 9 THR N N 9 118.650 118.650 113.417 5.233 17635 645 1 2 . 1 1 9 9 THR HA H 9 5.557 5.557 5.181 0.376 17635 646 1 2 . 1 1 9 9 THR C C 9 177.117 177.117 174.291 2.826 17635 647 1 2 . 1 1 9 9 THR CA C 9 62.314 62.314 62.462 -0.148 17635 648 1 2 . 1 1 9 9 THR CB C 9 71.225 71.225 70.759 0.466 17635 649 1 2 . 1 1 9 9 THR H H 9 8.428 8.428 7.771 0.657 17635 650 1 2 . 1 1 10 10 ILE N N 10 118.556 118.556 119.335 -0.779 17635 651 1 2 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.944 0.221 17635 652 1 2 . 1 1 10 10 ILE C C 10 176.837 176.837 174.343 2.494 17635 653 1 2 . 1 1 10 10 ILE CA C 10 59.298 59.298 59.169 0.129 17635 654 1 2 . 1 1 10 10 ILE CB C 10 39.880 39.880 40.568 -0.688 17635 655 1 2 . 1 1 10 10 ILE H H 10 8.770 8.770 9.074 -0.304 17635 656 1 2 . 1 1 11 11 PHE N N 11 123.798 123.798 120.212 3.586 17635 657 1 2 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.895 0.525 17635 658 1 2 . 1 1 11 11 PHE C C 11 177.066 177.066 174.926 2.140 17635 659 1 2 . 1 1 11 11 PHE CA C 11 55.362 55.362 56.538 -1.176 17635 660 1 2 . 1 1 11 11 PHE CB C 11 41.868 41.868 40.509 1.359 17635 661 1 2 . 1 1 11 11 PHE H H 11 9.548 9.548 8.273 1.275 17635 662 1 2 . 1 1 12 12 VAL N N 12 127.993 127.993 125.701 2.292 17635 663 1 2 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.551 0.407 17635 664 1 2 . 1 1 12 12 VAL C C 12 176.965 176.965 174.935 2.030 17635 665 1 2 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.722 -1.887 17635 666 1 2 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.679 2.121 17635 667 1 2 . 1 1 12 12 VAL H H 12 8.940 8.940 8.755 0.185 17635 668 1 2 . 1 1 13 13 GLN N N 13 122.289 122.289 126.161 -3.872 17635 669 1 2 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.633 0.145 17635 670 1 2 . 1 1 13 13 GLN C C 13 175.631 175.631 175.973 -0.342 17635 671 1 2 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.958 0.152 17635 672 1 2 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.780 3.352 17635 673 1 2 . 1 1 13 13 GLN H H 13 8.747 8.747 8.159 0.588 17635 674 1 2 . 1 1 14 14 GLY N N 14 109.212 109.212 111.880 -2.668 17635 675 1 2 . 1 1 14 14 GLY C C 14 175.436 175.436 173.591 1.845 17635 676 1 2 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.261 0.169 17635 677 1 2 . 1 1 14 14 GLY H H 14 8.236 8.236 9.152 -0.916 17635 678 1 2 . 1 1 15 15 LEU N N 15 117.824 117.824 120.966 -3.142 17635 679 1 2 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.185 -0.479 17635 680 1 2 . 1 1 15 15 LEU C C 15 174.111 174.111 177.487 -3.376 17635 681 1 2 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.560 0.158 17635 682 1 2 . 1 1 15 15 LEU CB C 15 42.433 42.433 40.933 1.500 17635 683 1 2 . 1 1 15 15 LEU H H 15 8.442 8.442 8.117 0.325 17635 684 1 2 . 1 1 16 16 GLY N N 16 105.063 105.063 106.036 -0.973 17635 685 1 2 . 1 1 16 16 GLY C C 16 177.771 177.771 173.194 4.577 17635 686 1 2 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.149 -1.055 17635 687 1 2 . 1 1 16 16 GLY H H 16 8.006 8.006 7.596 0.410 17635 688 1 2 . 1 1 17 17 GLU N N 17 113.781 113.781 120.118 -6.337 17635 689 1 2 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.516 -0.397 17635 690 1 2 . 1 1 17 17 GLU C C 17 173.937 173.937 175.323 -1.386 17635 691 1 2 . 1 1 17 17 GLU CA C 17 57.281 57.281 55.871 1.409 17635 692 1 2 . 1 1 17 17 GLU CB C 17 30.436 30.436 30.023 0.413 17635 693 1 2 . 1 1 17 17 GLU H H 17 8.134 8.134 8.267 -0.133 17635 694 1 2 . 1 1 18 18 ASN N N 18 116.660 116.660 115.775 0.885 17635 695 1 2 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.565 0.376 17635 696 1 2 . 1 1 18 18 ASN C C 18 175.900 175.900 174.737 1.163 17635 697 1 2 . 1 1 18 18 ASN CA C 18 52.478 52.478 53.132 -0.654 17635 698 1 2 . 1 1 18 18 ASN CB C 18 38.485 38.485 38.690 -0.205 17635 699 1 2 . 1 1 18 18 ASN H H 18 8.407 8.407 7.714 0.693 17635 700 1 2 . 1 1 19 19 VAL N N 19 118.323 118.323 122.059 -3.736 17635 701 1 2 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.380 0.772 17635 702 1 2 . 1 1 19 19 VAL C C 19 177.655 177.655 174.226 3.429 17635 703 1 2 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.130 -1.253 17635 704 1 2 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.729 1.784 17635 705 1 2 . 1 1 19 19 VAL H H 19 6.855 6.855 7.717 -0.862 17635 706 1 2 . 1 1 20 20 THR N N 20 111.636 111.636 115.308 -3.672 17635 707 1 2 . 1 1 20 20 THR HA H 20 4.719 4.719 4.471 0.248 17635 708 1 2 . 1 1 20 20 THR C C 20 175.266 175.266 175.036 0.230 17635 709 1 2 . 1 1 20 20 THR CA C 20 58.698 58.698 59.347 -0.649 17635 710 1 2 . 1 1 20 20 THR CB C 20 72.948 72.948 71.983 0.965 17635 711 1 2 . 1 1 20 20 THR H H 20 7.328 7.328 7.502 -0.174 17635 712 1 2 . 1 1 21 21 ILE N N 21 122.147 122.147 123.205 -1.058 17635 713 1 2 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.610 -0.092 17635 714 1 2 . 1 1 21 21 ILE C C 21 173.198 173.198 177.795 -4.597 17635 715 1 2 . 1 1 21 21 ILE CA C 21 65.772 65.772 65.978 -0.206 17635 716 1 2 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.452 0.131 17635 717 1 2 . 1 1 21 21 ILE H H 21 9.074 9.074 8.851 0.223 17635 718 1 2 . 1 1 22 22 GLU N N 22 118.154 118.154 119.923 -1.769 17635 719 1 2 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.072 -0.086 17635 720 1 2 . 1 1 22 22 GLU C C 22 171.799 171.799 178.719 -6.920 17635 721 1 2 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.829 0.784 17635 722 1 2 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.927 -0.136 17635 723 1 2 . 1 1 22 22 GLU H H 22 8.814 8.814 8.681 0.133 17635 724 1 2 . 1 1 23 23 SER N N 23 115.921 115.921 116.159 -0.238 17635 725 1 2 . 1 1 23 23 SER HA H 23 4.384 4.384 4.509 -0.125 17635 726 1 2 . 1 1 23 23 SER C C 23 172.447 172.447 176.523 -4.076 17635 727 1 2 . 1 1 23 23 SER CA C 23 61.239 61.239 61.057 0.182 17635 728 1 2 . 1 1 23 23 SER CB C 23 62.838 62.838 62.683 0.155 17635 729 1 2 . 1 1 23 23 SER H H 23 8.236 8.236 7.979 0.257 17635 730 1 2 . 1 1 24 24 VAL N N 24 124.867 124.867 122.378 2.489 17635 731 1 2 . 1 1 24 24 VAL HA H 24 3.748 3.748 3.989 -0.241 17635 732 1 2 . 1 1 24 24 VAL C C 24 173.016 173.016 177.815 -4.799 17635 733 1 2 . 1 1 24 24 VAL CA C 24 67.254 67.254 65.002 2.252 17635 734 1 2 . 1 1 24 24 VAL CB C 24 31.533 31.533 30.790 0.743 17635 735 1 2 . 1 1 24 24 VAL H H 24 7.973 7.973 8.452 -0.479 17635 736 1 2 . 1 1 25 25 ALA N N 25 123.198 123.198 121.872 1.326 17635 737 1 2 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.055 -0.156 17635 738 1 2 . 1 1 25 25 ALA C C 25 171.061 171.061 179.072 -8.011 17635 739 1 2 . 1 1 25 25 ALA CA C 25 55.695 55.695 55.104 0.591 17635 740 1 2 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.562 -0.824 17635 741 1 2 . 1 1 25 25 ALA H H 25 8.695 8.695 8.532 0.163 17635 742 1 2 . 1 1 26 26 ASP N N 26 115.503 115.503 118.574 -3.071 17635 743 1 2 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.462 -0.139 17635 744 1 2 . 1 1 26 26 ASP C C 26 173.108 173.108 178.222 -5.114 17635 745 1 2 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.461 0.862 17635 746 1 2 . 1 1 26 26 ASP CB C 26 41.052 41.052 40.927 0.125 17635 747 1 2 . 1 1 26 26 ASP H H 26 8.312 8.312 8.019 0.293 17635 748 1 2 . 1 1 27 27 TYR N N 27 119.224 119.224 118.180 1.044 17635 749 1 2 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.579 -0.379 17635 750 1 2 . 1 1 27 27 TYR C C 27 172.908 172.908 175.674 -2.766 17635 751 1 2 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.492 2.524 17635 752 1 2 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.195 0.737 17635 753 1 2 . 1 1 27 27 TYR H H 27 7.533 7.533 7.798 -0.265 17635 754 1 2 . 1 1 28 28 PHE N N 28 112.595 112.595 119.115 -6.520 17635 755 1 2 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.283 0.047 17635 756 1 2 . 1 1 28 28 PHE C C 28 173.082 173.082 174.940 -1.858 17635 757 1 2 . 1 1 28 28 PHE CA C 28 61.784 61.784 54.985 6.799 17635 758 1 2 . 1 1 28 28 PHE CB C 28 40.003 40.003 37.943 2.061 17635 759 1 2 . 1 1 28 28 PHE H H 28 7.974 7.974 8.308 -0.334 17635 760 1 2 . 1 1 29 29 LYS N N 29 118.820 118.820 116.872 1.948 17635 761 1 2 . 1 1 29 29 LYS HA H 29 4.917 4.917 5.013 -0.096 17635 762 1 2 . 1 1 29 29 LYS C C 29 173.682 173.682 176.819 -3.137 17635 763 1 2 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.786 2.494 17635 764 1 2 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.287 -0.996 17635 765 1 2 . 1 1 29 29 LYS H H 29 8.325 8.325 7.855 0.470 17635 766 1 2 . 1 1 30 30 GLN N N 30 116.232 116.232 118.605 -2.373 17635 767 1 2 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.276 -0.141 17635 768 1 2 . 1 1 30 30 GLN C C 30 173.790 173.790 176.856 -3.066 17635 769 1 2 . 1 1 30 30 GLN CA C 30 57.546 57.546 58.038 -0.492 17635 770 1 2 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.097 0.801 17635 771 1 2 . 1 1 30 30 GLN H H 30 7.518 7.518 8.268 -0.750 17635 772 1 2 . 1 1 31 31 ILE N N 31 116.489 116.489 118.746 -2.257 17635 773 1 2 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.089 0.150 17635 774 1 2 . 1 1 31 31 ILE C C 31 175.599 175.599 175.346 0.253 17635 775 1 2 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.938 -3.717 17635 776 1 2 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.747 1.587 17635 777 1 2 . 1 1 31 31 ILE H H 31 7.809 7.809 8.510 -0.701 17635 778 1 2 . 1 1 32 32 GLY N N 32 107.416 107.416 104.398 3.018 17635 779 1 2 . 1 1 32 32 GLY C C 32 180.182 180.182 172.272 7.910 17635 780 1 2 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.811 0.183 17635 781 1 2 . 1 1 32 32 GLY H H 32 7.344 7.344 7.687 -0.343 17635 782 1 2 . 1 1 33 33 ILE N N 33 117.784 117.784 120.477 -2.693 17635 783 1 2 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.489 -0.400 17635 784 1 2 . 1 1 33 33 ILE C C 33 173.301 173.301 175.355 -2.054 17635 785 1 2 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.642 0.999 17635 786 1 2 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.715 -1.056 17635 787 1 2 . 1 1 33 33 ILE H H 33 8.173 8.173 8.449 -0.276 17635 788 1 2 . 1 1 34 34 ILE N N 34 131.781 131.781 126.111 5.670 17635 789 1 2 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.225 -0.438 17635 790 1 2 . 1 1 34 34 ILE C C 34 174.663 174.663 175.916 -1.253 17635 791 1 2 . 1 1 34 34 ILE CA C 34 61.370 61.370 59.450 1.920 17635 792 1 2 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.915 -0.920 17635 793 1 2 . 1 1 34 34 ILE H H 34 8.687 8.687 8.523 0.164 17635 794 1 2 . 1 1 35 35 LYS N N 35 130.372 130.372 128.195 2.177 17635 795 1 2 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.297 -0.213 17635 796 1 2 . 1 1 35 35 LYS C C 35 175.376 175.376 176.886 -1.510 17635 797 1 2 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.108 0.365 17635 798 1 2 . 1 1 35 35 LYS CB C 35 33.664 33.664 30.598 3.066 17635 799 1 2 . 1 1 35 35 LYS H H 35 8.680 8.680 8.711 -0.031 17635 800 1 2 . 1 1 36 36 THR N N 36 118.312 118.312 121.731 -3.419 17635 801 1 2 . 1 1 36 36 THR HA H 36 4.415 4.415 4.168 0.247 17635 802 1 2 . 1 1 36 36 THR C C 36 176.394 176.394 174.517 1.877 17635 803 1 2 . 1 1 36 36 THR CA C 36 61.340 61.340 63.744 -2.404 17635 804 1 2 . 1 1 36 36 THR CB C 36 70.809 70.809 69.405 1.404 17635 805 1 2 . 1 1 36 36 THR H H 36 8.456 8.456 8.040 0.416 17635 806 1 2 . 1 1 37 37 ASN N N 37 124.092 124.092 122.443 1.649 17635 807 1 2 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.612 -0.082 17635 808 1 2 . 1 1 37 37 ASN C C 37 174.235 174.235 175.848 -1.613 17635 809 1 2 . 1 1 37 37 ASN CA C 37 53.064 53.064 53.101 -0.037 17635 810 1 2 . 1 1 37 37 ASN CB C 37 38.927 38.927 40.220 -1.293 17635 811 1 2 . 1 1 37 37 ASN H H 37 8.794 8.794 8.788 0.006 17635 812 1 2 . 1 1 38 38 LYS N N 38 127.969 127.969 121.303 6.666 17635 813 1 2 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.449 -0.445 17635 814 1 2 . 1 1 38 38 LYS C C 38 172.702 172.702 176.703 -4.001 17635 815 1 2 . 1 1 38 38 LYS CA C 38 58.458 58.458 57.796 0.662 17635 816 1 2 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.426 -0.259 17635 817 1 2 . 1 1 38 38 LYS H H 38 8.962 8.962 8.745 0.217 17635 818 1 2 . 1 1 39 39 LYS N N 39 117.413 117.413 118.353 -0.940 17635 819 1 2 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.345 -0.087 17635 820 1 2 . 1 1 39 39 LYS C C 39 172.261 172.261 177.442 -5.181 17635 821 1 2 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.073 0.246 17635 822 1 2 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.921 -0.124 17635 823 1 2 . 1 1 39 39 LYS H H 39 8.314 8.314 8.055 0.259 17635 824 1 2 . 1 1 40 40 THR N N 40 105.547 105.547 108.902 -3.355 17635 825 1 2 . 1 1 40 40 THR HA H 40 4.465 4.465 4.530 -0.065 17635 826 1 2 . 1 1 40 40 THR C C 40 174.021 174.021 175.567 -1.546 17635 827 1 2 . 1 1 40 40 THR CA C 40 61.260 61.260 62.080 -0.820 17635 828 1 2 . 1 1 40 40 THR CB C 40 70.997 70.997 69.753 1.244 17635 829 1 2 . 1 1 40 40 THR H H 40 7.422 7.422 7.657 -0.235 17635 830 1 2 . 1 1 41 41 GLY N N 41 111.631 111.631 111.778 -0.147 17635 831 1 2 . 1 1 41 41 GLY C C 41 176.727 176.727 173.537 3.190 17635 832 1 2 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.450 0.280 17635 833 1 2 . 1 1 41 41 GLY H H 41 8.644 8.644 8.339 0.305 17635 834 1 2 . 1 1 42 42 GLN N N 42 118.894 118.894 119.510 -0.616 17635 835 1 2 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.827 -0.158 17635 836 1 2 . 1 1 42 42 GLN C C 42 177.178 177.178 173.568 3.610 17635 837 1 2 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.730 0.851 17635 838 1 2 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.830 -0.600 17635 839 1 2 . 1 1 42 42 GLN H H 42 7.662 7.662 7.641 0.021 17635 840 1 2 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.210 0.385 17635 841 1 2 . 1 1 43 43 PRO C C 43 172.629 172.629 176.335 -3.706 17635 842 1 2 . 1 1 43 43 PRO CA C 43 62.822 62.822 64.201 -1.379 17635 843 1 2 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.053 0.643 17635 844 1 2 . 1 1 44 44 MET N N 44 124.162 124.162 121.814 2.348 17635 845 1 2 . 1 1 44 44 MET HA H 44 4.432 4.432 4.635 -0.203 17635 846 1 2 . 1 1 44 44 MET C C 44 176.474 176.474 174.583 1.891 17635 847 1 2 . 1 1 44 44 MET CA C 44 55.419 55.419 55.252 0.167 17635 848 1 2 . 1 1 44 44 MET CB C 44 30.555 30.555 34.626 -4.071 17635 849 1 2 . 1 1 44 44 MET H H 44 8.874 8.874 8.182 0.692 17635 850 1 2 . 1 1 45 45 ILE N N 45 126.237 126.237 122.724 3.513 17635 851 1 2 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.496 0.306 17635 852 1 2 . 1 1 45 45 ILE C C 45 176.415 176.415 174.252 2.163 17635 853 1 2 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.236 -1.020 17635 854 1 2 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.681 -0.455 17635 855 1 2 . 1 1 45 45 ILE H H 45 7.730 7.730 8.477 -0.747 17635 856 1 2 . 1 1 46 46 ASN N N 46 124.735 124.735 124.914 -0.179 17635 857 1 2 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.208 -0.267 17635 858 1 2 . 1 1 46 46 ASN C C 46 176.836 176.836 173.623 3.213 17635 859 1 2 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.438 -0.877 17635 860 1 2 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.700 -0.230 17635 861 1 2 . 1 1 46 46 ASN H H 46 8.384 8.384 8.441 -0.057 17635 862 1 2 . 1 1 47 47 LEU N N 47 122.487 122.487 118.925 3.562 17635 863 1 2 . 1 1 47 47 LEU HA H 47 4.715 4.715 5.140 -0.425 17635 864 1 2 . 1 1 47 47 LEU C C 47 174.190 174.190 175.804 -1.614 17635 865 1 2 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.813 -0.481 17635 866 1 2 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.753 -2.476 17635 867 1 2 . 1 1 47 47 LEU H H 47 8.594 8.594 8.291 0.303 17635 868 1 2 . 1 1 48 48 TYR N N 48 121.842 121.842 121.195 0.647 17635 869 1 2 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.792 -0.025 17635 870 1 2 . 1 1 48 48 TYR C C 48 173.649 173.649 174.706 -1.057 17635 871 1 2 . 1 1 48 48 TYR CA C 48 57.894 57.894 57.232 0.662 17635 872 1 2 . 1 1 48 48 TYR CB C 48 39.199 39.199 40.616 -1.417 17635 873 1 2 . 1 1 48 48 TYR H H 48 7.666 7.666 8.768 -1.102 17635 874 1 2 . 1 1 49 49 THR N N 49 116.554 116.554 115.290 1.264 17635 875 1 2 . 1 1 49 49 THR HA H 49 4.806 4.806 4.517 0.289 17635 876 1 2 . 1 1 49 49 THR C C 49 176.654 176.654 174.033 2.621 17635 877 1 2 . 1 1 49 49 THR CA C 49 60.693 60.693 60.272 0.421 17635 878 1 2 . 1 1 49 49 THR CB C 49 71.437 71.437 70.809 0.628 17635 879 1 2 . 1 1 49 49 THR H H 49 8.965 8.965 8.126 0.839 17635 880 1 2 . 1 1 50 50 ASP N N 50 123.826 123.826 122.973 0.853 17635 881 1 2 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.526 0.098 17635 882 1 2 . 1 1 50 50 ASP C C 50 173.380 173.380 176.492 -3.112 17635 883 1 2 . 1 1 50 50 ASP CA C 50 54.088 54.088 55.780 -1.692 17635 884 1 2 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.687 1.180 17635 885 1 2 . 1 1 50 50 ASP H H 50 8.939 8.939 8.625 0.314 17635 886 1 2 . 1 1 51 51 ARG N N 51 127.794 127.794 125.166 2.628 17635 887 1 2 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.269 -0.224 17635 888 1 2 . 1 1 51 51 ARG C C 51 173.101 173.101 176.171 -3.070 17635 889 1 2 . 1 1 51 51 ARG CA C 51 58.562 58.562 57.734 0.828 17635 890 1 2 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.590 0.577 17635 891 1 2 . 1 1 51 51 ARG H H 51 8.958 8.958 8.560 0.398 17635 892 1 2 . 1 1 52 52 GLU N N 52 117.542 117.542 120.066 -2.524 17635 893 1 2 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.320 -0.042 17635 894 1 2 . 1 1 52 52 GLU C C 52 172.201 172.201 177.346 -5.145 17635 895 1 2 . 1 1 52 52 GLU CA C 52 58.524 58.524 57.930 0.594 17635 896 1 2 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.695 0.583 17635 897 1 2 . 1 1 52 52 GLU H H 52 8.561 8.561 8.316 0.245 17635 898 1 2 . 1 1 53 53 THR N N 53 107.065 107.065 111.539 -4.474 17635 899 1 2 . 1 1 53 53 THR HA H 53 4.436 4.436 4.385 0.051 17635 900 1 2 . 1 1 53 53 THR C C 53 173.851 173.851 175.491 -1.640 17635 901 1 2 . 1 1 53 53 THR CA C 53 61.944 61.944 62.084 -0.140 17635 902 1 2 . 1 1 53 53 THR CB C 53 71.197 71.197 69.715 1.482 17635 903 1 2 . 1 1 53 53 THR H H 53 8.087 8.087 8.006 0.081 17635 904 1 2 . 1 1 54 54 GLY N N 54 111.295 111.295 109.109 2.186 17635 905 1 2 . 1 1 54 54 GLY C C 54 176.747 176.747 174.701 2.046 17635 906 1 2 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.887 0.816 17635 907 1 2 . 1 1 54 54 GLY H H 54 8.423 8.423 7.845 0.578 17635 908 1 2 . 1 1 55 55 LYS N N 55 119.673 119.673 120.830 -1.157 17635 909 1 2 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.162 0.191 17635 910 1 2 . 1 1 55 55 LYS C C 55 173.854 173.854 175.867 -2.013 17635 911 1 2 . 1 1 55 55 LYS CA C 55 55.842 55.842 56.580 -0.738 17635 912 1 2 . 1 1 55 55 LYS CB C 55 33.821 33.821 32.955 0.866 17635 913 1 2 . 1 1 55 55 LYS H H 55 7.767 7.767 7.749 0.018 17635 914 1 2 . 1 1 56 56 LEU N N 56 122.426 122.426 121.165 1.261 17635 915 1 2 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.410 -0.054 17635 916 1 2 . 1 1 56 56 LEU C C 56 172.534 172.534 176.537 -4.003 17635 917 1 2 . 1 1 56 56 LEU CA C 56 56.255 56.255 53.814 2.441 17635 918 1 2 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.997 -1.343 17635 919 1 2 . 1 1 56 56 LEU H H 56 8.768 8.768 8.258 0.510 17635 920 1 2 . 1 1 57 57 LYS N N 57 118.264 118.264 122.826 -4.562 17635 921 1 2 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.130 0.158 17635 922 1 2 . 1 1 57 57 LYS C C 57 173.648 173.648 177.478 -3.830 17635 923 1 2 . 1 1 57 57 LYS CA C 57 56.264 56.264 57.685 -1.421 17635 924 1 2 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.722 1.340 17635 925 1 2 . 1 1 57 57 LYS H H 57 8.012 8.012 8.754 -0.742 17635 926 1 2 . 1 1 58 58 GLY N N 58 108.514 108.514 106.207 2.307 17635 927 1 2 . 1 1 58 58 GLY C C 58 177.876 177.876 172.994 4.882 17635 928 1 2 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.181 1.183 17635 929 1 2 . 1 1 58 58 GLY H H 58 8.334 8.334 8.346 -0.012 17635 930 1 2 . 1 1 59 59 GLU N N 59 116.119 116.119 119.313 -3.194 17635 931 1 2 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.074 0.447 17635 932 1 2 . 1 1 59 59 GLU C C 59 173.860 173.860 173.763 0.097 17635 933 1 2 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.643 -2.618 17635 934 1 2 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.597 0.707 17635 935 1 2 . 1 1 59 59 GLU H H 59 7.202 7.202 7.681 -0.479 17635 936 1 2 . 1 1 60 60 ALA N N 60 123.607 123.607 126.468 -2.861 17635 937 1 2 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.046 0.561 17635 938 1 2 . 1 1 60 60 ALA C C 60 173.923 173.923 175.115 -1.192 17635 939 1 2 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.608 -0.665 17635 940 1 2 . 1 1 60 60 ALA CB C 60 24.059 24.059 22.934 1.125 17635 941 1 2 . 1 1 60 60 ALA H H 60 8.930 8.930 9.272 -0.342 17635 942 1 2 . 1 1 61 61 THR N N 61 108.384 108.384 114.012 -5.628 17635 943 1 2 . 1 1 61 61 THR HA H 61 5.743 5.743 4.471 1.272 17635 944 1 2 . 1 1 61 61 THR C C 61 176.172 176.172 173.899 2.273 17635 945 1 2 . 1 1 61 61 THR CA C 61 59.625 59.625 60.445 -0.820 17635 946 1 2 . 1 1 61 61 THR CB C 61 71.224 71.224 69.867 1.357 17635 947 1 2 . 1 1 61 61 THR H H 61 8.452 8.452 8.717 -0.265 17635 948 1 2 . 1 1 62 62 VAL N N 62 120.200 120.200 122.928 -2.728 17635 949 1 2 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.436 -0.192 17635 950 1 2 . 1 1 62 62 VAL C C 62 175.994 175.994 175.044 0.950 17635 951 1 2 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.110 0.316 17635 952 1 2 . 1 1 62 62 VAL CB C 62 34.685 34.685 34.844 -0.159 17635 953 1 2 . 1 1 62 62 VAL H H 62 8.071 8.071 8.752 -0.681 17635 954 1 2 . 1 1 63 63 SER N N 63 121.689 121.689 121.636 0.053 17635 955 1 2 . 1 1 63 63 SER HA H 63 5.261 5.261 4.783 0.478 17635 956 1 2 . 1 1 63 63 SER C C 63 177.943 177.943 173.596 4.347 17635 957 1 2 . 1 1 63 63 SER CA C 63 57.662 57.662 57.056 0.606 17635 958 1 2 . 1 1 63 63 SER CB C 63 64.427 64.427 64.191 0.236 17635 959 1 2 . 1 1 63 63 SER H H 63 7.695 7.695 8.345 -0.650 17635 960 1 2 . 1 1 64 64 PHE N N 64 122.640 122.640 121.046 1.594 17635 961 1 2 . 1 1 64 64 PHE HA H 64 4.854 4.854 5.033 -0.179 17635 962 1 2 . 1 1 64 64 PHE C C 64 174.605 174.605 175.479 -0.874 17635 963 1 2 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.986 0.218 17635 964 1 2 . 1 1 64 64 PHE CB C 64 41.976 41.976 43.084 -1.108 17635 965 1 2 . 1 1 64 64 PHE H H 64 9.025 9.025 9.026 -0.001 17635 966 1 2 . 1 1 65 65 ASP N N 65 119.943 119.943 123.382 -3.439 17635 967 1 2 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.537 -0.102 17635 968 1 2 . 1 1 65 65 ASP C C 65 174.396 174.396 175.927 -1.531 17635 969 1 2 . 1 1 65 65 ASP CA C 65 57.442 57.442 56.644 0.798 17635 970 1 2 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.868 0.166 17635 971 1 2 . 1 1 65 65 ASP H H 65 8.512 8.512 9.031 -0.519 17635 972 1 2 . 1 1 66 66 ASP N N 66 116.125 116.125 118.422 -2.297 17635 973 1 2 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.165 0.234 17635 974 1 2 . 1 1 66 66 ASP C C 66 175.936 175.936 174.641 1.295 17635 975 1 2 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.379 -0.586 17635 976 1 2 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.142 0.777 17635 977 1 2 . 1 1 66 66 ASP H H 66 8.323 8.323 7.781 0.542 17635 978 1 2 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.477 -0.027 17635 979 1 2 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.669 0.255 17635 980 1 2 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.485 -0.655 17635 981 1 2 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.315 0.104 17635 982 1 2 . 1 1 68 68 PRO C C 68 171.345 171.345 179.083 -7.738 17635 983 1 2 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.887 0.348 17635 984 1 2 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.977 0.020 17635 985 1 2 . 1 1 69 69 SER N N 69 114.544 114.544 114.108 0.436 17635 986 1 2 . 1 1 69 69 SER HA H 69 4.036 4.036 3.941 0.095 17635 987 1 2 . 1 1 69 69 SER C C 69 176.535 176.535 175.757 0.778 17635 988 1 2 . 1 1 69 69 SER CA C 69 61.837 61.837 61.263 0.574 17635 989 1 2 . 1 1 69 69 SER CB C 69 62.773 62.773 62.564 0.209 17635 990 1 2 . 1 1 69 69 SER H H 69 8.004 8.004 7.934 0.070 17635 991 1 2 . 1 1 70 70 ALA N N 70 122.649 122.649 123.431 -0.782 17635 992 1 2 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.040 0.553 17635 993 1 2 . 1 1 70 70 ALA C C 70 172.686 172.686 178.969 -6.283 17635 994 1 2 . 1 1 70 70 ALA CA C 70 55.036 55.036 54.996 0.040 17635 995 1 2 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.108 -0.244 17635 996 1 2 . 1 1 70 70 ALA H H 70 7.383 7.383 7.343 0.040 17635 997 1 2 . 1 1 71 71 LYS N N 71 116.308 116.308 119.892 -3.584 17635 998 1 2 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.462 0.313 17635 999 1 2 . 1 1 71 71 LYS C C 71 172.333 172.333 178.189 -5.856 17635 1000 1 2 . 1 1 71 71 LYS CA C 71 59.002 59.002 57.942 1.060 17635 1001 1 2 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.604 0.838 17635 1002 1 2 . 1 1 71 71 LYS H H 71 7.159 7.159 7.365 -0.206 17635 1003 1 2 . 1 1 72 72 ALA N N 72 119.806 119.806 120.702 -0.896 17635 1004 1 2 . 1 1 72 72 ALA HA H 72 4.166 4.166 3.918 0.248 17635 1005 1 2 . 1 1 72 72 ALA C C 72 170.530 170.530 179.616 -9.086 17635 1006 1 2 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.769 -0.054 17635 1007 1 2 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.752 0.068 17635 1008 1 2 . 1 1 72 72 ALA H H 72 7.924 7.924 7.686 0.238 17635 1009 1 2 . 1 1 73 73 ALA N N 73 120.524 120.524 120.914 -0.390 17635 1010 1 2 . 1 1 73 73 ALA HA H 73 4.279 4.279 3.947 0.332 17635 1011 1 2 . 1 1 73 73 ALA C C 73 171.039 171.039 179.323 -8.284 17635 1012 1 2 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.725 0.654 17635 1013 1 2 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.225 0.906 17635 1014 1 2 . 1 1 73 73 ALA H H 73 8.104 8.104 7.272 0.832 17635 1015 1 2 . 1 1 74 74 ILE N N 74 119.875 119.875 117.927 1.948 17635 1016 1 2 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.685 -0.271 17635 1017 1 2 . 1 1 74 74 ILE C C 74 172.435 172.435 177.630 -5.195 17635 1018 1 2 . 1 1 74 74 ILE CA C 74 65.844 65.844 64.998 0.846 17635 1019 1 2 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.635 1.108 17635 1020 1 2 . 1 1 74 74 ILE H H 74 7.574 7.574 7.542 0.032 17635 1021 1 2 . 1 1 75 75 ASP N N 75 117.867 117.867 118.136 -0.269 17635 1022 1 2 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.378 -0.067 17635 1023 1 2 . 1 1 75 75 ASP C C 75 172.054 172.054 176.715 -4.661 17635 1024 1 2 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.680 0.481 17635 1025 1 2 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.170 -0.639 17635 1026 1 2 . 1 1 75 75 ASP H H 75 7.937 7.937 7.902 0.035 17635 1027 1 2 . 1 1 76 76 TRP N N 76 117.313 117.313 120.386 -3.073 17635 1028 1 2 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.324 0.032 17635 1029 1 2 . 1 1 76 76 TRP C C 76 173.272 173.272 177.087 -3.815 17635 1030 1 2 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.177 1.285 17635 1031 1 2 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.251 1.526 17635 1032 1 2 . 1 1 76 76 TRP H H 76 8.475 8.475 7.404 1.071 17635 1033 1 2 . 1 1 77 77 PHE N N 77 112.019 112.019 117.552 -5.533 17635 1034 1 2 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.046 0.602 17635 1035 1 2 . 1 1 77 77 PHE C C 77 173.747 173.747 176.053 -2.306 17635 1036 1 2 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.649 -0.728 17635 1037 1 2 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.123 2.607 17635 1038 1 2 . 1 1 77 77 PHE H H 77 8.488 8.488 6.824 1.664 17635 1039 1 2 . 1 1 78 78 ASP N N 78 118.408 118.408 119.419 -1.011 17635 1040 1 2 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.513 -0.049 17635 1041 1 2 . 1 1 78 78 ASP C C 78 172.542 172.542 176.641 -4.099 17635 1042 1 2 . 1 1 78 78 ASP CA C 78 58.690 58.690 54.910 3.780 17635 1043 1 2 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.340 1.546 17635 1044 1 2 . 1 1 78 78 ASP H H 78 7.978 7.978 8.417 -0.439 17635 1045 1 2 . 1 1 79 79 GLY N N 79 115.548 115.548 102.820 12.728 17635 1046 1 2 . 1 1 79 79 GLY C C 79 175.680 175.680 173.442 2.238 17635 1047 1 2 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.982 1.090 17635 1048 1 2 . 1 1 79 79 GLY H H 79 8.615 8.615 8.494 0.121 17635 1049 1 2 . 1 1 80 80 LYS N N 80 120.271 120.271 119.737 0.534 17635 1050 1 2 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.543 -0.081 17635 1051 1 2 . 1 1 80 80 LYS C C 80 175.853 175.853 175.020 0.833 17635 1052 1 2 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.718 0.432 17635 1053 1 2 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.396 -1.970 17635 1054 1 2 . 1 1 80 80 LYS H H 80 8.013 8.013 7.963 0.050 17635 1055 1 2 . 1 1 81 81 GLU N N 81 115.765 115.765 119.113 -3.348 17635 1056 1 2 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.287 -0.589 17635 1057 1 2 . 1 1 81 81 GLU C C 81 173.263 173.263 175.847 -2.584 17635 1058 1 2 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.564 0.360 17635 1059 1 2 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.426 0.616 17635 1060 1 2 . 1 1 81 81 GLU H H 81 8.201 8.201 8.566 -0.365 17635 1061 1 2 . 1 1 82 82 PHE N N 82 127.080 127.080 126.232 0.848 17635 1062 1 2 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.607 -0.111 17635 1063 1 2 . 1 1 82 82 PHE C C 82 175.349 175.349 175.401 -0.052 17635 1064 1 2 . 1 1 82 82 PHE CA C 82 56.716 56.716 54.954 1.762 17635 1065 1 2 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.727 2.268 17635 1066 1 2 . 1 1 82 82 PHE H H 82 9.162 9.162 9.224 -0.062 17635 1067 1 2 . 1 1 83 83 SER N N 83 125.136 125.136 122.033 3.103 17635 1068 1 2 . 1 1 83 83 SER HA H 83 3.803 3.803 4.187 -0.384 17635 1069 1 2 . 1 1 83 83 SER C C 83 175.543 175.543 174.833 0.710 17635 1070 1 2 . 1 1 83 83 SER CA C 83 58.371 58.371 58.932 -0.562 17635 1071 1 2 . 1 1 83 83 SER CB C 83 62.519 62.519 62.791 -0.272 17635 1072 1 2 . 1 1 83 83 SER H H 83 9.193 9.193 9.192 0.001 17635 1073 1 2 . 1 1 84 84 GLY N N 84 103.581 103.581 104.734 -1.153 17635 1074 1 2 . 1 1 84 84 GLY C C 84 177.188 177.188 173.864 3.324 17635 1075 1 2 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.784 0.268 17635 1076 1 2 . 1 1 84 84 GLY H H 84 8.446 8.446 8.284 0.162 17635 1077 1 2 . 1 1 85 85 ASN N N 85 119.051 119.051 119.645 -0.594 17635 1078 1 2 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.243 0.091 17635 1079 1 2 . 1 1 85 85 ASN C C 85 178.020 178.020 172.510 5.510 17635 1080 1 2 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.813 -0.342 17635 1081 1 2 . 1 1 85 85 ASN CB C 85 41.117 41.117 39.288 1.829 17635 1082 1 2 . 1 1 85 85 ASN H H 85 7.762 7.762 7.793 -0.031 17635 1083 1 2 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.509 -0.842 17635 1084 1 2 . 1 1 86 86 PRO C C 86 173.474 173.474 176.218 -2.744 17635 1085 1 2 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.338 0.372 17635 1086 1 2 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.784 -0.914 17635 1087 1 2 . 1 1 87 87 ILE N N 87 117.270 117.270 115.251 2.019 17635 1088 1 2 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.372 -0.226 17635 1089 1 2 . 1 1 87 87 ILE C C 87 174.495 174.495 174.233 0.262 17635 1090 1 2 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.610 0.881 17635 1091 1 2 . 1 1 87 87 ILE CB C 87 41.671 41.671 43.106 -1.435 17635 1092 1 2 . 1 1 87 87 ILE H H 87 8.469 8.469 9.025 -0.556 17635 1093 1 2 . 1 1 88 88 LYS N N 88 122.271 122.271 120.009 2.262 17635 1094 1 2 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.765 0.427 17635 1095 1 2 . 1 1 88 88 LYS C C 88 174.393 174.393 174.886 -0.493 17635 1096 1 2 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.178 -1.040 17635 1097 1 2 . 1 1 88 88 LYS CB C 88 35.049 35.049 33.895 1.154 17635 1098 1 2 . 1 1 88 88 LYS H H 88 8.353 8.353 8.259 0.094 17635 1099 1 2 . 1 1 89 89 VAL N N 89 125.661 125.661 125.593 0.068 17635 1100 1 2 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.850 0.113 17635 1101 1 2 . 1 1 89 89 VAL C C 89 177.160 177.160 176.150 1.010 17635 1102 1 2 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.276 -0.915 17635 1103 1 2 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.908 1.862 17635 1104 1 2 . 1 1 89 89 VAL H H 89 9.414 9.414 8.572 0.842 17635 1105 1 2 . 1 1 90 90 SER N N 90 119.538 119.538 120.092 -0.554 17635 1106 1 2 . 1 1 90 90 SER HA H 90 4.710 4.710 4.784 -0.074 17635 1107 1 2 . 1 1 90 90 SER C C 90 176.533 176.533 174.244 2.289 17635 1108 1 2 . 1 1 90 90 SER CA C 90 56.936 56.936 56.419 0.517 17635 1109 1 2 . 1 1 90 90 SER CB C 90 66.470 66.470 65.597 0.873 17635 1110 1 2 . 1 1 90 90 SER H H 90 8.945 8.945 8.233 0.712 17635 1111 1 2 . 1 1 91 91 PHE N N 91 120.115 120.115 123.148 -3.033 17635 1112 1 2 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.621 0.052 17635 1113 1 2 . 1 1 91 91 PHE C C 91 173.349 173.349 174.625 -1.276 17635 1114 1 2 . 1 1 91 91 PHE CA C 91 61.155 61.155 55.836 5.319 17635 1115 1 2 . 1 1 91 91 PHE CB C 91 39.503 39.503 38.628 0.875 17635 1116 1 2 . 1 1 91 91 PHE H H 91 8.919 8.919 8.372 0.547 17635 1117 1 2 . 1 1 92 92 ALA N N 92 124.386 124.386 121.863 2.523 17635 1118 1 2 . 1 1 92 92 ALA HA H 92 4.356 4.356 3.930 0.426 17635 1119 1 2 . 1 1 92 92 ALA C C 92 172.984 172.984 176.179 -3.195 17635 1120 1 2 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.383 -0.285 17635 1121 1 2 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.349 1.058 17635 1122 1 2 . 1 1 92 92 ALA H H 92 8.563 8.563 7.843 0.720 17635 1123 1 2 . 1 1 93 93 THR N N 93 116.073 116.073 113.964 2.109 17635 1124 1 2 . 1 1 93 93 THR HA H 93 4.208 4.208 4.142 0.066 17635 1125 1 2 . 1 1 93 93 THR C C 93 176.032 176.032 176.073 -0.041 17635 1126 1 2 . 1 1 93 93 THR CA C 93 62.255 62.255 61.007 1.248 17635 1127 1 2 . 1 1 93 93 THR CB C 93 69.708 69.708 69.702 0.006 17635 1128 1 2 . 1 1 93 93 THR H H 93 8.312 8.312 6.896 1.416 17635 1129 1 2 . 1 1 94 94 ARG N N 94 124.359 124.359 125.669 -1.310 17635 1130 1 2 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.129 0.208 17635 1131 1 2 . 1 1 94 94 ARG C C 94 174.426 174.426 176.354 -1.928 17635 1132 1 2 . 1 1 94 94 ARG CA C 94 56.055 56.055 57.686 -1.631 17635 1133 1 2 . 1 1 94 94 ARG CB C 94 30.911 30.911 29.974 0.937 17635 1134 1 2 . 1 1 94 94 ARG H H 94 8.493 8.493 8.435 0.058 17635 1135 1 2 . 1 1 95 95 ARG N N 95 122.515 122.515 118.126 4.389 17635 1136 1 2 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.100 0.128 17635 1137 1 2 . 1 1 95 95 ARG C C 95 174.306 174.306 174.785 -0.479 17635 1138 1 2 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.589 -0.447 17635 1139 1 2 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.602 1.364 17635 1140 1 2 . 1 1 95 95 ARG H H 95 8.343 8.343 7.952 0.391 17635 1141 1 2 . 1 1 96 96 ALA N N 96 125.127 125.127 123.031 2.096 17635 1142 1 2 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.449 -0.240 17635 1143 1 2 . 1 1 96 96 ALA C C 96 173.226 173.226 175.665 -2.439 17635 1144 1 2 . 1 1 96 96 ALA CA C 96 52.770 52.770 51.926 0.844 17635 1145 1 2 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.596 -0.403 17635 1146 1 2 . 1 1 96 96 ALA H H 96 8.402 8.402 8.394 0.008 17635 1147 1 2 . 1 1 97 97 ASP N N 97 118.483 118.483 119.762 -1.279 17635 1148 1 2 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.925 -0.427 17635 1149 1 2 . 1 1 97 97 ASP C C 97 174.302 174.302 175.417 -1.115 17635 1150 1 2 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.518 -0.427 17635 1151 1 2 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.449 -0.542 17635 1152 1 2 . 1 1 97 97 ASP H H 97 8.206 8.206 8.236 -0.030 17635 1153 1 2 . 1 1 98 98 PHE N N 98 120.321 120.321 121.813 -1.492 17635 1154 1 2 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.662 -0.172 17635 1155 1 2 . 1 1 98 98 PHE C C 98 174.878 174.878 174.908 -0.030 17635 1156 1 2 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.631 -0.471 17635 1157 1 2 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.896 0.407 17635 1158 1 2 . 1 1 98 98 PHE H H 98 7.990 7.990 8.007 -0.017 17635 1159 1 2 . 1 1 99 99 ASN N N 99 120.016 120.016 120.747 -0.731 17635 1160 1 2 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.201 0.408 17635 1161 1 2 . 1 1 99 99 ASN C C 99 175.348 175.348 175.180 0.168 17635 1162 1 2 . 1 1 99 99 ASN CA C 99 53.313 53.313 54.500 -1.187 17635 1163 1 2 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.169 0.558 17635 1164 1 2 . 1 1 99 99 ASN H H 99 8.336 8.336 8.584 -0.248 17635 1165 1 2 . 1 1 100 100 ARG N N 100 121.374 121.374 119.987 1.387 17635 1166 1 2 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.070 0.203 17635 1167 1 2 . 1 1 100 100 ARG C C 100 173.627 173.627 175.225 -1.598 17635 1168 1 2 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.835 -0.343 17635 1169 1 2 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.420 0.099 17635 1170 1 2 . 1 1 100 100 ARG H H 100 8.181 8.181 8.013 0.168 17635 1171 1 2 . 1 1 101 101 GLY N N 101 109.586 109.586 111.703 -2.117 17635 1172 1 2 . 1 1 101 101 GLY C C 101 175.739 175.739 173.394 2.345 17635 1173 1 2 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.843 0.537 17635 1174 1 2 . 1 1 101 101 GLY H H 101 8.413 8.413 8.399 0.014 17635 1175 1 2 . 1 1 102 102 GLY N N 102 108.692 108.692 108.132 0.560 17635 1176 1 2 . 1 1 102 102 GLY C C 102 176.286 176.286 174.345 1.941 17635 1177 1 2 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.435 0.903 17635 1178 1 2 . 1 1 102 102 GLY H H 102 8.281 8.281 8.074 0.207 17635 1179 1 2 . 1 1 103 103 GLY N N 103 108.844 108.844 112.729 -3.885 17635 1180 1 2 . 1 1 103 103 GLY C C 103 175.798 175.798 173.429 2.369 17635 1181 1 2 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.493 0.853 17635 1182 1 2 . 1 1 103 103 GLY H H 103 8.364 8.364 8.413 -0.049 17635 1183 1 2 . 1 1 104 104 ASN N N 104 118.527 118.527 118.913 -0.386 17635 1184 1 2 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.920 -0.202 17635 1185 1 2 . 1 1 104 104 ASN C C 104 174.547 174.547 176.911 -2.364 17635 1186 1 2 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.381 0.828 17635 1187 1 2 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.485 -0.606 17635 1188 1 2 . 1 1 104 104 ASN H H 104 8.438 8.438 8.623 -0.185 17635 1189 1 2 . 1 1 105 105 GLY N N 105 109.166 109.166 107.412 1.754 17635 1190 1 2 . 1 1 105 105 GLY C C 105 176.074 176.074 174.688 1.386 17635 1191 1 2 . 1 1 105 105 GLY CA C 105 45.602 45.602 46.034 -0.432 17635 1192 1 2 . 1 1 105 105 GLY H H 105 8.477 8.477 8.455 0.022 17635 1193 1 2 . 1 1 106 106 ARG N N 106 120.341 120.341 121.037 -0.696 17635 1194 1 2 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.567 -0.216 17635 1195 1 2 . 1 1 106 106 ARG C C 106 173.491 173.491 175.354 -1.863 17635 1196 1 2 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.474 0.753 17635 1197 1 2 . 1 1 106 106 ARG CB C 106 30.629 30.629 32.508 -1.879 17635 1198 1 2 . 1 1 106 106 ARG H H 106 8.244 8.244 7.695 0.549 17635 1199 1 2 . 1 1 107 107 GLY N N 107 109.856 109.856 109.169 0.687 17635 1200 1 2 . 1 1 107 107 GLY C C 107 175.834 175.834 173.859 1.975 17635 1201 1 2 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.847 0.594 17635 1202 1 2 . 1 1 107 107 GLY H H 107 8.522 8.522 8.600 -0.078 17635 1203 1 3 . 1 1 2 2 GLN N N 2 121.692 121.692 120.260 1.432 17635 1204 1 3 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.571 -0.305 17635 1205 1 3 . 1 1 2 2 GLN C C 2 175.248 175.248 174.474 0.774 17635 1206 1 3 . 1 1 2 2 GLN CA C 2 55.996 55.996 54.757 1.239 17635 1207 1 3 . 1 1 2 2 GLN CB C 2 29.639 29.639 30.947 -1.308 17635 1208 1 3 . 1 1 2 2 GLN H H 2 8.621 8.621 8.111 0.510 17635 1209 1 3 . 1 1 3 3 ASP N N 3 121.801 121.801 122.304 -0.503 17635 1210 1 3 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.696 -0.128 17635 1211 1 3 . 1 1 3 3 ASP C C 3 174.336 174.336 175.220 -0.884 17635 1212 1 3 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.614 -0.552 17635 1213 1 3 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.527 0.544 17635 1214 1 3 . 1 1 3 3 ASP H H 3 8.436 8.436 8.279 0.157 17635 1215 1 3 . 1 1 4 4 ASN N N 4 120.292 120.292 122.985 -2.693 17635 1216 1 3 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.788 -0.151 17635 1217 1 3 . 1 1 4 4 ASN C C 4 174.415 174.415 174.892 -0.477 17635 1218 1 3 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.152 0.709 17635 1219 1 3 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.875 -0.341 17635 1220 1 3 . 1 1 4 4 ASN H H 4 8.528 8.528 8.459 0.069 17635 1221 1 3 . 1 1 5 5 SER N N 5 117.091 117.091 115.730 1.361 17635 1222 1 3 . 1 1 5 5 SER HA H 5 4.163 4.163 4.596 -0.433 17635 1223 1 3 . 1 1 5 5 SER C C 5 176.370 176.370 174.612 1.758 17635 1224 1 3 . 1 1 5 5 SER CA C 5 60.846 60.846 57.200 3.646 17635 1225 1 3 . 1 1 5 5 SER CB C 5 63.136 63.136 63.105 0.032 17635 1226 1 3 . 1 1 5 5 SER H H 5 8.470 8.470 8.189 0.281 17635 1227 1 3 . 1 1 6 6 ASP N N 6 119.436 119.436 119.461 -0.025 17635 1228 1 3 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.517 0.178 17635 1229 1 3 . 1 1 6 6 ASP C C 6 175.048 175.048 175.733 -0.685 17635 1230 1 3 . 1 1 6 6 ASP CA C 6 53.094 53.094 56.279 -3.185 17635 1231 1 3 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.946 -0.011 17635 1232 1 3 . 1 1 6 6 ASP H H 6 8.218 8.218 8.541 -0.323 17635 1233 1 3 . 1 1 7 7 ASN N N 7 119.696 119.696 117.592 2.104 17635 1234 1 3 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.573 0.055 17635 1235 1 3 . 1 1 7 7 ASN C C 7 176.539 176.539 174.989 1.550 17635 1236 1 3 . 1 1 7 7 ASN CA C 7 53.158 53.158 54.400 -1.242 17635 1237 1 3 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.579 0.280 17635 1238 1 3 . 1 1 7 7 ASN H H 7 7.734 7.734 8.273 -0.539 17635 1239 1 3 . 1 1 8 8 ASN N N 8 119.436 119.436 117.286 2.150 17635 1240 1 3 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.897 -0.029 17635 1241 1 3 . 1 1 8 8 ASN C C 8 175.327 175.327 174.546 0.781 17635 1242 1 3 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.022 -0.818 17635 1243 1 3 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.417 -0.922 17635 1244 1 3 . 1 1 8 8 ASN H H 8 8.350 8.350 8.868 -0.518 17635 1245 1 3 . 1 1 9 9 THR N N 9 118.650 118.650 120.269 -1.619 17635 1246 1 3 . 1 1 9 9 THR HA H 9 5.557 5.557 5.011 0.546 17635 1247 1 3 . 1 1 9 9 THR C C 9 177.117 177.117 175.039 2.078 17635 1248 1 3 . 1 1 9 9 THR CA C 9 62.314 62.314 63.604 -1.290 17635 1249 1 3 . 1 1 9 9 THR CB C 9 71.225 71.225 69.629 1.596 17635 1250 1 3 . 1 1 9 9 THR H H 9 8.428 8.428 7.612 0.816 17635 1251 1 3 . 1 1 10 10 ILE N N 10 118.556 118.556 120.961 -2.405 17635 1252 1 3 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.118 0.047 17635 1253 1 3 . 1 1 10 10 ILE C C 10 176.837 176.837 174.948 1.889 17635 1254 1 3 . 1 1 10 10 ILE CA C 10 59.298 59.298 59.271 0.027 17635 1255 1 3 . 1 1 10 10 ILE CB C 10 39.880 39.880 40.155 -0.275 17635 1256 1 3 . 1 1 10 10 ILE H H 10 8.770 8.770 8.695 0.075 17635 1257 1 3 . 1 1 11 11 PHE N N 11 123.798 123.798 119.963 3.835 17635 1258 1 3 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.764 0.656 17635 1259 1 3 . 1 1 11 11 PHE C C 11 177.066 177.066 174.721 2.345 17635 1260 1 3 . 1 1 11 11 PHE CA C 11 55.362 55.362 56.346 -0.984 17635 1261 1 3 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.333 0.535 17635 1262 1 3 . 1 1 11 11 PHE H H 11 9.548 9.548 8.302 1.246 17635 1263 1 3 . 1 1 12 12 VAL N N 12 127.993 127.993 125.261 2.732 17635 1264 1 3 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.566 0.392 17635 1265 1 3 . 1 1 12 12 VAL C C 12 176.965 176.965 175.021 1.944 17635 1266 1 3 . 1 1 12 12 VAL CA C 12 59.835 59.835 60.151 -0.316 17635 1267 1 3 . 1 1 12 12 VAL CB C 12 34.800 34.800 31.454 3.346 17635 1268 1 3 . 1 1 12 12 VAL H H 12 8.940 8.940 9.056 -0.116 17635 1269 1 3 . 1 1 13 13 GLN N N 13 122.289 122.289 126.678 -4.389 17635 1270 1 3 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.607 0.172 17635 1271 1 3 . 1 1 13 13 GLN C C 13 175.631 175.631 175.669 -0.038 17635 1272 1 3 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.206 -0.096 17635 1273 1 3 . 1 1 13 13 GLN CB C 13 34.132 34.132 31.079 3.053 17635 1274 1 3 . 1 1 13 13 GLN H H 13 8.747 8.747 8.223 0.524 17635 1275 1 3 . 1 1 14 14 GLY N N 14 109.212 109.212 112.730 -3.518 17635 1276 1 3 . 1 1 14 14 GLY C C 14 175.436 175.436 172.727 2.709 17635 1277 1 3 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.466 -0.036 17635 1278 1 3 . 1 1 14 14 GLY H H 14 8.236 8.236 8.369 -0.133 17635 1279 1 3 . 1 1 15 15 LEU N N 15 117.824 117.824 119.481 -1.657 17635 1280 1 3 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.737 -1.031 17635 1281 1 3 . 1 1 15 15 LEU C C 15 174.111 174.111 177.348 -3.237 17635 1282 1 3 . 1 1 15 15 LEU CA C 15 55.718 55.718 54.600 1.118 17635 1283 1 3 . 1 1 15 15 LEU CB C 15 42.433 42.433 42.289 0.143 17635 1284 1 3 . 1 1 15 15 LEU H H 15 8.442 8.442 7.457 0.985 17635 1285 1 3 . 1 1 16 16 GLY N N 16 105.063 105.063 106.682 -1.619 17635 1286 1 3 . 1 1 16 16 GLY C C 16 177.771 177.771 173.513 4.258 17635 1287 1 3 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.504 -1.410 17635 1288 1 3 . 1 1 16 16 GLY H H 16 8.006 8.006 8.044 -0.038 17635 1289 1 3 . 1 1 17 17 GLU N N 17 113.781 113.781 120.846 -7.065 17635 1290 1 3 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.535 -0.416 17635 1291 1 3 . 1 1 17 17 GLU C C 17 173.937 173.937 175.302 -1.365 17635 1292 1 3 . 1 1 17 17 GLU CA C 17 57.281 57.281 55.947 1.333 17635 1293 1 3 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.018 1.418 17635 1294 1 3 . 1 1 17 17 GLU H H 17 8.134 8.134 8.339 -0.205 17635 1295 1 3 . 1 1 18 18 ASN N N 18 116.660 116.660 115.989 0.671 17635 1296 1 3 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.619 0.322 17635 1297 1 3 . 1 1 18 18 ASN C C 18 175.900 175.900 173.585 2.315 17635 1298 1 3 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.502 -0.024 17635 1299 1 3 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.255 -0.770 17635 1300 1 3 . 1 1 18 18 ASN H H 18 8.407 8.407 7.815 0.592 17635 1301 1 3 . 1 1 19 19 VAL N N 19 118.323 118.323 121.209 -2.886 17635 1302 1 3 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.888 0.264 17635 1303 1 3 . 1 1 19 19 VAL C C 19 177.655 177.655 175.659 1.996 17635 1304 1 3 . 1 1 19 19 VAL CA C 19 61.877 61.877 61.933 -0.056 17635 1305 1 3 . 1 1 19 19 VAL CB C 19 32.513 32.513 29.292 3.221 17635 1306 1 3 . 1 1 19 19 VAL H H 19 6.855 6.855 7.826 -0.971 17635 1307 1 3 . 1 1 20 20 THR N N 20 111.636 111.636 118.105 -6.469 17635 1308 1 3 . 1 1 20 20 THR HA H 20 4.719 4.719 4.659 0.060 17635 1309 1 3 . 1 1 20 20 THR C C 20 175.266 175.266 175.080 0.186 17635 1310 1 3 . 1 1 20 20 THR CA C 20 58.698 58.698 59.703 -1.004 17635 1311 1 3 . 1 1 20 20 THR CB C 20 72.948 72.948 72.169 0.779 17635 1312 1 3 . 1 1 20 20 THR H H 20 7.328 7.328 7.626 -0.298 17635 1313 1 3 . 1 1 21 21 ILE N N 21 122.147 122.147 122.733 -0.586 17635 1314 1 3 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.762 -0.244 17635 1315 1 3 . 1 1 21 21 ILE C C 21 173.198 173.198 177.521 -4.323 17635 1316 1 3 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.400 1.373 17635 1317 1 3 . 1 1 21 21 ILE CB C 21 37.583 37.583 36.694 0.889 17635 1318 1 3 . 1 1 21 21 ILE H H 21 9.074 9.074 8.795 0.279 17635 1319 1 3 . 1 1 22 22 GLU N N 22 118.154 118.154 119.733 -1.579 17635 1320 1 3 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.071 -0.085 17635 1321 1 3 . 1 1 22 22 GLU C C 22 171.799 171.799 178.675 -6.876 17635 1322 1 3 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.490 1.123 17635 1323 1 3 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.089 0.702 17635 1324 1 3 . 1 1 22 22 GLU H H 22 8.814 8.814 8.662 0.152 17635 1325 1 3 . 1 1 23 23 SER N N 23 115.921 115.921 115.723 0.198 17635 1326 1 3 . 1 1 23 23 SER HA H 23 4.384 4.384 4.374 0.010 17635 1327 1 3 . 1 1 23 23 SER C C 23 172.447 172.447 176.994 -4.547 17635 1328 1 3 . 1 1 23 23 SER CA C 23 61.239 61.239 61.220 0.019 17635 1329 1 3 . 1 1 23 23 SER CB C 23 62.838 62.838 63.119 -0.281 17635 1330 1 3 . 1 1 23 23 SER H H 23 8.236 8.236 8.136 0.100 17635 1331 1 3 . 1 1 24 24 VAL N N 24 124.867 124.867 122.094 2.773 17635 1332 1 3 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.294 -0.546 17635 1333 1 3 . 1 1 24 24 VAL C C 24 173.016 173.016 177.843 -4.827 17635 1334 1 3 . 1 1 24 24 VAL CA C 24 67.254 67.254 65.760 1.494 17635 1335 1 3 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.206 0.327 17635 1336 1 3 . 1 1 24 24 VAL H H 24 7.973 7.973 8.498 -0.525 17635 1337 1 3 . 1 1 25 25 ALA N N 25 123.198 123.198 122.128 1.070 17635 1338 1 3 . 1 1 25 25 ALA HA H 25 3.899 3.899 3.990 -0.091 17635 1339 1 3 . 1 1 25 25 ALA C C 25 171.061 171.061 179.043 -7.982 17635 1340 1 3 . 1 1 25 25 ALA CA C 25 55.695 55.695 55.278 0.417 17635 1341 1 3 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.300 -0.562 17635 1342 1 3 . 1 1 25 25 ALA H H 25 8.695 8.695 8.604 0.091 17635 1343 1 3 . 1 1 26 26 ASP N N 26 115.503 115.503 118.323 -2.820 17635 1344 1 3 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.532 -0.209 17635 1345 1 3 . 1 1 26 26 ASP C C 26 173.108 173.108 177.594 -4.486 17635 1346 1 3 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.786 0.537 17635 1347 1 3 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.236 -0.184 17635 1348 1 3 . 1 1 26 26 ASP H H 26 8.312 8.312 7.881 0.431 17635 1349 1 3 . 1 1 27 27 TYR N N 27 119.224 119.224 117.580 1.644 17635 1350 1 3 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.518 -0.318 17635 1351 1 3 . 1 1 27 27 TYR C C 27 172.908 172.908 176.171 -3.263 17635 1352 1 3 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.083 1.933 17635 1353 1 3 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.386 0.546 17635 1354 1 3 . 1 1 27 27 TYR H H 27 7.533 7.533 7.740 -0.207 17635 1355 1 3 . 1 1 28 28 PHE N N 28 112.595 112.595 119.357 -6.762 17635 1356 1 3 . 1 1 28 28 PHE HA H 28 4.330 4.330 3.981 0.349 17635 1357 1 3 . 1 1 28 28 PHE C C 28 173.082 173.082 175.295 -2.213 17635 1358 1 3 . 1 1 28 28 PHE CA C 28 61.784 61.784 57.786 3.998 17635 1359 1 3 . 1 1 28 28 PHE CB C 28 40.003 40.003 39.180 0.823 17635 1360 1 3 . 1 1 28 28 PHE H H 28 7.974 7.974 8.128 -0.154 17635 1361 1 3 . 1 1 29 29 LYS N N 29 118.820 118.820 117.356 1.464 17635 1362 1 3 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.827 0.090 17635 1363 1 3 . 1 1 29 29 LYS C C 29 173.682 173.682 176.463 -2.781 17635 1364 1 3 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.162 2.118 17635 1365 1 3 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.259 0.032 17635 1366 1 3 . 1 1 29 29 LYS H H 29 8.325 8.325 7.762 0.563 17635 1367 1 3 . 1 1 30 30 GLN N N 30 116.232 116.232 117.989 -1.757 17635 1368 1 3 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.224 -0.089 17635 1369 1 3 . 1 1 30 30 GLN C C 30 173.790 173.790 176.592 -2.802 17635 1370 1 3 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.497 0.049 17635 1371 1 3 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.937 0.961 17635 1372 1 3 . 1 1 30 30 GLN H H 30 7.518 7.518 8.147 -0.629 17635 1373 1 3 . 1 1 31 31 ILE N N 31 116.489 116.489 119.135 -2.646 17635 1374 1 3 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.021 0.218 17635 1375 1 3 . 1 1 31 31 ILE C C 31 175.599 175.599 175.336 0.263 17635 1376 1 3 . 1 1 31 31 ILE CA C 31 58.221 58.221 60.862 -2.641 17635 1377 1 3 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.953 1.381 17635 1378 1 3 . 1 1 31 31 ILE H H 31 7.809 7.809 7.858 -0.049 17635 1379 1 3 . 1 1 32 32 GLY N N 32 107.416 107.416 105.962 1.454 17635 1380 1 3 . 1 1 32 32 GLY C C 32 180.182 180.182 171.895 8.287 17635 1381 1 3 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.307 0.687 17635 1382 1 3 . 1 1 32 32 GLY H H 32 7.344 7.344 7.357 -0.013 17635 1383 1 3 . 1 1 33 33 ILE N N 33 117.784 117.784 121.006 -3.222 17635 1384 1 3 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.457 -0.368 17635 1385 1 3 . 1 1 33 33 ILE C C 33 173.301 173.301 175.055 -1.754 17635 1386 1 3 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.699 0.942 17635 1387 1 3 . 1 1 33 33 ILE CB C 33 38.659 38.659 38.912 -0.253 17635 1388 1 3 . 1 1 33 33 ILE H H 33 8.173 8.173 8.343 -0.170 17635 1389 1 3 . 1 1 34 34 ILE N N 34 131.781 131.781 128.483 3.298 17635 1390 1 3 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.296 -0.509 17635 1391 1 3 . 1 1 34 34 ILE C C 34 174.663 174.663 176.328 -1.665 17635 1392 1 3 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.857 0.513 17635 1393 1 3 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.330 -0.335 17635 1394 1 3 . 1 1 34 34 ILE H H 34 8.687 8.687 8.858 -0.171 17635 1395 1 3 . 1 1 35 35 LYS N N 35 130.372 130.372 129.511 0.861 17635 1396 1 3 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.097 -0.013 17635 1397 1 3 . 1 1 35 35 LYS C C 35 175.376 175.376 176.350 -0.974 17635 1398 1 3 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.983 0.489 17635 1399 1 3 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.341 2.323 17635 1400 1 3 . 1 1 35 35 LYS H H 35 8.680 8.680 8.677 0.003 17635 1401 1 3 . 1 1 36 36 THR N N 36 118.312 118.312 118.353 -0.041 17635 1402 1 3 . 1 1 36 36 THR HA H 36 4.415 4.415 4.234 0.181 17635 1403 1 3 . 1 1 36 36 THR C C 36 176.394 176.394 174.065 2.329 17635 1404 1 3 . 1 1 36 36 THR CA C 36 61.340 61.340 63.984 -2.644 17635 1405 1 3 . 1 1 36 36 THR CB C 36 70.809 70.809 69.404 1.405 17635 1406 1 3 . 1 1 36 36 THR H H 36 8.456 8.456 8.195 0.261 17635 1407 1 3 . 1 1 37 37 ASN N N 37 124.092 124.092 121.746 2.346 17635 1408 1 3 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.854 -0.324 17635 1409 1 3 . 1 1 37 37 ASN C C 37 174.235 174.235 175.808 -1.573 17635 1410 1 3 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.818 1.246 17635 1411 1 3 . 1 1 37 37 ASN CB C 37 38.927 38.927 40.772 -1.845 17635 1412 1 3 . 1 1 37 37 ASN H H 37 8.794 8.794 8.741 0.053 17635 1413 1 3 . 1 1 38 38 LYS N N 38 127.969 127.969 124.732 3.237 17635 1414 1 3 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.164 -0.160 17635 1415 1 3 . 1 1 38 38 LYS C C 38 172.702 172.702 177.068 -4.366 17635 1416 1 3 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.198 0.260 17635 1417 1 3 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.022 0.145 17635 1418 1 3 . 1 1 38 38 LYS H H 38 8.962 8.962 8.641 0.321 17635 1419 1 3 . 1 1 39 39 LYS N N 39 117.413 117.413 119.559 -2.146 17635 1420 1 3 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.245 0.013 17635 1421 1 3 . 1 1 39 39 LYS C C 39 172.261 172.261 177.176 -4.915 17635 1422 1 3 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.452 -0.133 17635 1423 1 3 . 1 1 39 39 LYS CB C 39 32.797 32.797 33.048 -0.251 17635 1424 1 3 . 1 1 39 39 LYS H H 39 8.314 8.314 8.830 -0.516 17635 1425 1 3 . 1 1 40 40 THR N N 40 105.547 105.547 107.413 -1.866 17635 1426 1 3 . 1 1 40 40 THR HA H 40 4.465 4.465 4.447 0.018 17635 1427 1 3 . 1 1 40 40 THR C C 40 174.021 174.021 175.795 -1.774 17635 1428 1 3 . 1 1 40 40 THR CA C 40 61.260 61.260 61.794 -0.534 17635 1429 1 3 . 1 1 40 40 THR CB C 40 70.997 70.997 70.821 0.176 17635 1430 1 3 . 1 1 40 40 THR H H 40 7.422 7.422 7.572 -0.150 17635 1431 1 3 . 1 1 41 41 GLY N N 41 111.631 111.631 111.632 -0.001 17635 1432 1 3 . 1 1 41 41 GLY C C 41 176.727 176.727 173.658 3.069 17635 1433 1 3 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.168 0.562 17635 1434 1 3 . 1 1 41 41 GLY H H 41 8.644 8.644 8.541 0.103 17635 1435 1 3 . 1 1 42 42 GLN N N 42 118.894 118.894 120.001 -1.107 17635 1436 1 3 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.847 -0.178 17635 1437 1 3 . 1 1 42 42 GLN C C 42 177.178 177.178 173.617 3.561 17635 1438 1 3 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.522 1.059 17635 1439 1 3 . 1 1 42 42 GLN CB C 42 29.230 29.230 30.596 -1.366 17635 1440 1 3 . 1 1 42 42 GLN H H 42 7.662 7.662 7.770 -0.108 17635 1441 1 3 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.401 0.194 17635 1442 1 3 . 1 1 43 43 PRO C C 43 172.629 172.629 176.211 -3.582 17635 1443 1 3 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.575 -0.753 17635 1444 1 3 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.083 0.613 17635 1445 1 3 . 1 1 44 44 MET N N 44 124.162 124.162 121.325 2.837 17635 1446 1 3 . 1 1 44 44 MET HA H 44 4.432 4.432 4.573 -0.141 17635 1447 1 3 . 1 1 44 44 MET C C 44 176.474 176.474 174.769 1.705 17635 1448 1 3 . 1 1 44 44 MET CA C 44 55.419 55.419 55.149 0.270 17635 1449 1 3 . 1 1 44 44 MET CB C 44 30.555 30.555 34.853 -4.298 17635 1450 1 3 . 1 1 44 44 MET H H 44 8.874 8.874 8.658 0.216 17635 1451 1 3 . 1 1 45 45 ILE N N 45 126.237 126.237 122.341 3.896 17635 1452 1 3 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.483 0.319 17635 1453 1 3 . 1 1 45 45 ILE C C 45 176.415 176.415 174.456 1.959 17635 1454 1 3 . 1 1 45 45 ILE CA C 45 59.216 59.216 59.798 -0.582 17635 1455 1 3 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.087 0.139 17635 1456 1 3 . 1 1 45 45 ILE H H 45 7.730 7.730 8.344 -0.614 17635 1457 1 3 . 1 1 46 46 ASN N N 46 124.735 124.735 123.639 1.096 17635 1458 1 3 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.920 0.021 17635 1459 1 3 . 1 1 46 46 ASN C C 46 176.836 176.836 173.681 3.155 17635 1460 1 3 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.322 -0.760 17635 1461 1 3 . 1 1 46 46 ASN CB C 46 40.470 40.470 39.974 0.496 17635 1462 1 3 . 1 1 46 46 ASN H H 46 8.384 8.384 8.779 -0.395 17635 1463 1 3 . 1 1 47 47 LEU N N 47 122.487 122.487 119.580 2.907 17635 1464 1 3 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.881 -0.166 17635 1465 1 3 . 1 1 47 47 LEU C C 47 174.190 174.190 176.654 -2.464 17635 1466 1 3 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.458 -1.126 17635 1467 1 3 . 1 1 47 47 LEU CB C 47 42.277 42.277 45.024 -2.747 17635 1468 1 3 . 1 1 47 47 LEU H H 47 8.594 8.594 8.245 0.349 17635 1469 1 3 . 1 1 48 48 TYR N N 48 121.842 121.842 123.259 -1.417 17635 1470 1 3 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.524 0.243 17635 1471 1 3 . 1 1 48 48 TYR C C 48 173.649 173.649 176.021 -2.372 17635 1472 1 3 . 1 1 48 48 TYR CA C 48 57.894 57.894 58.116 -0.222 17635 1473 1 3 . 1 1 48 48 TYR CB C 48 39.199 39.199 36.572 2.627 17635 1474 1 3 . 1 1 48 48 TYR H H 48 7.666 7.666 9.221 -1.555 17635 1475 1 3 . 1 1 49 49 THR N N 49 116.554 116.554 114.334 2.220 17635 1476 1 3 . 1 1 49 49 THR HA H 49 4.806 4.806 4.346 0.460 17635 1477 1 3 . 1 1 49 49 THR C C 49 176.654 176.654 174.249 2.405 17635 1478 1 3 . 1 1 49 49 THR CA C 49 60.693 60.693 59.923 0.770 17635 1479 1 3 . 1 1 49 49 THR CB C 49 71.437 71.437 70.213 1.224 17635 1480 1 3 . 1 1 49 49 THR H H 49 8.965 8.965 7.781 1.184 17635 1481 1 3 . 1 1 50 50 ASP N N 50 123.826 123.826 122.340 1.486 17635 1482 1 3 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.491 0.133 17635 1483 1 3 . 1 1 50 50 ASP C C 50 173.380 173.380 176.924 -3.544 17635 1484 1 3 . 1 1 50 50 ASP CA C 50 54.088 54.088 55.642 -1.554 17635 1485 1 3 . 1 1 50 50 ASP CB C 50 42.867 42.867 40.372 2.495 17635 1486 1 3 . 1 1 50 50 ASP H H 50 8.939 8.939 8.480 0.459 17635 1487 1 3 . 1 1 51 51 ARG N N 51 127.794 127.794 124.209 3.585 17635 1488 1 3 . 1 1 51 51 ARG HA H 51 4.045 4.045 3.806 0.239 17635 1489 1 3 . 1 1 51 51 ARG C C 51 173.101 173.101 176.150 -3.049 17635 1490 1 3 . 1 1 51 51 ARG CA C 51 58.562 58.562 59.080 -0.518 17635 1491 1 3 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.474 0.693 17635 1492 1 3 . 1 1 51 51 ARG H H 51 8.958 8.958 8.545 0.413 17635 1493 1 3 . 1 1 52 52 GLU N N 52 117.542 117.542 114.553 2.989 17635 1494 1 3 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.398 -0.120 17635 1495 1 3 . 1 1 52 52 GLU C C 52 172.201 172.201 177.162 -4.961 17635 1496 1 3 . 1 1 52 52 GLU CA C 52 58.524 58.524 56.299 2.225 17635 1497 1 3 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.710 -0.433 17635 1498 1 3 . 1 1 52 52 GLU H H 52 8.561 8.561 8.588 -0.027 17635 1499 1 3 . 1 1 53 53 THR N N 53 107.065 107.065 115.018 -7.953 17635 1500 1 3 . 1 1 53 53 THR HA H 53 4.436 4.436 4.058 0.378 17635 1501 1 3 . 1 1 53 53 THR C C 53 173.851 173.851 176.010 -2.159 17635 1502 1 3 . 1 1 53 53 THR CA C 53 61.944 61.944 64.744 -2.800 17635 1503 1 3 . 1 1 53 53 THR CB C 53 71.197 71.197 69.055 2.142 17635 1504 1 3 . 1 1 53 53 THR H H 53 8.087 8.087 7.886 0.201 17635 1505 1 3 . 1 1 54 54 GLY N N 54 111.295 111.295 108.282 3.013 17635 1506 1 3 . 1 1 54 54 GLY C C 54 176.747 176.747 175.542 1.205 17635 1507 1 3 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.785 -0.082 17635 1508 1 3 . 1 1 54 54 GLY H H 54 8.423 8.423 7.685 0.738 17635 1509 1 3 . 1 1 55 55 LYS N N 55 119.673 119.673 119.548 0.125 17635 1510 1 3 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.056 0.297 17635 1511 1 3 . 1 1 55 55 LYS C C 55 173.854 173.854 176.579 -2.725 17635 1512 1 3 . 1 1 55 55 LYS CA C 55 55.842 55.842 56.672 -0.830 17635 1513 1 3 . 1 1 55 55 LYS CB C 55 33.821 33.821 32.490 1.331 17635 1514 1 3 . 1 1 55 55 LYS H H 55 7.767 7.767 8.329 -0.562 17635 1515 1 3 . 1 1 56 56 LEU N N 56 122.426 122.426 115.496 6.930 17635 1516 1 3 . 1 1 56 56 LEU HA H 56 4.356 4.356 3.982 0.374 17635 1517 1 3 . 1 1 56 56 LEU C C 56 172.534 172.534 174.566 -2.032 17635 1518 1 3 . 1 1 56 56 LEU CA C 56 56.255 56.255 55.766 0.489 17635 1519 1 3 . 1 1 56 56 LEU CB C 56 41.654 41.654 41.373 0.281 17635 1520 1 3 . 1 1 56 56 LEU H H 56 8.768 8.768 7.788 0.980 17635 1521 1 3 . 1 1 57 57 LYS N N 57 118.264 118.264 119.697 -1.433 17635 1522 1 3 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.520 -0.232 17635 1523 1 3 . 1 1 57 57 LYS C C 57 173.648 173.648 175.168 -1.520 17635 1524 1 3 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.358 -0.095 17635 1525 1 3 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.817 1.245 17635 1526 1 3 . 1 1 57 57 LYS H H 57 8.012 8.012 8.108 -0.096 17635 1527 1 3 . 1 1 58 58 GLY N N 58 108.514 108.514 109.355 -0.841 17635 1528 1 3 . 1 1 58 58 GLY C C 58 177.876 177.876 172.639 5.237 17635 1529 1 3 . 1 1 58 58 GLY CA C 58 46.364 46.364 46.093 0.271 17635 1530 1 3 . 1 1 58 58 GLY H H 58 8.334 8.334 7.971 0.363 17635 1531 1 3 . 1 1 59 59 GLU N N 59 116.119 116.119 119.115 -2.996 17635 1532 1 3 . 1 1 59 59 GLU HA H 59 5.521 5.521 4.651 0.870 17635 1533 1 3 . 1 1 59 59 GLU C C 59 173.860 173.860 173.684 0.176 17635 1534 1 3 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.258 -2.233 17635 1535 1 3 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.248 1.056 17635 1536 1 3 . 1 1 59 59 GLU H H 59 7.202 7.202 7.831 -0.629 17635 1537 1 3 . 1 1 60 60 ALA N N 60 123.607 123.607 120.882 2.725 17635 1538 1 3 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.980 0.627 17635 1539 1 3 . 1 1 60 60 ALA C C 60 173.923 173.923 175.131 -1.208 17635 1540 1 3 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.716 -0.773 17635 1541 1 3 . 1 1 60 60 ALA CB C 60 24.059 24.059 22.889 1.170 17635 1542 1 3 . 1 1 60 60 ALA H H 60 8.930 8.930 9.214 -0.284 17635 1543 1 3 . 1 1 61 61 THR N N 61 108.384 108.384 114.667 -6.283 17635 1544 1 3 . 1 1 61 61 THR HA H 61 5.743 5.743 4.476 1.267 17635 1545 1 3 . 1 1 61 61 THR C C 61 176.172 176.172 173.417 2.755 17635 1546 1 3 . 1 1 61 61 THR CA C 61 59.625 59.625 60.317 -0.692 17635 1547 1 3 . 1 1 61 61 THR CB C 61 71.224 71.224 69.678 1.546 17635 1548 1 3 . 1 1 61 61 THR H H 61 8.452 8.452 8.538 -0.086 17635 1549 1 3 . 1 1 62 62 VAL N N 62 120.200 120.200 126.736 -6.536 17635 1550 1 3 . 1 1 62 62 VAL HA H 62 4.244 4.244 3.831 0.413 17635 1551 1 3 . 1 1 62 62 VAL C C 62 175.994 175.994 174.416 1.578 17635 1552 1 3 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.023 0.403 17635 1553 1 3 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.561 2.124 17635 1554 1 3 . 1 1 62 62 VAL H H 62 8.071 8.071 7.889 0.182 17635 1555 1 3 . 1 1 63 63 SER N N 63 121.689 121.689 122.533 -0.844 17635 1556 1 3 . 1 1 63 63 SER HA H 63 5.261 5.261 4.548 0.713 17635 1557 1 3 . 1 1 63 63 SER C C 63 177.943 177.943 173.704 4.239 17635 1558 1 3 . 1 1 63 63 SER CA C 63 57.662 57.662 56.654 1.008 17635 1559 1 3 . 1 1 63 63 SER CB C 63 64.427 64.427 62.943 1.484 17635 1560 1 3 . 1 1 63 63 SER H H 63 7.695 7.695 7.994 -0.299 17635 1561 1 3 . 1 1 64 64 PHE N N 64 122.640 122.640 125.710 -3.070 17635 1562 1 3 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.805 0.049 17635 1563 1 3 . 1 1 64 64 PHE C C 64 174.605 174.605 175.771 -1.166 17635 1564 1 3 . 1 1 64 64 PHE CA C 64 58.204 58.204 58.399 -0.195 17635 1565 1 3 . 1 1 64 64 PHE CB C 64 41.976 41.976 41.135 0.841 17635 1566 1 3 . 1 1 64 64 PHE H H 64 9.025 9.025 8.388 0.637 17635 1567 1 3 . 1 1 65 65 ASP N N 65 119.943 119.943 119.362 0.581 17635 1568 1 3 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.641 -0.206 17635 1569 1 3 . 1 1 65 65 ASP C C 65 174.396 174.396 175.798 -1.402 17635 1570 1 3 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.168 2.274 17635 1571 1 3 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.179 -0.145 17635 1572 1 3 . 1 1 65 65 ASP H H 65 8.512 8.512 8.998 -0.486 17635 1573 1 3 . 1 1 66 66 ASP N N 66 116.125 116.125 119.438 -3.313 17635 1574 1 3 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.093 0.306 17635 1575 1 3 . 1 1 66 66 ASP C C 66 175.936 175.936 174.987 0.949 17635 1576 1 3 . 1 1 66 66 ASP CA C 66 50.793 50.793 50.752 0.041 17635 1577 1 3 . 1 1 66 66 ASP CB C 66 42.919 42.919 43.543 -0.624 17635 1578 1 3 . 1 1 66 66 ASP H H 66 8.323 8.323 7.903 0.420 17635 1579 1 3 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.622 -0.172 17635 1580 1 3 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.387 0.537 17635 1581 1 3 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.607 -0.777 17635 1582 1 3 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.332 0.087 17635 1583 1 3 . 1 1 68 68 PRO C C 68 171.345 171.345 178.749 -7.404 17635 1584 1 3 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.853 0.382 17635 1585 1 3 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.122 -0.125 17635 1586 1 3 . 1 1 69 69 SER N N 69 114.544 114.544 114.651 -0.107 17635 1587 1 3 . 1 1 69 69 SER HA H 69 4.036 4.036 3.988 0.048 17635 1588 1 3 . 1 1 69 69 SER C C 69 176.535 176.535 175.908 0.627 17635 1589 1 3 . 1 1 69 69 SER CA C 69 61.837 61.837 61.133 0.704 17635 1590 1 3 . 1 1 69 69 SER CB C 69 62.773 62.773 62.419 0.354 17635 1591 1 3 . 1 1 69 69 SER H H 69 8.004 8.004 7.925 0.079 17635 1592 1 3 . 1 1 70 70 ALA N N 70 122.649 122.649 124.902 -2.253 17635 1593 1 3 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.821 -0.228 17635 1594 1 3 . 1 1 70 70 ALA C C 70 172.686 172.686 179.288 -6.602 17635 1595 1 3 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.221 -0.185 17635 1596 1 3 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.287 -0.423 17635 1597 1 3 . 1 1 70 70 ALA H H 70 7.383 7.383 7.538 -0.155 17635 1598 1 3 . 1 1 71 71 LYS N N 71 116.308 116.308 119.147 -2.839 17635 1599 1 3 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.644 0.131 17635 1600 1 3 . 1 1 71 71 LYS C C 71 172.333 172.333 178.581 -6.248 17635 1601 1 3 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.420 0.582 17635 1602 1 3 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.363 0.079 17635 1603 1 3 . 1 1 71 71 LYS H H 71 7.159 7.159 7.527 -0.368 17635 1604 1 3 . 1 1 72 72 ALA N N 72 119.806 119.806 120.640 -0.834 17635 1605 1 3 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.024 0.142 17635 1606 1 3 . 1 1 72 72 ALA C C 72 170.530 170.530 179.728 -9.198 17635 1607 1 3 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.952 -0.237 17635 1608 1 3 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.970 -0.149 17635 1609 1 3 . 1 1 72 72 ALA H H 72 7.924 7.924 7.977 -0.053 17635 1610 1 3 . 1 1 73 73 ALA N N 73 120.524 120.524 121.170 -0.646 17635 1611 1 3 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.179 0.100 17635 1612 1 3 . 1 1 73 73 ALA C C 73 171.039 171.039 179.616 -8.577 17635 1613 1 3 . 1 1 73 73 ALA CA C 73 55.379 55.379 55.016 0.363 17635 1614 1 3 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.727 0.404 17635 1615 1 3 . 1 1 73 73 ALA H H 73 8.104 8.104 7.448 0.656 17635 1616 1 3 . 1 1 74 74 ILE N N 74 119.875 119.875 118.101 1.774 17635 1617 1 3 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.814 -0.400 17635 1618 1 3 . 1 1 74 74 ILE C C 74 172.435 172.435 177.715 -5.280 17635 1619 1 3 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.189 0.655 17635 1620 1 3 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.798 0.945 17635 1621 1 3 . 1 1 74 74 ILE H H 74 7.574 7.574 7.766 -0.192 17635 1622 1 3 . 1 1 75 75 ASP N N 75 117.867 117.867 118.131 -0.264 17635 1623 1 3 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.417 -0.106 17635 1624 1 3 . 1 1 75 75 ASP C C 75 172.054 172.054 176.762 -4.708 17635 1625 1 3 . 1 1 75 75 ASP CA C 75 57.161 57.161 57.001 0.161 17635 1626 1 3 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.405 -0.874 17635 1627 1 3 . 1 1 75 75 ASP H H 75 7.937 7.937 8.012 -0.075 17635 1628 1 3 . 1 1 76 76 TRP N N 76 117.313 117.313 120.505 -3.192 17635 1629 1 3 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.338 0.018 17635 1630 1 3 . 1 1 76 76 TRP C C 76 173.272 173.272 177.516 -4.244 17635 1631 1 3 . 1 1 76 76 TRP CA C 76 59.462 59.462 59.106 0.356 17635 1632 1 3 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.708 1.069 17635 1633 1 3 . 1 1 76 76 TRP H H 76 8.475 8.475 7.446 1.029 17635 1634 1 3 . 1 1 77 77 PHE N N 77 112.019 112.019 117.681 -5.662 17635 1635 1 3 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.488 0.160 17635 1636 1 3 . 1 1 77 77 PHE C C 77 173.747 173.747 175.792 -2.045 17635 1637 1 3 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.282 -0.361 17635 1638 1 3 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.748 1.982 17635 1639 1 3 . 1 1 77 77 PHE H H 77 8.488 8.488 7.561 0.927 17635 1640 1 3 . 1 1 78 78 ASP N N 78 118.408 118.408 119.147 -0.739 17635 1641 1 3 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.543 -0.079 17635 1642 1 3 . 1 1 78 78 ASP C C 78 172.542 172.542 175.382 -2.840 17635 1643 1 3 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.517 3.173 17635 1644 1 3 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.510 1.376 17635 1645 1 3 . 1 1 78 78 ASP H H 78 7.978 7.978 8.831 -0.853 17635 1646 1 3 . 1 1 79 79 GLY N N 79 115.548 115.548 102.679 12.869 17635 1647 1 3 . 1 1 79 79 GLY C C 79 175.680 175.680 173.145 2.535 17635 1648 1 3 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.862 1.210 17635 1649 1 3 . 1 1 79 79 GLY H H 79 8.615 8.615 8.596 0.019 17635 1650 1 3 . 1 1 80 80 LYS N N 80 120.271 120.271 119.081 1.190 17635 1651 1 3 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.610 -0.148 17635 1652 1 3 . 1 1 80 80 LYS C C 80 175.853 175.853 174.736 1.117 17635 1653 1 3 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.399 -0.249 17635 1654 1 3 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.519 -2.093 17635 1655 1 3 . 1 1 80 80 LYS H H 80 8.013 8.013 7.987 0.026 17635 1656 1 3 . 1 1 81 81 GLU N N 81 115.765 115.765 119.417 -3.652 17635 1657 1 3 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.012 -0.314 17635 1658 1 3 . 1 1 81 81 GLU C C 81 173.263 173.263 175.384 -2.121 17635 1659 1 3 . 1 1 81 81 GLU CA C 81 55.924 55.924 54.830 1.094 17635 1660 1 3 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.110 0.932 17635 1661 1 3 . 1 1 81 81 GLU H H 81 8.201 8.201 8.514 -0.313 17635 1662 1 3 . 1 1 82 82 PHE N N 82 127.080 127.080 126.665 0.415 17635 1663 1 3 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.270 0.226 17635 1664 1 3 . 1 1 82 82 PHE C C 82 175.349 175.349 175.944 -0.595 17635 1665 1 3 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.086 0.630 17635 1666 1 3 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.087 2.907 17635 1667 1 3 . 1 1 82 82 PHE H H 82 9.162 9.162 9.018 0.144 17635 1668 1 3 . 1 1 83 83 SER N N 83 125.136 125.136 119.821 5.315 17635 1669 1 3 . 1 1 83 83 SER HA H 83 3.803 3.803 4.126 -0.323 17635 1670 1 3 . 1 1 83 83 SER C C 83 175.543 175.543 174.050 1.493 17635 1671 1 3 . 1 1 83 83 SER CA C 83 58.371 58.371 59.382 -1.010 17635 1672 1 3 . 1 1 83 83 SER CB C 83 62.519 62.519 62.246 0.273 17635 1673 1 3 . 1 1 83 83 SER H H 83 9.193 9.193 8.945 0.248 17635 1674 1 3 . 1 1 84 84 GLY N N 84 103.581 103.581 106.840 -3.259 17635 1675 1 3 . 1 1 84 84 GLY C C 84 177.188 177.188 173.787 3.401 17635 1676 1 3 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.901 0.151 17635 1677 1 3 . 1 1 84 84 GLY H H 84 8.446 8.446 8.205 0.241 17635 1678 1 3 . 1 1 85 85 ASN N N 85 119.051 119.051 121.478 -2.427 17635 1679 1 3 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.225 0.109 17635 1680 1 3 . 1 1 85 85 ASN C C 85 178.020 178.020 172.635 5.385 17635 1681 1 3 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.108 -0.637 17635 1682 1 3 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.971 2.146 17635 1683 1 3 . 1 1 85 85 ASN H H 85 7.762 7.762 8.087 -0.325 17635 1684 1 3 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.241 -0.574 17635 1685 1 3 . 1 1 86 86 PRO C C 86 173.474 173.474 176.390 -2.916 17635 1686 1 3 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.652 0.058 17635 1687 1 3 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.741 -0.871 17635 1688 1 3 . 1 1 87 87 ILE N N 87 117.270 117.270 115.564 1.706 17635 1689 1 3 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.428 -0.282 17635 1690 1 3 . 1 1 87 87 ILE C C 87 174.495 174.495 174.827 -0.332 17635 1691 1 3 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.574 0.917 17635 1692 1 3 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.761 -1.090 17635 1693 1 3 . 1 1 87 87 ILE H H 87 8.469 8.469 9.269 -0.800 17635 1694 1 3 . 1 1 88 88 LYS N N 88 122.271 122.271 120.138 2.133 17635 1695 1 3 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.787 0.405 17635 1696 1 3 . 1 1 88 88 LYS C C 88 174.393 174.393 175.328 -0.935 17635 1697 1 3 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.647 -0.509 17635 1698 1 3 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.328 0.721 17635 1699 1 3 . 1 1 88 88 LYS H H 88 8.353 8.353 8.314 0.039 17635 1700 1 3 . 1 1 89 89 VAL N N 89 125.661 125.661 125.190 0.471 17635 1701 1 3 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.747 0.216 17635 1702 1 3 . 1 1 89 89 VAL C C 89 177.160 177.160 176.225 0.935 17635 1703 1 3 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.545 -1.184 17635 1704 1 3 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.917 1.853 17635 1705 1 3 . 1 1 89 89 VAL H H 89 9.414 9.414 8.615 0.799 17635 1706 1 3 . 1 1 90 90 SER N N 90 119.538 119.538 121.106 -1.568 17635 1707 1 3 . 1 1 90 90 SER HA H 90 4.710 4.710 4.763 -0.053 17635 1708 1 3 . 1 1 90 90 SER C C 90 176.533 176.533 173.680 2.853 17635 1709 1 3 . 1 1 90 90 SER CA C 90 56.936 56.936 57.077 -0.141 17635 1710 1 3 . 1 1 90 90 SER CB C 90 66.470 66.470 66.151 0.319 17635 1711 1 3 . 1 1 90 90 SER H H 90 8.945 8.945 8.277 0.668 17635 1712 1 3 . 1 1 91 91 PHE N N 91 120.115 120.115 123.781 -3.666 17635 1713 1 3 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.517 0.156 17635 1714 1 3 . 1 1 91 91 PHE C C 91 173.349 173.349 175.073 -1.724 17635 1715 1 3 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.495 4.660 17635 1716 1 3 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.627 1.876 17635 1717 1 3 . 1 1 91 91 PHE H H 91 8.919 8.919 8.559 0.360 17635 1718 1 3 . 1 1 92 92 ALA N N 92 124.386 124.386 123.976 0.410 17635 1719 1 3 . 1 1 92 92 ALA HA H 92 4.356 4.356 3.796 0.560 17635 1720 1 3 . 1 1 92 92 ALA C C 92 172.984 172.984 175.972 -2.988 17635 1721 1 3 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.840 -0.742 17635 1722 1 3 . 1 1 92 92 ALA CB C 92 19.406 19.406 19.262 0.144 17635 1723 1 3 . 1 1 92 92 ALA H H 92 8.563 8.563 7.667 0.896 17635 1724 1 3 . 1 1 93 93 THR N N 93 116.073 116.073 111.331 4.742 17635 1725 1 3 . 1 1 93 93 THR HA H 93 4.208 4.208 3.720 0.488 17635 1726 1 3 . 1 1 93 93 THR C C 93 176.032 176.032 174.042 1.990 17635 1727 1 3 . 1 1 93 93 THR CA C 93 62.255 62.255 63.696 -1.441 17635 1728 1 3 . 1 1 93 93 THR CB C 93 69.708 69.708 69.084 0.624 17635 1729 1 3 . 1 1 93 93 THR H H 93 8.312 8.312 7.718 0.594 17635 1730 1 3 . 1 1 94 94 ARG N N 94 124.359 124.359 122.353 2.006 17635 1731 1 3 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.439 -0.102 17635 1732 1 3 . 1 1 94 94 ARG C C 94 174.426 174.426 176.122 -1.696 17635 1733 1 3 . 1 1 94 94 ARG CA C 94 56.055 56.055 55.688 0.367 17635 1734 1 3 . 1 1 94 94 ARG CB C 94 30.911 30.911 28.898 2.013 17635 1735 1 3 . 1 1 94 94 ARG H H 94 8.493 8.493 8.674 -0.181 17635 1736 1 3 . 1 1 95 95 ARG N N 95 122.515 122.515 124.318 -1.803 17635 1737 1 3 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.198 0.030 17635 1738 1 3 . 1 1 95 95 ARG C C 95 174.306 174.306 176.320 -2.014 17635 1739 1 3 . 1 1 95 95 ARG CA C 95 56.142 56.142 57.040 -0.898 17635 1740 1 3 . 1 1 95 95 ARG CB C 95 30.966 30.966 30.106 0.860 17635 1741 1 3 . 1 1 95 95 ARG H H 95 8.343 8.343 8.263 0.080 17635 1742 1 3 . 1 1 96 96 ALA N N 96 125.127 125.127 123.407 1.720 17635 1743 1 3 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.398 -0.189 17635 1744 1 3 . 1 1 96 96 ALA C C 96 173.226 173.226 176.515 -3.289 17635 1745 1 3 . 1 1 96 96 ALA CA C 96 52.770 52.770 51.984 0.786 17635 1746 1 3 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.573 -0.380 17635 1747 1 3 . 1 1 96 96 ALA H H 96 8.402 8.402 8.058 0.344 17635 1748 1 3 . 1 1 97 97 ASP N N 97 118.483 118.483 121.330 -2.847 17635 1749 1 3 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.784 -0.286 17635 1750 1 3 . 1 1 97 97 ASP C C 97 174.302 174.302 175.760 -1.458 17635 1751 1 3 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.053 0.038 17635 1752 1 3 . 1 1 97 97 ASP CB C 97 40.907 40.907 43.866 -2.959 17635 1753 1 3 . 1 1 97 97 ASP H H 97 8.206 8.206 8.460 -0.254 17635 1754 1 3 . 1 1 98 98 PHE N N 98 120.321 120.321 119.857 0.464 17635 1755 1 3 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.187 0.303 17635 1756 1 3 . 1 1 98 98 PHE C C 98 174.878 174.878 173.955 0.923 17635 1757 1 3 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.414 -0.254 17635 1758 1 3 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.686 0.617 17635 1759 1 3 . 1 1 98 98 PHE H H 98 7.990 7.990 8.474 -0.484 17635 1760 1 3 . 1 1 99 99 ASN N N 99 120.016 120.016 118.688 1.328 17635 1761 1 3 . 1 1 99 99 ASN HA H 99 4.609 4.609 5.036 -0.427 17635 1762 1 3 . 1 1 99 99 ASN C C 99 175.348 175.348 173.697 1.651 17635 1763 1 3 . 1 1 99 99 ASN CA C 99 53.313 53.313 52.668 0.645 17635 1764 1 3 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.597 -0.870 17635 1765 1 3 . 1 1 99 99 ASN H H 99 8.336 8.336 8.063 0.273 17635 1766 1 3 . 1 1 100 100 ARG N N 100 121.374 121.374 123.692 -2.318 17635 1767 1 3 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.763 -0.490 17635 1768 1 3 . 1 1 100 100 ARG C C 100 173.627 173.627 174.959 -1.332 17635 1769 1 3 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.765 0.727 17635 1770 1 3 . 1 1 100 100 ARG CB C 100 30.519 30.519 32.539 -2.020 17635 1771 1 3 . 1 1 100 100 ARG H H 100 8.181 8.181 8.278 -0.097 17635 1772 1 3 . 1 1 101 101 GLY N N 101 109.586 109.586 109.782 -0.196 17635 1773 1 3 . 1 1 101 101 GLY C C 101 175.739 175.739 174.591 1.148 17635 1774 1 3 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.369 1.011 17635 1775 1 3 . 1 1 101 101 GLY H H 101 8.413 8.413 8.588 -0.175 17635 1776 1 3 . 1 1 102 102 GLY N N 102 108.692 108.692 107.106 1.586 17635 1777 1 3 . 1 1 102 102 GLY C C 102 176.286 176.286 174.100 2.186 17635 1778 1 3 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.992 0.346 17635 1779 1 3 . 1 1 102 102 GLY H H 102 8.281 8.281 8.243 0.038 17635 1780 1 3 . 1 1 103 103 GLY N N 103 108.844 108.844 110.721 -1.877 17635 1781 1 3 . 1 1 103 103 GLY C C 103 175.798 175.798 174.345 1.453 17635 1782 1 3 . 1 1 103 103 GLY CA C 103 45.346 45.346 45.190 0.156 17635 1783 1 3 . 1 1 103 103 GLY H H 103 8.364 8.364 7.707 0.657 17635 1784 1 3 . 1 1 104 104 ASN N N 104 118.527 118.527 120.613 -2.086 17635 1785 1 3 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.754 -0.036 17635 1786 1 3 . 1 1 104 104 ASN C C 104 174.547 174.547 176.154 -1.607 17635 1787 1 3 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.989 0.220 17635 1788 1 3 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.180 -0.301 17635 1789 1 3 . 1 1 104 104 ASN H H 104 8.438 8.438 8.565 -0.127 17635 1790 1 3 . 1 1 105 105 GLY N N 105 109.166 109.166 108.726 0.440 17635 1791 1 3 . 1 1 105 105 GLY C C 105 176.074 176.074 174.184 1.890 17635 1792 1 3 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.645 0.957 17635 1793 1 3 . 1 1 105 105 GLY H H 105 8.477 8.477 8.255 0.222 17635 1794 1 3 . 1 1 106 106 ARG N N 106 120.341 120.341 124.137 -3.796 17635 1795 1 3 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.312 0.039 17635 1796 1 3 . 1 1 106 106 ARG C C 106 173.491 173.491 176.886 -3.395 17635 1797 1 3 . 1 1 106 106 ARG CA C 106 56.227 56.227 56.626 -0.399 17635 1798 1 3 . 1 1 106 106 ARG CB C 106 30.629 30.629 29.914 0.715 17635 1799 1 3 . 1 1 106 106 ARG H H 106 8.244 8.244 8.758 -0.514 17635 1800 1 3 . 1 1 107 107 GLY N N 107 109.856 109.856 113.633 -3.777 17635 1801 1 3 . 1 1 107 107 GLY C C 107 175.834 175.834 174.154 1.680 17635 1802 1 3 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.954 0.487 17635 1803 1 3 . 1 1 107 107 GLY H H 107 8.522 8.522 8.493 0.029 17635 1804 1 4 . 1 1 2 2 GLN N N 2 121.692 121.692 120.193 1.499 17635 1805 1 4 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.216 0.050 17635 1806 1 4 . 1 1 2 2 GLN C C 2 175.248 175.248 175.427 -0.179 17635 1807 1 4 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.908 0.088 17635 1808 1 4 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.285 0.354 17635 1809 1 4 . 1 1 2 2 GLN H H 2 8.621 8.621 8.395 0.226 17635 1810 1 4 . 1 1 3 3 ASP N N 3 121.801 121.801 124.329 -2.528 17635 1811 1 4 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.631 -0.063 17635 1812 1 4 . 1 1 3 3 ASP C C 3 174.336 174.336 175.250 -0.914 17635 1813 1 4 . 1 1 3 3 ASP CA C 3 54.062 54.062 52.900 1.162 17635 1814 1 4 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.027 1.044 17635 1815 1 4 . 1 1 3 3 ASP H H 3 8.436 8.436 8.757 -0.321 17635 1816 1 4 . 1 1 4 4 ASN N N 4 120.292 120.292 117.493 2.799 17635 1817 1 4 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.521 0.116 17635 1818 1 4 . 1 1 4 4 ASN C C 4 174.415 174.415 174.910 -0.495 17635 1819 1 4 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.527 0.334 17635 1820 1 4 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.776 -0.242 17635 1821 1 4 . 1 1 4 4 ASN H H 4 8.528 8.528 7.633 0.895 17635 1822 1 4 . 1 1 5 5 SER N N 5 117.091 117.091 119.693 -2.602 17635 1823 1 4 . 1 1 5 5 SER HA H 5 4.163 4.163 4.302 -0.139 17635 1824 1 4 . 1 1 5 5 SER C C 5 176.370 176.370 174.153 2.217 17635 1825 1 4 . 1 1 5 5 SER CA C 5 60.846 60.846 59.640 1.206 17635 1826 1 4 . 1 1 5 5 SER CB C 5 63.136 63.136 63.582 -0.446 17635 1827 1 4 . 1 1 5 5 SER H H 5 8.470 8.470 8.429 0.041 17635 1828 1 4 . 1 1 6 6 ASP N N 6 119.436 119.436 119.097 0.339 17635 1829 1 4 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.963 -0.268 17635 1830 1 4 . 1 1 6 6 ASP C C 6 175.048 175.048 174.215 0.833 17635 1831 1 4 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.630 -0.536 17635 1832 1 4 . 1 1 6 6 ASP CB C 6 40.935 40.935 42.331 -1.396 17635 1833 1 4 . 1 1 6 6 ASP H H 6 8.218 8.218 8.294 -0.076 17635 1834 1 4 . 1 1 7 7 ASN N N 7 119.696 119.696 118.568 1.128 17635 1835 1 4 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.631 -0.003 17635 1836 1 4 . 1 1 7 7 ASN C C 7 176.539 176.539 176.250 0.289 17635 1837 1 4 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.753 -0.595 17635 1838 1 4 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.790 0.069 17635 1839 1 4 . 1 1 7 7 ASN H H 7 7.734 7.734 8.012 -0.278 17635 1840 1 4 . 1 1 8 8 ASN N N 8 119.436 119.436 117.518 1.918 17635 1841 1 4 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.559 0.309 17635 1842 1 4 . 1 1 8 8 ASN C C 8 175.327 175.327 175.010 0.317 17635 1843 1 4 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.913 -1.709 17635 1844 1 4 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.449 0.046 17635 1845 1 4 . 1 1 8 8 ASN H H 8 8.350 8.350 8.448 -0.098 17635 1846 1 4 . 1 1 9 9 THR N N 9 118.650 118.650 115.217 3.433 17635 1847 1 4 . 1 1 9 9 THR HA H 9 5.557 5.557 4.586 0.971 17635 1848 1 4 . 1 1 9 9 THR C C 9 177.117 177.117 174.300 2.817 17635 1849 1 4 . 1 1 9 9 THR CA C 9 62.314 62.314 63.505 -1.191 17635 1850 1 4 . 1 1 9 9 THR CB C 9 71.225 71.225 67.938 3.287 17635 1851 1 4 . 1 1 9 9 THR H H 9 8.428 8.428 7.534 0.894 17635 1852 1 4 . 1 1 10 10 ILE N N 10 118.556 118.556 123.325 -4.769 17635 1853 1 4 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.297 -0.132 17635 1854 1 4 . 1 1 10 10 ILE C C 10 176.837 176.837 173.998 2.839 17635 1855 1 4 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.842 0.456 17635 1856 1 4 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.653 -1.773 17635 1857 1 4 . 1 1 10 10 ILE H H 10 8.770 8.770 8.763 0.007 17635 1858 1 4 . 1 1 11 11 PHE N N 11 123.798 123.798 120.246 3.552 17635 1859 1 4 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.119 0.301 17635 1860 1 4 . 1 1 11 11 PHE C C 11 177.066 177.066 173.392 3.674 17635 1861 1 4 . 1 1 11 11 PHE CA C 11 55.362 55.362 54.432 0.930 17635 1862 1 4 . 1 1 11 11 PHE CB C 11 41.868 41.868 40.701 1.167 17635 1863 1 4 . 1 1 11 11 PHE H H 11 9.548 9.548 8.765 0.783 17635 1864 1 4 . 1 1 12 12 VAL N N 12 127.993 127.993 124.966 3.027 17635 1865 1 4 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.370 0.588 17635 1866 1 4 . 1 1 12 12 VAL C C 12 176.965 176.965 174.926 2.039 17635 1867 1 4 . 1 1 12 12 VAL CA C 12 59.835 59.835 59.906 -0.071 17635 1868 1 4 . 1 1 12 12 VAL CB C 12 34.800 34.800 31.673 3.127 17635 1869 1 4 . 1 1 12 12 VAL H H 12 8.940 8.940 8.936 0.004 17635 1870 1 4 . 1 1 13 13 GLN N N 13 122.289 122.289 126.727 -4.438 17635 1871 1 4 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.365 0.414 17635 1872 1 4 . 1 1 13 13 GLN C C 13 175.631 175.631 175.647 -0.016 17635 1873 1 4 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.093 0.017 17635 1874 1 4 . 1 1 13 13 GLN CB C 13 34.132 34.132 29.828 4.304 17635 1875 1 4 . 1 1 13 13 GLN H H 13 8.747 8.747 7.890 0.857 17635 1876 1 4 . 1 1 14 14 GLY N N 14 109.212 109.212 112.616 -3.404 17635 1877 1 4 . 1 1 14 14 GLY C C 14 175.436 175.436 173.423 2.013 17635 1878 1 4 . 1 1 14 14 GLY CA C 14 45.430 45.430 44.963 0.467 17635 1879 1 4 . 1 1 14 14 GLY H H 14 8.236 8.236 8.882 -0.646 17635 1880 1 4 . 1 1 15 15 LEU N N 15 117.824 117.824 122.578 -4.754 17635 1881 1 4 . 1 1 15 15 LEU HA H 15 3.706 3.706 3.441 0.265 17635 1882 1 4 . 1 1 15 15 LEU C C 15 174.111 174.111 176.260 -2.149 17635 1883 1 4 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.399 0.319 17635 1884 1 4 . 1 1 15 15 LEU CB C 15 42.433 42.433 40.599 1.833 17635 1885 1 4 . 1 1 15 15 LEU H H 15 8.442 8.442 8.010 0.432 17635 1886 1 4 . 1 1 16 16 GLY N N 16 105.063 105.063 104.714 0.349 17635 1887 1 4 . 1 1 16 16 GLY C C 16 177.771 177.771 173.812 3.959 17635 1888 1 4 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.218 -0.124 17635 1889 1 4 . 1 1 16 16 GLY H H 16 8.006 8.006 7.625 0.381 17635 1890 1 4 . 1 1 17 17 GLU N N 17 113.781 113.781 120.338 -6.557 17635 1891 1 4 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.760 0.358 17635 1892 1 4 . 1 1 17 17 GLU C C 17 173.937 173.937 175.338 -1.401 17635 1893 1 4 . 1 1 17 17 GLU CA C 17 57.281 57.281 57.399 -0.118 17635 1894 1 4 . 1 1 17 17 GLU CB C 17 30.436 30.436 28.334 2.102 17635 1895 1 4 . 1 1 17 17 GLU H H 17 8.134 8.134 8.665 -0.531 17635 1896 1 4 . 1 1 18 18 ASN N N 18 116.660 116.660 112.515 4.145 17635 1897 1 4 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.709 0.232 17635 1898 1 4 . 1 1 18 18 ASN C C 18 175.900 175.900 174.764 1.136 17635 1899 1 4 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.341 0.137 17635 1900 1 4 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.289 -0.804 17635 1901 1 4 . 1 1 18 18 ASN H H 18 8.407 8.407 7.942 0.465 17635 1902 1 4 . 1 1 19 19 VAL N N 19 118.323 118.323 120.967 -2.644 17635 1903 1 4 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.864 0.288 17635 1904 1 4 . 1 1 19 19 VAL C C 19 177.655 177.655 174.836 2.819 17635 1905 1 4 . 1 1 19 19 VAL CA C 19 61.877 61.877 62.497 -0.620 17635 1906 1 4 . 1 1 19 19 VAL CB C 19 32.513 32.513 29.974 2.539 17635 1907 1 4 . 1 1 19 19 VAL H H 19 6.855 6.855 7.883 -1.028 17635 1908 1 4 . 1 1 20 20 THR N N 20 111.636 111.636 115.887 -4.251 17635 1909 1 4 . 1 1 20 20 THR HA H 20 4.719 4.719 4.690 0.029 17635 1910 1 4 . 1 1 20 20 THR C C 20 175.266 175.266 175.029 0.237 17635 1911 1 4 . 1 1 20 20 THR CA C 20 58.698 58.698 59.863 -1.165 17635 1912 1 4 . 1 1 20 20 THR CB C 20 72.948 72.948 71.808 1.140 17635 1913 1 4 . 1 1 20 20 THR H H 20 7.328 7.328 8.028 -0.700 17635 1914 1 4 . 1 1 21 21 ILE N N 21 122.147 122.147 123.409 -1.262 17635 1915 1 4 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.711 -0.193 17635 1916 1 4 . 1 1 21 21 ILE C C 21 173.198 173.198 177.518 -4.320 17635 1917 1 4 . 1 1 21 21 ILE CA C 21 65.772 65.772 65.667 0.105 17635 1918 1 4 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.766 -0.183 17635 1919 1 4 . 1 1 21 21 ILE H H 21 9.074 9.074 8.703 0.371 17635 1920 1 4 . 1 1 22 22 GLU N N 22 118.154 118.154 119.647 -1.493 17635 1921 1 4 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.057 -0.071 17635 1922 1 4 . 1 1 22 22 GLU C C 22 171.799 171.799 178.124 -6.325 17635 1923 1 4 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.673 0.940 17635 1924 1 4 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.427 0.364 17635 1925 1 4 . 1 1 22 22 GLU H H 22 8.814 8.814 8.652 0.162 17635 1926 1 4 . 1 1 23 23 SER N N 23 115.921 115.921 114.905 1.016 17635 1927 1 4 . 1 1 23 23 SER HA H 23 4.384 4.384 4.534 -0.150 17635 1928 1 4 . 1 1 23 23 SER C C 23 172.447 172.447 176.739 -4.292 17635 1929 1 4 . 1 1 23 23 SER CA C 23 61.239 61.239 60.898 0.341 17635 1930 1 4 . 1 1 23 23 SER CB C 23 62.838 62.838 63.351 -0.513 17635 1931 1 4 . 1 1 23 23 SER H H 23 8.236 8.236 8.170 0.066 17635 1932 1 4 . 1 1 24 24 VAL N N 24 124.867 124.867 122.726 2.141 17635 1933 1 4 . 1 1 24 24 VAL HA H 24 3.748 3.748 3.965 -0.217 17635 1934 1 4 . 1 1 24 24 VAL C C 24 173.016 173.016 177.652 -4.636 17635 1935 1 4 . 1 1 24 24 VAL CA C 24 67.254 67.254 65.825 1.429 17635 1936 1 4 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.346 0.187 17635 1937 1 4 . 1 1 24 24 VAL H H 24 7.973 7.973 8.014 -0.041 17635 1938 1 4 . 1 1 25 25 ALA N N 25 123.198 123.198 121.670 1.528 17635 1939 1 4 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.062 -0.163 17635 1940 1 4 . 1 1 25 25 ALA C C 25 171.061 171.061 178.472 -7.411 17635 1941 1 4 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.971 0.724 17635 1942 1 4 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.460 -0.722 17635 1943 1 4 . 1 1 25 25 ALA H H 25 8.695 8.695 8.468 0.227 17635 1944 1 4 . 1 1 26 26 ASP N N 26 115.503 115.503 117.431 -1.928 17635 1945 1 4 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.466 -0.143 17635 1946 1 4 . 1 1 26 26 ASP C C 26 173.108 173.108 178.200 -5.092 17635 1947 1 4 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.447 0.876 17635 1948 1 4 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.012 0.040 17635 1949 1 4 . 1 1 26 26 ASP H H 26 8.312 8.312 8.095 0.217 17635 1950 1 4 . 1 1 27 27 TYR N N 27 119.224 119.224 118.669 0.555 17635 1951 1 4 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.540 -0.340 17635 1952 1 4 . 1 1 27 27 TYR C C 27 172.908 172.908 176.355 -3.447 17635 1953 1 4 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.002 2.014 17635 1954 1 4 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.254 0.678 17635 1955 1 4 . 1 1 27 27 TYR H H 27 7.533 7.533 7.833 -0.300 17635 1956 1 4 . 1 1 28 28 PHE N N 28 112.595 112.595 119.007 -6.412 17635 1957 1 4 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.053 0.277 17635 1958 1 4 . 1 1 28 28 PHE C C 28 173.082 173.082 174.932 -1.850 17635 1959 1 4 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.392 6.392 17635 1960 1 4 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.232 1.771 17635 1961 1 4 . 1 1 28 28 PHE H H 28 7.974 7.974 8.312 -0.338 17635 1962 1 4 . 1 1 29 29 LYS N N 29 118.820 118.820 117.362 1.458 17635 1963 1 4 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.770 0.147 17635 1964 1 4 . 1 1 29 29 LYS C C 29 173.682 173.682 176.637 -2.955 17635 1965 1 4 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.950 2.330 17635 1966 1 4 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.024 -0.733 17635 1967 1 4 . 1 1 29 29 LYS H H 29 8.325 8.325 7.478 0.847 17635 1968 1 4 . 1 1 30 30 GLN N N 30 116.232 116.232 117.691 -1.459 17635 1969 1 4 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.151 -0.016 17635 1970 1 4 . 1 1 30 30 GLN C C 30 173.790 173.790 176.570 -2.780 17635 1971 1 4 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.305 0.241 17635 1972 1 4 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.835 1.063 17635 1973 1 4 . 1 1 30 30 GLN H H 30 7.518 7.518 7.918 -0.400 17635 1974 1 4 . 1 1 31 31 ILE N N 31 116.489 116.489 117.362 -0.873 17635 1975 1 4 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.737 0.502 17635 1976 1 4 . 1 1 31 31 ILE C C 31 175.599 175.599 175.830 -0.231 17635 1977 1 4 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.414 -3.193 17635 1978 1 4 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.029 2.305 17635 1979 1 4 . 1 1 31 31 ILE H H 31 7.809 7.809 7.828 -0.019 17635 1980 1 4 . 1 1 32 32 GLY N N 32 107.416 107.416 106.442 0.974 17635 1981 1 4 . 1 1 32 32 GLY C C 32 180.182 180.182 171.877 8.305 17635 1982 1 4 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.492 0.502 17635 1983 1 4 . 1 1 32 32 GLY H H 32 7.344 7.344 7.249 0.095 17635 1984 1 4 . 1 1 33 33 ILE N N 33 117.784 117.784 121.304 -3.520 17635 1985 1 4 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.468 -0.379 17635 1986 1 4 . 1 1 33 33 ILE C C 33 173.301 173.301 175.222 -1.921 17635 1987 1 4 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.260 1.381 17635 1988 1 4 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.132 -0.472 17635 1989 1 4 . 1 1 33 33 ILE H H 33 8.173 8.173 8.087 0.086 17635 1990 1 4 . 1 1 34 34 ILE N N 34 131.781 131.781 129.153 2.628 17635 1991 1 4 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.370 -0.583 17635 1992 1 4 . 1 1 34 34 ILE C C 34 174.663 174.663 176.409 -1.746 17635 1993 1 4 . 1 1 34 34 ILE CA C 34 61.370 61.370 61.766 -0.396 17635 1994 1 4 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.221 -0.226 17635 1995 1 4 . 1 1 34 34 ILE H H 34 8.687 8.687 9.047 -0.360 17635 1996 1 4 . 1 1 35 35 LYS N N 35 130.372 130.372 129.373 0.999 17635 1997 1 4 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.339 -0.255 17635 1998 1 4 . 1 1 35 35 LYS C C 35 175.376 175.376 176.480 -1.104 17635 1999 1 4 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.061 0.412 17635 2000 1 4 . 1 1 35 35 LYS CB C 35 33.664 33.664 30.847 2.817 17635 2001 1 4 . 1 1 35 35 LYS H H 35 8.680 8.680 8.765 -0.085 17635 2002 1 4 . 1 1 36 36 THR N N 36 118.312 118.312 118.531 -0.219 17635 2003 1 4 . 1 1 36 36 THR HA H 36 4.415 4.415 4.376 0.039 17635 2004 1 4 . 1 1 36 36 THR C C 36 176.394 176.394 174.223 2.171 17635 2005 1 4 . 1 1 36 36 THR CA C 36 61.340 61.340 62.795 -1.455 17635 2006 1 4 . 1 1 36 36 THR CB C 36 70.809 70.809 69.243 1.566 17635 2007 1 4 . 1 1 36 36 THR H H 36 8.456 8.456 8.085 0.371 17635 2008 1 4 . 1 1 37 37 ASN N N 37 124.092 124.092 123.220 0.872 17635 2009 1 4 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.629 -0.099 17635 2010 1 4 . 1 1 37 37 ASN C C 37 174.235 174.235 175.844 -1.609 17635 2011 1 4 . 1 1 37 37 ASN CA C 37 53.064 53.064 53.765 -0.701 17635 2012 1 4 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.610 -0.683 17635 2013 1 4 . 1 1 37 37 ASN H H 37 8.794 8.794 8.828 -0.034 17635 2014 1 4 . 1 1 38 38 LYS N N 38 127.969 127.969 126.024 1.945 17635 2015 1 4 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.226 -0.222 17635 2016 1 4 . 1 1 38 38 LYS C C 38 172.702 172.702 176.624 -3.922 17635 2017 1 4 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.699 -0.241 17635 2018 1 4 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.309 -0.142 17635 2019 1 4 . 1 1 38 38 LYS H H 38 8.962 8.962 8.798 0.164 17635 2020 1 4 . 1 1 39 39 LYS N N 39 117.413 117.413 117.585 -0.172 17635 2021 1 4 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.317 -0.059 17635 2022 1 4 . 1 1 39 39 LYS C C 39 172.261 172.261 177.514 -5.253 17635 2023 1 4 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.351 -0.032 17635 2024 1 4 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.554 0.243 17635 2025 1 4 . 1 1 39 39 LYS H H 39 8.314 8.314 8.043 0.271 17635 2026 1 4 . 1 1 40 40 THR N N 40 105.547 105.547 111.264 -5.717 17635 2027 1 4 . 1 1 40 40 THR HA H 40 4.465 4.465 4.540 -0.075 17635 2028 1 4 . 1 1 40 40 THR C C 40 174.021 174.021 175.285 -1.264 17635 2029 1 4 . 1 1 40 40 THR CA C 40 61.260 61.260 61.870 -0.610 17635 2030 1 4 . 1 1 40 40 THR CB C 40 70.997 70.997 69.379 1.618 17635 2031 1 4 . 1 1 40 40 THR H H 40 7.422 7.422 7.913 -0.491 17635 2032 1 4 . 1 1 41 41 GLY N N 41 111.631 111.631 109.847 1.784 17635 2033 1 4 . 1 1 41 41 GLY C C 41 176.727 176.727 173.437 3.290 17635 2034 1 4 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.819 -0.089 17635 2035 1 4 . 1 1 41 41 GLY H H 41 8.644 8.644 8.240 0.404 17635 2036 1 4 . 1 1 42 42 GLN N N 42 118.894 118.894 117.681 1.213 17635 2037 1 4 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.887 -0.218 17635 2038 1 4 . 1 1 42 42 GLN C C 42 177.178 177.178 173.593 3.585 17635 2039 1 4 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.170 1.411 17635 2040 1 4 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.890 -0.660 17635 2041 1 4 . 1 1 42 42 GLN H H 42 7.662 7.662 7.863 -0.201 17635 2042 1 4 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.352 0.243 17635 2043 1 4 . 1 1 43 43 PRO C C 43 172.629 172.629 176.090 -3.461 17635 2044 1 4 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.654 -0.832 17635 2045 1 4 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.174 0.522 17635 2046 1 4 . 1 1 44 44 MET N N 44 124.162 124.162 121.042 3.120 17635 2047 1 4 . 1 1 44 44 MET HA H 44 4.432 4.432 4.746 -0.314 17635 2048 1 4 . 1 1 44 44 MET C C 44 176.474 176.474 174.584 1.890 17635 2049 1 4 . 1 1 44 44 MET CA C 44 55.419 55.419 54.036 1.383 17635 2050 1 4 . 1 1 44 44 MET CB C 44 30.555 30.555 34.809 -4.254 17635 2051 1 4 . 1 1 44 44 MET H H 44 8.874 8.874 8.162 0.712 17635 2052 1 4 . 1 1 45 45 ILE N N 45 126.237 126.237 123.020 3.217 17635 2053 1 4 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.461 0.341 17635 2054 1 4 . 1 1 45 45 ILE C C 45 176.415 176.415 174.246 2.169 17635 2055 1 4 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.135 -0.919 17635 2056 1 4 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.637 -0.411 17635 2057 1 4 . 1 1 45 45 ILE H H 45 7.730 7.730 8.482 -0.752 17635 2058 1 4 . 1 1 46 46 ASN N N 46 124.735 124.735 122.826 1.909 17635 2059 1 4 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.011 -0.070 17635 2060 1 4 . 1 1 46 46 ASN C C 46 176.836 176.836 173.949 2.887 17635 2061 1 4 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.294 -0.733 17635 2062 1 4 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.850 -0.380 17635 2063 1 4 . 1 1 46 46 ASN H H 46 8.384 8.384 8.875 -0.491 17635 2064 1 4 . 1 1 47 47 LEU N N 47 122.487 122.487 121.067 1.420 17635 2065 1 4 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.623 0.092 17635 2066 1 4 . 1 1 47 47 LEU C C 47 174.190 174.190 175.804 -1.614 17635 2067 1 4 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.245 -0.912 17635 2068 1 4 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.065 -1.788 17635 2069 1 4 . 1 1 47 47 LEU H H 47 8.594 8.594 8.491 0.103 17635 2070 1 4 . 1 1 48 48 TYR N N 48 121.842 121.842 125.326 -3.484 17635 2071 1 4 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.781 -0.014 17635 2072 1 4 . 1 1 48 48 TYR C C 48 173.649 173.649 175.154 -1.505 17635 2073 1 4 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.851 1.043 17635 2074 1 4 . 1 1 48 48 TYR CB C 48 39.199 39.199 39.169 0.030 17635 2075 1 4 . 1 1 48 48 TYR H H 48 7.666 7.666 8.904 -1.238 17635 2076 1 4 . 1 1 49 49 THR N N 49 116.554 116.554 115.314 1.240 17635 2077 1 4 . 1 1 49 49 THR HA H 49 4.806 4.806 4.599 0.207 17635 2078 1 4 . 1 1 49 49 THR C C 49 176.654 176.654 173.855 2.799 17635 2079 1 4 . 1 1 49 49 THR CA C 49 60.693 60.693 59.384 1.309 17635 2080 1 4 . 1 1 49 49 THR CB C 49 71.437 71.437 70.724 0.713 17635 2081 1 4 . 1 1 49 49 THR H H 49 8.965 8.965 8.243 0.722 17635 2082 1 4 . 1 1 50 50 ASP N N 50 123.826 123.826 121.773 2.053 17635 2083 1 4 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.542 0.082 17635 2084 1 4 . 1 1 50 50 ASP C C 50 173.380 173.380 176.784 -3.404 17635 2085 1 4 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.775 -0.687 17635 2086 1 4 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.476 0.391 17635 2087 1 4 . 1 1 50 50 ASP H H 50 8.939 8.939 8.767 0.172 17635 2088 1 4 . 1 1 51 51 ARG N N 51 127.794 127.794 123.952 3.842 17635 2089 1 4 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.331 -0.286 17635 2090 1 4 . 1 1 51 51 ARG C C 51 173.101 173.101 175.480 -2.379 17635 2091 1 4 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.262 2.300 17635 2092 1 4 . 1 1 51 51 ARG CB C 51 30.167 30.167 28.985 1.182 17635 2093 1 4 . 1 1 51 51 ARG H H 51 8.958 8.958 8.505 0.453 17635 2094 1 4 . 1 1 52 52 GLU N N 52 117.542 117.542 120.281 -2.739 17635 2095 1 4 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.434 -0.156 17635 2096 1 4 . 1 1 52 52 GLU C C 52 172.201 172.201 176.667 -4.466 17635 2097 1 4 . 1 1 52 52 GLU CA C 52 58.524 58.524 57.260 1.264 17635 2098 1 4 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.322 -0.044 17635 2099 1 4 . 1 1 52 52 GLU H H 52 8.561 8.561 8.224 0.337 17635 2100 1 4 . 1 1 53 53 THR N N 53 107.065 107.065 110.114 -3.049 17635 2101 1 4 . 1 1 53 53 THR HA H 53 4.436 4.436 4.475 -0.039 17635 2102 1 4 . 1 1 53 53 THR C C 53 173.851 173.851 175.418 -1.567 17635 2103 1 4 . 1 1 53 53 THR CA C 53 61.944 61.944 61.725 0.219 17635 2104 1 4 . 1 1 53 53 THR CB C 53 71.197 71.197 69.917 1.280 17635 2105 1 4 . 1 1 53 53 THR H H 53 8.087 8.087 7.866 0.221 17635 2106 1 4 . 1 1 54 54 GLY N N 54 111.295 111.295 110.100 1.195 17635 2107 1 4 . 1 1 54 54 GLY C C 54 176.747 176.747 175.052 1.695 17635 2108 1 4 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.709 0.994 17635 2109 1 4 . 1 1 54 54 GLY H H 54 8.423 8.423 7.598 0.825 17635 2110 1 4 . 1 1 55 55 LYS N N 55 119.673 119.673 121.372 -1.699 17635 2111 1 4 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.185 0.168 17635 2112 1 4 . 1 1 55 55 LYS C C 55 173.854 173.854 176.200 -2.346 17635 2113 1 4 . 1 1 55 55 LYS CA C 55 55.842 55.842 56.905 -1.063 17635 2114 1 4 . 1 1 55 55 LYS CB C 55 33.821 33.821 33.047 0.774 17635 2115 1 4 . 1 1 55 55 LYS H H 55 7.767 7.767 7.618 0.149 17635 2116 1 4 . 1 1 56 56 LEU N N 56 122.426 122.426 119.829 2.597 17635 2117 1 4 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.387 -0.031 17635 2118 1 4 . 1 1 56 56 LEU C C 56 172.534 172.534 176.805 -4.271 17635 2119 1 4 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.447 1.808 17635 2120 1 4 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.472 -0.818 17635 2121 1 4 . 1 1 56 56 LEU H H 56 8.768 8.768 8.174 0.594 17635 2122 1 4 . 1 1 57 57 LYS N N 57 118.264 118.264 121.741 -3.477 17635 2123 1 4 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.112 0.176 17635 2124 1 4 . 1 1 57 57 LYS C C 57 173.648 173.648 177.549 -3.901 17635 2125 1 4 . 1 1 57 57 LYS CA C 57 56.264 56.264 57.426 -1.163 17635 2126 1 4 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.961 1.101 17635 2127 1 4 . 1 1 57 57 LYS H H 57 8.012 8.012 8.362 -0.350 17635 2128 1 4 . 1 1 58 58 GLY N N 58 108.514 108.514 106.782 1.732 17635 2129 1 4 . 1 1 58 58 GLY C C 58 177.876 177.876 172.763 5.113 17635 2130 1 4 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.130 1.234 17635 2131 1 4 . 1 1 58 58 GLY H H 58 8.334 8.334 8.054 0.280 17635 2132 1 4 . 1 1 59 59 GLU N N 59 116.119 116.119 118.957 -2.838 17635 2133 1 4 . 1 1 59 59 GLU HA H 59 5.521 5.521 4.919 0.602 17635 2134 1 4 . 1 1 59 59 GLU C C 59 173.860 173.860 173.825 0.035 17635 2135 1 4 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.497 -2.472 17635 2136 1 4 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.687 0.617 17635 2137 1 4 . 1 1 59 59 GLU H H 59 7.202 7.202 7.566 -0.364 17635 2138 1 4 . 1 1 60 60 ALA N N 60 123.607 123.607 126.284 -2.677 17635 2139 1 4 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.185 0.422 17635 2140 1 4 . 1 1 60 60 ALA C C 60 173.923 173.923 175.077 -1.154 17635 2141 1 4 . 1 1 60 60 ALA CA C 60 50.943 50.943 50.546 0.397 17635 2142 1 4 . 1 1 60 60 ALA CB C 60 24.059 24.059 22.879 1.180 17635 2143 1 4 . 1 1 60 60 ALA H H 60 8.930 8.930 9.000 -0.070 17635 2144 1 4 . 1 1 61 61 THR N N 61 108.384 108.384 112.295 -3.911 17635 2145 1 4 . 1 1 61 61 THR HA H 61 5.743 5.743 4.850 0.893 17635 2146 1 4 . 1 1 61 61 THR C C 61 176.172 176.172 173.124 3.048 17635 2147 1 4 . 1 1 61 61 THR CA C 61 59.625 59.625 60.075 -0.450 17635 2148 1 4 . 1 1 61 61 THR CB C 61 71.224 71.224 71.106 0.118 17635 2149 1 4 . 1 1 61 61 THR H H 61 8.452 8.452 8.661 -0.209 17635 2150 1 4 . 1 1 62 62 VAL N N 62 120.200 120.200 124.524 -4.324 17635 2151 1 4 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.364 -0.120 17635 2152 1 4 . 1 1 62 62 VAL C C 62 175.994 175.994 174.227 1.767 17635 2153 1 4 . 1 1 62 62 VAL CA C 62 61.426 61.426 60.640 0.786 17635 2154 1 4 . 1 1 62 62 VAL CB C 62 34.685 34.685 35.046 -0.361 17635 2155 1 4 . 1 1 62 62 VAL H H 62 8.071 8.071 9.192 -1.121 17635 2156 1 4 . 1 1 63 63 SER N N 63 121.689 121.689 119.639 2.050 17635 2157 1 4 . 1 1 63 63 SER HA H 63 5.261 5.261 4.828 0.433 17635 2158 1 4 . 1 1 63 63 SER C C 63 177.943 177.943 173.638 4.305 17635 2159 1 4 . 1 1 63 63 SER CA C 63 57.662 57.662 56.780 0.882 17635 2160 1 4 . 1 1 63 63 SER CB C 63 64.427 64.427 64.395 0.032 17635 2161 1 4 . 1 1 63 63 SER H H 63 7.695 7.695 8.240 -0.545 17635 2162 1 4 . 1 1 64 64 PHE N N 64 122.640 122.640 123.281 -0.641 17635 2163 1 4 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.894 -0.040 17635 2164 1 4 . 1 1 64 64 PHE C C 64 174.605 174.605 175.926 -1.321 17635 2165 1 4 . 1 1 64 64 PHE CA C 64 58.204 58.204 56.992 1.212 17635 2166 1 4 . 1 1 64 64 PHE CB C 64 41.976 41.976 41.738 0.238 17635 2167 1 4 . 1 1 64 64 PHE H H 64 9.025 9.025 8.987 0.038 17635 2168 1 4 . 1 1 65 65 ASP N N 65 119.943 119.943 121.667 -1.724 17635 2169 1 4 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.643 -0.208 17635 2170 1 4 . 1 1 65 65 ASP C C 65 174.396 174.396 175.896 -1.500 17635 2171 1 4 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.592 1.850 17635 2172 1 4 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.154 -0.120 17635 2173 1 4 . 1 1 65 65 ASP H H 65 8.512 8.512 9.381 -0.869 17635 2174 1 4 . 1 1 66 66 ASP N N 66 116.125 116.125 117.815 -1.690 17635 2175 1 4 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.047 0.352 17635 2176 1 4 . 1 1 66 66 ASP C C 66 175.936 175.936 174.900 1.036 17635 2177 1 4 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.600 -0.807 17635 2178 1 4 . 1 1 66 66 ASP CB C 66 42.919 42.919 43.242 -0.323 17635 2179 1 4 . 1 1 66 66 ASP H H 66 8.323 8.323 7.748 0.575 17635 2180 1 4 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.425 0.025 17635 2181 1 4 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.316 0.608 17635 2182 1 4 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.512 -0.682 17635 2183 1 4 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.273 0.146 17635 2184 1 4 . 1 1 68 68 PRO C C 68 171.345 171.345 179.065 -7.720 17635 2185 1 4 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.086 0.149 17635 2186 1 4 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.078 -0.081 17635 2187 1 4 . 1 1 69 69 SER N N 69 114.544 114.544 114.437 0.107 17635 2188 1 4 . 1 1 69 69 SER HA H 69 4.036 4.036 3.872 0.164 17635 2189 1 4 . 1 1 69 69 SER C C 69 176.535 176.535 176.099 0.436 17635 2190 1 4 . 1 1 69 69 SER CA C 69 61.837 61.837 61.218 0.619 17635 2191 1 4 . 1 1 69 69 SER CB C 69 62.773 62.773 62.220 0.553 17635 2192 1 4 . 1 1 69 69 SER H H 69 8.004 8.004 8.057 -0.053 17635 2193 1 4 . 1 1 70 70 ALA N N 70 122.649 122.649 124.127 -1.478 17635 2194 1 4 . 1 1 70 70 ALA HA H 70 3.593 3.593 4.202 -0.609 17635 2195 1 4 . 1 1 70 70 ALA C C 70 172.686 172.686 179.378 -6.692 17635 2196 1 4 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.425 -0.389 17635 2197 1 4 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.282 -0.418 17635 2198 1 4 . 1 1 70 70 ALA H H 70 7.383 7.383 7.704 -0.321 17635 2199 1 4 . 1 1 71 71 LYS N N 71 116.308 116.308 119.785 -3.477 17635 2200 1 4 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.855 -0.080 17635 2201 1 4 . 1 1 71 71 LYS C C 71 172.333 172.333 178.558 -6.225 17635 2202 1 4 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.259 0.743 17635 2203 1 4 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.885 0.557 17635 2204 1 4 . 1 1 71 71 LYS H H 71 7.159 7.159 7.497 -0.338 17635 2205 1 4 . 1 1 72 72 ALA N N 72 119.806 119.806 121.045 -1.239 17635 2206 1 4 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.051 0.115 17635 2207 1 4 . 1 1 72 72 ALA C C 72 170.530 170.530 179.553 -9.023 17635 2208 1 4 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.758 -0.043 17635 2209 1 4 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.028 -0.208 17635 2210 1 4 . 1 1 72 72 ALA H H 72 7.924 7.924 8.437 -0.513 17635 2211 1 4 . 1 1 73 73 ALA N N 73 120.524 120.524 121.198 -0.674 17635 2212 1 4 . 1 1 73 73 ALA HA H 73 4.279 4.279 3.841 0.438 17635 2213 1 4 . 1 1 73 73 ALA C C 73 171.039 171.039 179.478 -8.439 17635 2214 1 4 . 1 1 73 73 ALA CA C 73 55.379 55.379 55.059 0.320 17635 2215 1 4 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.750 0.381 17635 2216 1 4 . 1 1 73 73 ALA H H 73 8.104 8.104 7.936 0.168 17635 2217 1 4 . 1 1 74 74 ILE N N 74 119.875 119.875 117.934 1.941 17635 2218 1 4 . 1 1 74 74 ILE HA H 74 3.414 3.414 4.076 -0.662 17635 2219 1 4 . 1 1 74 74 ILE C C 74 172.435 172.435 177.421 -4.986 17635 2220 1 4 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.019 0.825 17635 2221 1 4 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.929 0.814 17635 2222 1 4 . 1 1 74 74 ILE H H 74 7.574 7.574 7.966 -0.392 17635 2223 1 4 . 1 1 75 75 ASP N N 75 117.867 117.867 118.108 -0.241 17635 2224 1 4 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.440 -0.129 17635 2225 1 4 . 1 1 75 75 ASP C C 75 172.054 172.054 176.684 -4.630 17635 2226 1 4 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.453 0.708 17635 2227 1 4 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.114 -0.583 17635 2228 1 4 . 1 1 75 75 ASP H H 75 7.937 7.937 8.078 -0.141 17635 2229 1 4 . 1 1 76 76 TRP N N 76 117.313 117.313 120.746 -3.433 17635 2230 1 4 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.315 0.041 17635 2231 1 4 . 1 1 76 76 TRP C C 76 173.272 173.272 176.581 -3.309 17635 2232 1 4 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.841 0.621 17635 2233 1 4 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.402 1.375 17635 2234 1 4 . 1 1 76 76 TRP H H 76 8.475 8.475 7.243 1.232 17635 2235 1 4 . 1 1 77 77 PHE N N 77 112.019 112.019 116.293 -4.274 17635 2236 1 4 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.622 0.026 17635 2237 1 4 . 1 1 77 77 PHE C C 77 173.747 173.747 175.678 -1.931 17635 2238 1 4 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.090 -0.169 17635 2239 1 4 . 1 1 77 77 PHE CB C 77 40.730 40.730 39.161 1.569 17635 2240 1 4 . 1 1 77 77 PHE H H 77 8.488 8.488 7.837 0.651 17635 2241 1 4 . 1 1 78 78 ASP N N 78 118.408 118.408 118.120 0.288 17635 2242 1 4 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.550 -0.086 17635 2243 1 4 . 1 1 78 78 ASP C C 78 172.542 172.542 176.257 -3.715 17635 2244 1 4 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.176 3.514 17635 2245 1 4 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.769 2.117 17635 2246 1 4 . 1 1 78 78 ASP H H 78 7.978 7.978 8.725 -0.747 17635 2247 1 4 . 1 1 79 79 GLY N N 79 115.548 115.548 103.056 12.492 17635 2248 1 4 . 1 1 79 79 GLY C C 79 175.680 175.680 173.672 2.008 17635 2249 1 4 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.054 1.018 17635 2250 1 4 . 1 1 79 79 GLY H H 79 8.615 8.615 8.644 -0.029 17635 2251 1 4 . 1 1 80 80 LYS N N 80 120.271 120.271 118.706 1.565 17635 2252 1 4 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.521 -0.059 17635 2253 1 4 . 1 1 80 80 LYS C C 80 175.853 175.853 175.092 0.761 17635 2254 1 4 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.032 0.118 17635 2255 1 4 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.060 -1.634 17635 2256 1 4 . 1 1 80 80 LYS H H 80 8.013 8.013 8.143 -0.130 17635 2257 1 4 . 1 1 81 81 GLU N N 81 115.765 115.765 118.629 -2.864 17635 2258 1 4 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.350 -0.652 17635 2259 1 4 . 1 1 81 81 GLU C C 81 173.263 173.263 175.737 -2.474 17635 2260 1 4 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.522 0.402 17635 2261 1 4 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.414 0.628 17635 2262 1 4 . 1 1 81 81 GLU H H 81 8.201 8.201 8.459 -0.258 17635 2263 1 4 . 1 1 82 82 PHE N N 82 127.080 127.080 125.936 1.144 17635 2264 1 4 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.608 -0.112 17635 2265 1 4 . 1 1 82 82 PHE C C 82 175.349 175.349 175.026 0.323 17635 2266 1 4 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.963 0.753 17635 2267 1 4 . 1 1 82 82 PHE CB C 82 41.994 41.994 40.385 1.609 17635 2268 1 4 . 1 1 82 82 PHE H H 82 9.162 9.162 9.246 -0.084 17635 2269 1 4 . 1 1 83 83 SER N N 83 125.136 125.136 122.452 2.684 17635 2270 1 4 . 1 1 83 83 SER HA H 83 3.803 3.803 4.191 -0.388 17635 2271 1 4 . 1 1 83 83 SER C C 83 175.543 175.543 174.776 0.767 17635 2272 1 4 . 1 1 83 83 SER CA C 83 58.371 58.371 59.566 -1.195 17635 2273 1 4 . 1 1 83 83 SER CB C 83 62.519 62.519 62.637 -0.118 17635 2274 1 4 . 1 1 83 83 SER H H 83 9.193 9.193 9.257 -0.064 17635 2275 1 4 . 1 1 84 84 GLY N N 84 103.581 103.581 105.601 -2.020 17635 2276 1 4 . 1 1 84 84 GLY C C 84 177.188 177.188 173.190 3.998 17635 2277 1 4 . 1 1 84 84 GLY CA C 84 45.052 45.052 45.146 -0.094 17635 2278 1 4 . 1 1 84 84 GLY H H 84 8.446 8.446 8.367 0.079 17635 2279 1 4 . 1 1 85 85 ASN N N 85 119.051 119.051 117.622 1.429 17635 2280 1 4 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.233 0.101 17635 2281 1 4 . 1 1 85 85 ASN C C 85 178.020 178.020 172.443 5.577 17635 2282 1 4 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.721 -0.250 17635 2283 1 4 . 1 1 85 85 ASN CB C 85 41.117 41.117 40.126 0.991 17635 2284 1 4 . 1 1 85 85 ASN H H 85 7.762 7.762 7.829 -0.067 17635 2285 1 4 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.390 -0.723 17635 2286 1 4 . 1 1 86 86 PRO C C 86 173.474 173.474 176.559 -3.085 17635 2287 1 4 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.339 0.371 17635 2288 1 4 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.274 -0.404 17635 2289 1 4 . 1 1 87 87 ILE N N 87 117.270 117.270 117.620 -0.350 17635 2290 1 4 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.405 -0.259 17635 2291 1 4 . 1 1 87 87 ILE C C 87 174.495 174.495 174.710 -0.215 17635 2292 1 4 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.401 1.090 17635 2293 1 4 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.601 -0.930 17635 2294 1 4 . 1 1 87 87 ILE H H 87 8.469 8.469 7.856 0.613 17635 2295 1 4 . 1 1 88 88 LYS N N 88 122.271 122.271 121.018 1.253 17635 2296 1 4 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.689 0.503 17635 2297 1 4 . 1 1 88 88 LYS C C 88 174.393 174.393 174.969 -0.576 17635 2298 1 4 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.639 -0.501 17635 2299 1 4 . 1 1 88 88 LYS CB C 88 35.049 35.049 33.637 1.412 17635 2300 1 4 . 1 1 88 88 LYS H H 88 8.353 8.353 8.189 0.164 17635 2301 1 4 . 1 1 89 89 VAL N N 89 125.661 125.661 126.373 -0.712 17635 2302 1 4 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.896 0.067 17635 2303 1 4 . 1 1 89 89 VAL C C 89 177.160 177.160 175.751 1.409 17635 2304 1 4 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.041 -0.680 17635 2305 1 4 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.398 2.372 17635 2306 1 4 . 1 1 89 89 VAL H H 89 9.414 9.414 8.689 0.725 17635 2307 1 4 . 1 1 90 90 SER N N 90 119.538 119.538 121.659 -2.121 17635 2308 1 4 . 1 1 90 90 SER HA H 90 4.710 4.710 4.815 -0.105 17635 2309 1 4 . 1 1 90 90 SER C C 90 176.533 176.533 173.314 3.219 17635 2310 1 4 . 1 1 90 90 SER CA C 90 56.936 56.936 56.344 0.592 17635 2311 1 4 . 1 1 90 90 SER CB C 90 66.470 66.470 65.567 0.903 17635 2312 1 4 . 1 1 90 90 SER H H 90 8.945 8.945 8.534 0.411 17635 2313 1 4 . 1 1 91 91 PHE N N 91 120.115 120.115 121.124 -1.009 17635 2314 1 4 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.580 0.093 17635 2315 1 4 . 1 1 91 91 PHE C C 91 173.349 173.349 175.292 -1.943 17635 2316 1 4 . 1 1 91 91 PHE CA C 91 61.155 61.155 58.949 2.206 17635 2317 1 4 . 1 1 91 91 PHE CB C 91 39.503 39.503 39.112 0.391 17635 2318 1 4 . 1 1 91 91 PHE H H 91 8.919 8.919 8.665 0.254 17635 2319 1 4 . 1 1 92 92 ALA N N 92 124.386 124.386 129.649 -5.263 17635 2320 1 4 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.372 -0.016 17635 2321 1 4 . 1 1 92 92 ALA C C 92 172.984 172.984 176.213 -3.229 17635 2322 1 4 . 1 1 92 92 ALA CA C 92 52.098 52.098 50.968 1.130 17635 2323 1 4 . 1 1 92 92 ALA CB C 92 19.406 19.406 21.060 -1.654 17635 2324 1 4 . 1 1 92 92 ALA H H 92 8.563 8.563 8.516 0.047 17635 2325 1 4 . 1 1 93 93 THR N N 93 116.073 116.073 113.926 2.147 17635 2326 1 4 . 1 1 93 93 THR HA H 93 4.208 4.208 4.428 -0.220 17635 2327 1 4 . 1 1 93 93 THR C C 93 176.032 176.032 174.165 1.867 17635 2328 1 4 . 1 1 93 93 THR CA C 93 62.255 62.255 61.748 0.507 17635 2329 1 4 . 1 1 93 93 THR CB C 93 69.708 69.708 69.466 0.242 17635 2330 1 4 . 1 1 93 93 THR H H 93 8.312 8.312 8.185 0.127 17635 2331 1 4 . 1 1 94 94 ARG N N 94 124.359 124.359 126.870 -2.511 17635 2332 1 4 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.478 -0.141 17635 2333 1 4 . 1 1 94 94 ARG C C 94 174.426 174.426 176.593 -2.167 17635 2334 1 4 . 1 1 94 94 ARG CA C 94 56.055 56.055 55.460 0.595 17635 2335 1 4 . 1 1 94 94 ARG CB C 94 30.911 30.911 31.053 -0.142 17635 2336 1 4 . 1 1 94 94 ARG H H 94 8.493 8.493 8.830 -0.337 17635 2337 1 4 . 1 1 95 95 ARG N N 95 122.515 122.515 118.397 4.118 17635 2338 1 4 . 1 1 95 95 ARG HA H 95 4.228 4.228 3.858 0.370 17635 2339 1 4 . 1 1 95 95 ARG C C 95 174.306 174.306 175.327 -1.021 17635 2340 1 4 . 1 1 95 95 ARG CA C 95 56.142 56.142 57.989 -1.847 17635 2341 1 4 . 1 1 95 95 ARG CB C 95 30.966 30.966 28.603 2.363 17635 2342 1 4 . 1 1 95 95 ARG H H 95 8.343 8.343 8.190 0.153 17635 2343 1 4 . 1 1 96 96 ALA N N 96 125.127 125.127 124.999 0.128 17635 2344 1 4 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.161 0.048 17635 2345 1 4 . 1 1 96 96 ALA C C 96 173.226 173.226 176.298 -3.072 17635 2346 1 4 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.734 0.036 17635 2347 1 4 . 1 1 96 96 ALA CB C 96 19.193 19.193 18.602 0.591 17635 2348 1 4 . 1 1 96 96 ALA H H 96 8.402 8.402 8.127 0.275 17635 2349 1 4 . 1 1 97 97 ASP N N 97 118.483 118.483 121.903 -3.420 17635 2350 1 4 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.831 -0.333 17635 2351 1 4 . 1 1 97 97 ASP C C 97 174.302 174.302 174.419 -0.117 17635 2352 1 4 . 1 1 97 97 ASP CA C 97 54.091 54.091 53.749 0.342 17635 2353 1 4 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.914 -0.007 17635 2354 1 4 . 1 1 97 97 ASP H H 97 8.206 8.206 8.161 0.045 17635 2355 1 4 . 1 1 98 98 PHE N N 98 120.321 120.321 122.515 -2.194 17635 2356 1 4 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.692 -0.202 17635 2357 1 4 . 1 1 98 98 PHE C C 98 174.878 174.878 175.984 -1.106 17635 2358 1 4 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.224 -0.064 17635 2359 1 4 . 1 1 98 98 PHE CB C 98 39.303 39.303 40.510 -1.207 17635 2360 1 4 . 1 1 98 98 PHE H H 98 7.990 7.990 8.315 -0.325 17635 2361 1 4 . 1 1 99 99 ASN N N 99 120.016 120.016 117.977 2.039 17635 2362 1 4 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.780 -0.171 17635 2363 1 4 . 1 1 99 99 ASN C C 99 175.348 175.348 174.498 0.850 17635 2364 1 4 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.408 -0.095 17635 2365 1 4 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.991 -0.264 17635 2366 1 4 . 1 1 99 99 ASN H H 99 8.336 8.336 8.405 -0.069 17635 2367 1 4 . 1 1 100 100 ARG N N 100 121.374 121.374 120.008 1.366 17635 2368 1 4 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.718 -0.445 17635 2369 1 4 . 1 1 100 100 ARG C C 100 173.627 173.627 176.779 -3.152 17635 2370 1 4 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.800 0.692 17635 2371 1 4 . 1 1 100 100 ARG CB C 100 30.519 30.519 31.214 -0.695 17635 2372 1 4 . 1 1 100 100 ARG H H 100 8.181 8.181 7.983 0.198 17635 2373 1 4 . 1 1 101 101 GLY N N 101 109.586 109.586 106.385 3.201 17635 2374 1 4 . 1 1 101 101 GLY C C 101 175.739 175.739 173.826 1.913 17635 2375 1 4 . 1 1 101 101 GLY CA C 101 45.380 45.380 45.137 0.243 17635 2376 1 4 . 1 1 101 101 GLY H H 101 8.413 8.413 8.576 -0.163 17635 2377 1 4 . 1 1 102 102 GLY N N 102 108.692 108.692 109.732 -1.040 17635 2378 1 4 . 1 1 102 102 GLY C C 102 176.286 176.286 174.399 1.887 17635 2379 1 4 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.985 0.353 17635 2380 1 4 . 1 1 102 102 GLY H H 102 8.281 8.281 8.090 0.191 17635 2381 1 4 . 1 1 103 103 GLY N N 103 108.844 108.844 109.359 -0.515 17635 2382 1 4 . 1 1 103 103 GLY C C 103 175.798 175.798 174.598 1.200 17635 2383 1 4 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.988 0.358 17635 2384 1 4 . 1 1 103 103 GLY H H 103 8.364 8.364 8.545 -0.181 17635 2385 1 4 . 1 1 104 104 ASN N N 104 118.527 118.527 118.870 -0.343 17635 2386 1 4 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.881 -0.163 17635 2387 1 4 . 1 1 104 104 ASN C C 104 174.547 174.547 175.445 -0.898 17635 2388 1 4 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.803 0.405 17635 2389 1 4 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.872 0.007 17635 2390 1 4 . 1 1 104 104 ASN H H 104 8.438 8.438 8.618 -0.180 17635 2391 1 4 . 1 1 105 105 GLY N N 105 109.166 109.166 109.954 -0.788 17635 2392 1 4 . 1 1 105 105 GLY C C 105 176.074 176.074 173.940 2.134 17635 2393 1 4 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.037 0.565 17635 2394 1 4 . 1 1 105 105 GLY H H 105 8.477 8.477 8.182 0.295 17635 2395 1 4 . 1 1 106 106 ARG N N 106 120.341 120.341 122.910 -2.569 17635 2396 1 4 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.666 -0.315 17635 2397 1 4 . 1 1 106 106 ARG C C 106 173.491 173.491 176.555 -3.064 17635 2398 1 4 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.754 0.473 17635 2399 1 4 . 1 1 106 106 ARG CB C 106 30.629 30.629 31.706 -1.077 17635 2400 1 4 . 1 1 106 106 ARG H H 106 8.244 8.244 7.736 0.508 17635 2401 1 4 . 1 1 107 107 GLY N N 107 109.856 109.856 112.393 -2.537 17635 2402 1 4 . 1 1 107 107 GLY C C 107 175.834 175.834 174.789 1.045 17635 2403 1 4 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.948 0.493 17635 2404 1 4 . 1 1 107 107 GLY H H 107 8.522 8.522 8.665 -0.143 17635 2405 1 5 . 1 1 2 2 GLN N N 2 121.692 121.692 118.813 2.879 17635 2406 1 5 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.047 0.219 17635 2407 1 5 . 1 1 2 2 GLN C C 2 175.248 175.248 174.797 0.451 17635 2408 1 5 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.196 -0.200 17635 2409 1 5 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.530 1.109 17635 2410 1 5 . 1 1 2 2 GLN H H 2 8.621 8.621 8.353 0.268 17635 2411 1 5 . 1 1 3 3 ASP N N 3 121.801 121.801 122.760 -0.959 17635 2412 1 5 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.707 -0.139 17635 2413 1 5 . 1 1 3 3 ASP C C 3 174.336 174.336 175.712 -1.376 17635 2414 1 5 . 1 1 3 3 ASP CA C 3 54.062 54.062 53.196 0.866 17635 2415 1 5 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.569 0.502 17635 2416 1 5 . 1 1 3 3 ASP H H 3 8.436 8.436 8.729 -0.293 17635 2417 1 5 . 1 1 4 4 ASN N N 4 120.292 120.292 119.253 1.039 17635 2418 1 5 . 1 1 4 4 ASN HA H 4 4.637 4.637 5.289 -0.652 17635 2419 1 5 . 1 1 4 4 ASN C C 4 174.415 174.415 175.117 -0.702 17635 2420 1 5 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.097 0.764 17635 2421 1 5 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.129 0.405 17635 2422 1 5 . 1 1 4 4 ASN H H 4 8.528 8.528 7.798 0.730 17635 2423 1 5 . 1 1 5 5 SER N N 5 117.091 117.091 115.943 1.148 17635 2424 1 5 . 1 1 5 5 SER HA H 5 4.163 4.163 4.401 -0.238 17635 2425 1 5 . 1 1 5 5 SER C C 5 176.370 176.370 175.091 1.279 17635 2426 1 5 . 1 1 5 5 SER CA C 5 60.846 60.846 60.467 0.379 17635 2427 1 5 . 1 1 5 5 SER CB C 5 63.136 63.136 63.920 -0.784 17635 2428 1 5 . 1 1 5 5 SER H H 5 8.470 8.470 8.065 0.405 17635 2429 1 5 . 1 1 6 6 ASP N N 6 119.436 119.436 117.989 1.447 17635 2430 1 5 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.786 -0.091 17635 2431 1 5 . 1 1 6 6 ASP C C 6 175.048 175.048 175.200 -0.152 17635 2432 1 5 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.106 -0.012 17635 2433 1 5 . 1 1 6 6 ASP CB C 6 40.935 40.935 41.526 -0.591 17635 2434 1 5 . 1 1 6 6 ASP H H 6 8.218 8.218 8.558 -0.340 17635 2435 1 5 . 1 1 7 7 ASN N N 7 119.696 119.696 116.972 2.724 17635 2436 1 5 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.784 -0.156 17635 2437 1 5 . 1 1 7 7 ASN C C 7 176.539 176.539 174.839 1.700 17635 2438 1 5 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.900 -0.742 17635 2439 1 5 . 1 1 7 7 ASN CB C 7 38.859 38.859 39.416 -0.557 17635 2440 1 5 . 1 1 7 7 ASN H H 7 7.734 7.734 8.120 -0.386 17635 2441 1 5 . 1 1 8 8 ASN N N 8 119.436 119.436 116.514 2.922 17635 2442 1 5 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.699 0.169 17635 2443 1 5 . 1 1 8 8 ASN C C 8 175.327 175.327 174.329 0.998 17635 2444 1 5 . 1 1 8 8 ASN CA C 8 53.204 53.204 53.855 -0.651 17635 2445 1 5 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.269 -0.774 17635 2446 1 5 . 1 1 8 8 ASN H H 8 8.350 8.350 8.715 -0.365 17635 2447 1 5 . 1 1 9 9 THR N N 9 118.650 118.650 117.763 0.887 17635 2448 1 5 . 1 1 9 9 THR HA H 9 5.557 5.557 4.739 0.818 17635 2449 1 5 . 1 1 9 9 THR C C 9 177.117 177.117 173.438 3.679 17635 2450 1 5 . 1 1 9 9 THR CA C 9 62.314 62.314 62.833 -0.519 17635 2451 1 5 . 1 1 9 9 THR CB C 9 71.225 71.225 68.689 2.536 17635 2452 1 5 . 1 1 9 9 THR H H 9 8.428 8.428 7.930 0.498 17635 2453 1 5 . 1 1 10 10 ILE N N 10 118.556 118.556 121.222 -2.666 17635 2454 1 5 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.410 0.755 17635 2455 1 5 . 1 1 10 10 ILE C C 10 176.837 176.837 173.760 3.077 17635 2456 1 5 . 1 1 10 10 ILE CA C 10 59.298 59.298 59.706 -0.408 17635 2457 1 5 . 1 1 10 10 ILE CB C 10 39.880 39.880 39.546 0.334 17635 2458 1 5 . 1 1 10 10 ILE H H 10 8.770 8.770 8.503 0.267 17635 2459 1 5 . 1 1 11 11 PHE N N 11 123.798 123.798 118.926 4.872 17635 2460 1 5 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.210 0.210 17635 2461 1 5 . 1 1 11 11 PHE C C 11 177.066 177.066 175.416 1.650 17635 2462 1 5 . 1 1 11 11 PHE CA C 11 55.362 55.362 56.337 -0.975 17635 2463 1 5 . 1 1 11 11 PHE CB C 11 41.868 41.868 40.866 1.002 17635 2464 1 5 . 1 1 11 11 PHE H H 11 9.548 9.548 8.376 1.172 17635 2465 1 5 . 1 1 12 12 VAL N N 12 127.993 127.993 123.288 4.705 17635 2466 1 5 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.627 0.331 17635 2467 1 5 . 1 1 12 12 VAL C C 12 176.965 176.965 175.274 1.691 17635 2468 1 5 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.357 -1.522 17635 2469 1 5 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.197 2.603 17635 2470 1 5 . 1 1 12 12 VAL H H 12 8.940 8.940 9.281 -0.341 17635 2471 1 5 . 1 1 13 13 GLN N N 13 122.289 122.289 126.233 -3.944 17635 2472 1 5 . 1 1 13 13 GLN HA H 13 4.779 4.779 5.098 -0.319 17635 2473 1 5 . 1 1 13 13 GLN C C 13 175.631 175.631 176.386 -0.755 17635 2474 1 5 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.954 0.156 17635 2475 1 5 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.591 3.541 17635 2476 1 5 . 1 1 13 13 GLN H H 13 8.747 8.747 8.155 0.592 17635 2477 1 5 . 1 1 14 14 GLY N N 14 109.212 109.212 111.824 -2.612 17635 2478 1 5 . 1 1 14 14 GLY C C 14 175.436 175.436 173.777 1.659 17635 2479 1 5 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.051 0.379 17635 2480 1 5 . 1 1 14 14 GLY H H 14 8.236 8.236 9.222 -0.986 17635 2481 1 5 . 1 1 15 15 LEU N N 15 117.824 117.824 120.969 -3.145 17635 2482 1 5 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.026 -0.320 17635 2483 1 5 . 1 1 15 15 LEU C C 15 174.111 174.111 178.121 -4.010 17635 2484 1 5 . 1 1 15 15 LEU CA C 15 55.718 55.718 56.550 -0.832 17635 2485 1 5 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.614 0.819 17635 2486 1 5 . 1 1 15 15 LEU H H 15 8.442 8.442 7.473 0.969 17635 2487 1 5 . 1 1 16 16 GLY N N 16 105.063 105.063 106.105 -1.042 17635 2488 1 5 . 1 1 16 16 GLY C C 16 177.771 177.771 174.145 3.626 17635 2489 1 5 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.121 -1.028 17635 2490 1 5 . 1 1 16 16 GLY H H 16 8.006 8.006 7.992 0.014 17635 2491 1 5 . 1 1 17 17 GLU N N 17 113.781 113.781 121.700 -7.919 17635 2492 1 5 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.528 -0.409 17635 2493 1 5 . 1 1 17 17 GLU C C 17 173.937 173.937 174.853 -0.916 17635 2494 1 5 . 1 1 17 17 GLU CA C 17 57.281 57.281 55.669 1.612 17635 2495 1 5 . 1 1 17 17 GLU CB C 17 30.436 30.436 30.103 0.333 17635 2496 1 5 . 1 1 17 17 GLU H H 17 8.134 8.134 8.513 -0.379 17635 2497 1 5 . 1 1 18 18 ASN N N 18 116.660 116.660 116.009 0.651 17635 2498 1 5 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.574 0.367 17635 2499 1 5 . 1 1 18 18 ASN C C 18 175.900 175.900 174.403 1.497 17635 2500 1 5 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.099 0.379 17635 2501 1 5 . 1 1 18 18 ASN CB C 18 38.485 38.485 38.542 -0.057 17635 2502 1 5 . 1 1 18 18 ASN H H 18 8.407 8.407 7.796 0.611 17635 2503 1 5 . 1 1 19 19 VAL N N 19 118.323 118.323 122.430 -4.107 17635 2504 1 5 . 1 1 19 19 VAL HA H 19 4.152 4.152 4.048 0.104 17635 2505 1 5 . 1 1 19 19 VAL C C 19 177.655 177.655 175.433 2.222 17635 2506 1 5 . 1 1 19 19 VAL CA C 19 61.877 61.877 62.813 -0.937 17635 2507 1 5 . 1 1 19 19 VAL CB C 19 32.513 32.513 29.323 3.190 17635 2508 1 5 . 1 1 19 19 VAL H H 19 6.855 6.855 8.015 -1.160 17635 2509 1 5 . 1 1 20 20 THR N N 20 111.636 111.636 116.566 -4.930 17635 2510 1 5 . 1 1 20 20 THR HA H 20 4.719 4.719 4.571 0.148 17635 2511 1 5 . 1 1 20 20 THR C C 20 175.266 175.266 174.858 0.408 17635 2512 1 5 . 1 1 20 20 THR CA C 20 58.698 58.698 60.197 -1.500 17635 2513 1 5 . 1 1 20 20 THR CB C 20 72.948 72.948 72.112 0.836 17635 2514 1 5 . 1 1 20 20 THR H H 20 7.328 7.328 7.822 -0.494 17635 2515 1 5 . 1 1 21 21 ILE N N 21 122.147 122.147 123.548 -1.401 17635 2516 1 5 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.705 -0.187 17635 2517 1 5 . 1 1 21 21 ILE C C 21 173.198 173.198 177.440 -4.242 17635 2518 1 5 . 1 1 21 21 ILE CA C 21 65.772 65.772 65.038 0.734 17635 2519 1 5 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.693 -0.110 17635 2520 1 5 . 1 1 21 21 ILE H H 21 9.074 9.074 8.669 0.405 17635 2521 1 5 . 1 1 22 22 GLU N N 22 118.154 118.154 119.927 -1.773 17635 2522 1 5 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.024 -0.038 17635 2523 1 5 . 1 1 22 22 GLU C C 22 171.799 171.799 178.488 -6.689 17635 2524 1 5 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.621 0.992 17635 2525 1 5 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.368 0.423 17635 2526 1 5 . 1 1 22 22 GLU H H 22 8.814 8.814 8.372 0.442 17635 2527 1 5 . 1 1 23 23 SER N N 23 115.921 115.921 114.694 1.227 17635 2528 1 5 . 1 1 23 23 SER HA H 23 4.384 4.384 4.290 0.094 17635 2529 1 5 . 1 1 23 23 SER C C 23 172.447 172.447 176.491 -4.044 17635 2530 1 5 . 1 1 23 23 SER CA C 23 61.239 61.239 61.786 -0.547 17635 2531 1 5 . 1 1 23 23 SER CB C 23 62.838 62.838 62.828 0.010 17635 2532 1 5 . 1 1 23 23 SER H H 23 8.236 8.236 8.226 0.010 17635 2533 1 5 . 1 1 24 24 VAL N N 24 124.867 124.867 121.120 3.747 17635 2534 1 5 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.173 -0.425 17635 2535 1 5 . 1 1 24 24 VAL C C 24 173.016 173.016 177.630 -4.614 17635 2536 1 5 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.186 1.068 17635 2537 1 5 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.823 -0.290 17635 2538 1 5 . 1 1 24 24 VAL H H 24 7.973 7.973 7.810 0.163 17635 2539 1 5 . 1 1 25 25 ALA N N 25 123.198 123.198 121.577 1.621 17635 2540 1 5 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.046 -0.147 17635 2541 1 5 . 1 1 25 25 ALA C C 25 171.061 171.061 178.614 -7.553 17635 2542 1 5 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.821 0.874 17635 2543 1 5 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.337 -0.599 17635 2544 1 5 . 1 1 25 25 ALA H H 25 8.695 8.695 8.429 0.266 17635 2545 1 5 . 1 1 26 26 ASP N N 26 115.503 115.503 118.115 -2.612 17635 2546 1 5 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.545 -0.222 17635 2547 1 5 . 1 1 26 26 ASP C C 26 173.108 173.108 178.166 -5.058 17635 2548 1 5 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.545 0.778 17635 2549 1 5 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.388 -0.336 17635 2550 1 5 . 1 1 26 26 ASP H H 26 8.312 8.312 8.280 0.032 17635 2551 1 5 . 1 1 27 27 TYR N N 27 119.224 119.224 118.441 0.783 17635 2552 1 5 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.623 -0.423 17635 2553 1 5 . 1 1 27 27 TYR C C 27 172.908 172.908 176.227 -3.319 17635 2554 1 5 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.556 2.460 17635 2555 1 5 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.357 0.575 17635 2556 1 5 . 1 1 27 27 TYR H H 27 7.533 7.533 7.911 -0.378 17635 2557 1 5 . 1 1 28 28 PHE N N 28 112.595 112.595 120.226 -7.631 17635 2558 1 5 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.083 0.247 17635 2559 1 5 . 1 1 28 28 PHE C C 28 173.082 173.082 174.829 -1.747 17635 2560 1 5 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.871 5.913 17635 2561 1 5 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.452 1.551 17635 2562 1 5 . 1 1 28 28 PHE H H 28 7.974 7.974 8.177 -0.203 17635 2563 1 5 . 1 1 29 29 LYS N N 29 118.820 118.820 117.373 1.447 17635 2564 1 5 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.886 0.031 17635 2565 1 5 . 1 1 29 29 LYS C C 29 173.682 173.682 176.586 -2.904 17635 2566 1 5 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.826 2.454 17635 2567 1 5 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.540 -1.249 17635 2568 1 5 . 1 1 29 29 LYS H H 29 8.325 8.325 7.945 0.380 17635 2569 1 5 . 1 1 30 30 GLN N N 30 116.232 116.232 118.603 -2.371 17635 2570 1 5 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.294 -0.159 17635 2571 1 5 . 1 1 30 30 GLN C C 30 173.790 173.790 177.066 -3.276 17635 2572 1 5 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.937 -0.391 17635 2573 1 5 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.170 0.728 17635 2574 1 5 . 1 1 30 30 GLN H H 30 7.518 7.518 8.212 -0.694 17635 2575 1 5 . 1 1 31 31 ILE N N 31 116.489 116.489 117.543 -1.054 17635 2576 1 5 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.051 0.188 17635 2577 1 5 . 1 1 31 31 ILE C C 31 175.599 175.599 175.631 -0.032 17635 2578 1 5 . 1 1 31 31 ILE CA C 31 58.221 58.221 62.093 -3.873 17635 2579 1 5 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.713 1.621 17635 2580 1 5 . 1 1 31 31 ILE H H 31 7.809 7.809 8.528 -0.719 17635 2581 1 5 . 1 1 32 32 GLY N N 32 107.416 107.416 104.545 2.871 17635 2582 1 5 . 1 1 32 32 GLY C C 32 180.182 180.182 172.605 7.577 17635 2583 1 5 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.741 0.253 17635 2584 1 5 . 1 1 32 32 GLY H H 32 7.344 7.344 7.788 -0.444 17635 2585 1 5 . 1 1 33 33 ILE N N 33 117.784 117.784 120.780 -2.996 17635 2586 1 5 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.475 -0.386 17635 2587 1 5 . 1 1 33 33 ILE C C 33 173.301 173.301 175.058 -1.757 17635 2588 1 5 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.687 0.954 17635 2589 1 5 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.640 -0.981 17635 2590 1 5 . 1 1 33 33 ILE H H 33 8.173 8.173 8.482 -0.309 17635 2591 1 5 . 1 1 34 34 ILE N N 34 131.781 131.781 126.385 5.396 17635 2592 1 5 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.109 -0.322 17635 2593 1 5 . 1 1 34 34 ILE C C 34 174.663 174.663 175.611 -0.948 17635 2594 1 5 . 1 1 34 34 ILE CA C 34 61.370 61.370 59.315 2.055 17635 2595 1 5 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.893 -0.898 17635 2596 1 5 . 1 1 34 34 ILE H H 34 8.687 8.687 8.416 0.271 17635 2597 1 5 . 1 1 35 35 LYS N N 35 130.372 130.372 127.475 2.897 17635 2598 1 5 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.040 0.044 17635 2599 1 5 . 1 1 35 35 LYS C C 35 175.376 175.376 176.512 -1.136 17635 2600 1 5 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.206 0.267 17635 2601 1 5 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.638 2.026 17635 2602 1 5 . 1 1 35 35 LYS H H 35 8.680 8.680 8.615 0.065 17635 2603 1 5 . 1 1 36 36 THR N N 36 118.312 118.312 120.725 -2.413 17635 2604 1 5 . 1 1 36 36 THR HA H 36 4.415 4.415 4.248 0.167 17635 2605 1 5 . 1 1 36 36 THR C C 36 176.394 176.394 173.977 2.417 17635 2606 1 5 . 1 1 36 36 THR CA C 36 61.340 61.340 64.018 -2.678 17635 2607 1 5 . 1 1 36 36 THR CB C 36 70.809 70.809 69.525 1.284 17635 2608 1 5 . 1 1 36 36 THR H H 36 8.456 8.456 8.643 -0.187 17635 2609 1 5 . 1 1 37 37 ASN N N 37 124.092 124.092 120.850 3.242 17635 2610 1 5 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.859 -0.329 17635 2611 1 5 . 1 1 37 37 ASN C C 37 174.235 174.235 176.067 -1.832 17635 2612 1 5 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.739 1.325 17635 2613 1 5 . 1 1 37 37 ASN CB C 37 38.927 38.927 40.758 -1.831 17635 2614 1 5 . 1 1 37 37 ASN H H 37 8.794 8.794 8.882 -0.088 17635 2615 1 5 . 1 1 38 38 LYS N N 38 127.969 127.969 125.132 2.837 17635 2616 1 5 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.185 -0.181 17635 2617 1 5 . 1 1 38 38 LYS C C 38 172.702 172.702 176.988 -4.286 17635 2618 1 5 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.120 0.338 17635 2619 1 5 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.919 0.248 17635 2620 1 5 . 1 1 38 38 LYS H H 38 8.962 8.962 8.762 0.200 17635 2621 1 5 . 1 1 39 39 LYS N N 39 117.413 117.413 118.357 -0.944 17635 2622 1 5 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.287 -0.029 17635 2623 1 5 . 1 1 39 39 LYS C C 39 172.261 172.261 177.213 -4.952 17635 2624 1 5 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.310 0.008 17635 2625 1 5 . 1 1 39 39 LYS CB C 39 32.797 32.797 33.293 -0.496 17635 2626 1 5 . 1 1 39 39 LYS H H 39 8.314 8.314 8.362 -0.048 17635 2627 1 5 . 1 1 40 40 THR N N 40 105.547 105.547 108.033 -2.486 17635 2628 1 5 . 1 1 40 40 THR HA H 40 4.465 4.465 4.503 -0.038 17635 2629 1 5 . 1 1 40 40 THR C C 40 174.021 174.021 175.931 -1.910 17635 2630 1 5 . 1 1 40 40 THR CA C 40 61.260 61.260 61.500 -0.240 17635 2631 1 5 . 1 1 40 40 THR CB C 40 70.997 70.997 70.507 0.490 17635 2632 1 5 . 1 1 40 40 THR H H 40 7.422 7.422 7.525 -0.103 17635 2633 1 5 . 1 1 41 41 GLY N N 41 111.631 111.631 111.884 -0.253 17635 2634 1 5 . 1 1 41 41 GLY C C 41 176.727 176.727 173.709 3.018 17635 2635 1 5 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.419 0.311 17635 2636 1 5 . 1 1 41 41 GLY H H 41 8.644 8.644 8.718 -0.074 17635 2637 1 5 . 1 1 42 42 GLN N N 42 118.894 118.894 117.649 1.245 17635 2638 1 5 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.835 -0.166 17635 2639 1 5 . 1 1 42 42 GLN C C 42 177.178 177.178 173.258 3.920 17635 2640 1 5 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.109 1.472 17635 2641 1 5 . 1 1 42 42 GLN CB C 42 29.230 29.230 28.627 0.603 17635 2642 1 5 . 1 1 42 42 GLN H H 42 7.662 7.662 7.657 0.005 17635 2643 1 5 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.321 0.274 17635 2644 1 5 . 1 1 43 43 PRO C C 43 172.629 172.629 176.375 -3.746 17635 2645 1 5 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.816 -0.994 17635 2646 1 5 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.061 0.635 17635 2647 1 5 . 1 1 44 44 MET N N 44 124.162 124.162 121.805 2.357 17635 2648 1 5 . 1 1 44 44 MET HA H 44 4.432 4.432 4.523 -0.091 17635 2649 1 5 . 1 1 44 44 MET C C 44 176.474 176.474 174.942 1.532 17635 2650 1 5 . 1 1 44 44 MET CA C 44 55.419 55.419 55.156 0.263 17635 2651 1 5 . 1 1 44 44 MET CB C 44 30.555 30.555 34.417 -3.862 17635 2652 1 5 . 1 1 44 44 MET H H 44 8.874 8.874 8.470 0.404 17635 2653 1 5 . 1 1 45 45 ILE N N 45 126.237 126.237 121.779 4.458 17635 2654 1 5 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.563 0.239 17635 2655 1 5 . 1 1 45 45 ILE C C 45 176.415 176.415 174.188 2.227 17635 2656 1 5 . 1 1 45 45 ILE CA C 45 59.216 59.216 59.698 -0.482 17635 2657 1 5 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.671 -0.445 17635 2658 1 5 . 1 1 45 45 ILE H H 45 7.730 7.730 8.246 -0.516 17635 2659 1 5 . 1 1 46 46 ASN N N 46 124.735 124.735 124.011 0.724 17635 2660 1 5 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.877 0.064 17635 2661 1 5 . 1 1 46 46 ASN C C 46 176.836 176.836 173.313 3.523 17635 2662 1 5 . 1 1 46 46 ASN CA C 46 51.561 51.561 51.775 -0.214 17635 2663 1 5 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.183 0.287 17635 2664 1 5 . 1 1 46 46 ASN H H 46 8.384 8.384 8.351 0.033 17635 2665 1 5 . 1 1 47 47 LEU N N 47 122.487 122.487 124.983 -2.496 17635 2666 1 5 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.723 -0.008 17635 2667 1 5 . 1 1 47 47 LEU C C 47 174.190 174.190 176.440 -2.250 17635 2668 1 5 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.118 -0.786 17635 2669 1 5 . 1 1 47 47 LEU CB C 47 42.277 42.277 42.987 -0.710 17635 2670 1 5 . 1 1 47 47 LEU H H 47 8.594 8.594 8.406 0.188 17635 2671 1 5 . 1 1 48 48 TYR N N 48 121.842 121.842 125.564 -3.722 17635 2672 1 5 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.816 -0.049 17635 2673 1 5 . 1 1 48 48 TYR C C 48 173.649 173.649 174.664 -1.015 17635 2674 1 5 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.807 1.087 17635 2675 1 5 . 1 1 48 48 TYR CB C 48 39.199 39.199 37.446 1.753 17635 2676 1 5 . 1 1 48 48 TYR H H 48 7.666 7.666 9.175 -1.509 17635 2677 1 5 . 1 1 49 49 THR N N 49 116.554 116.554 113.231 3.323 17635 2678 1 5 . 1 1 49 49 THR HA H 49 4.806 4.806 4.681 0.125 17635 2679 1 5 . 1 1 49 49 THR C C 49 176.654 176.654 172.910 3.744 17635 2680 1 5 . 1 1 49 49 THR CA C 49 60.693 60.693 59.583 1.110 17635 2681 1 5 . 1 1 49 49 THR CB C 49 71.437 71.437 71.530 -0.093 17635 2682 1 5 . 1 1 49 49 THR H H 49 8.965 8.965 7.811 1.154 17635 2683 1 5 . 1 1 50 50 ASP N N 50 123.826 123.826 119.938 3.888 17635 2684 1 5 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.589 0.035 17635 2685 1 5 . 1 1 50 50 ASP C C 50 173.380 173.380 175.625 -2.245 17635 2686 1 5 . 1 1 50 50 ASP CA C 50 54.088 54.088 53.775 0.313 17635 2687 1 5 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.090 0.777 17635 2688 1 5 . 1 1 50 50 ASP H H 50 8.939 8.939 8.659 0.280 17635 2689 1 5 . 1 1 51 51 ARG N N 51 127.794 127.794 120.282 7.512 17635 2690 1 5 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.347 -0.302 17635 2691 1 5 . 1 1 51 51 ARG C C 51 173.101 173.101 175.926 -2.825 17635 2692 1 5 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.940 1.622 17635 2693 1 5 . 1 1 51 51 ARG CB C 51 30.167 30.167 31.222 -1.055 17635 2694 1 5 . 1 1 51 51 ARG H H 51 8.958 8.958 8.424 0.534 17635 2695 1 5 . 1 1 52 52 GLU N N 52 117.542 117.542 115.425 2.117 17635 2696 1 5 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.511 -0.233 17635 2697 1 5 . 1 1 52 52 GLU C C 52 172.201 172.201 175.099 -2.898 17635 2698 1 5 . 1 1 52 52 GLU CA C 52 58.524 58.524 56.666 1.859 17635 2699 1 5 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.134 0.144 17635 2700 1 5 . 1 1 52 52 GLU H H 52 8.561 8.561 7.911 0.650 17635 2701 1 5 . 1 1 53 53 THR N N 53 107.065 107.065 112.368 -5.303 17635 2702 1 5 . 1 1 53 53 THR HA H 53 4.436 4.436 4.527 -0.091 17635 2703 1 5 . 1 1 53 53 THR C C 53 173.851 173.851 174.868 -1.017 17635 2704 1 5 . 1 1 53 53 THR CA C 53 61.944 61.944 63.879 -1.935 17635 2705 1 5 . 1 1 53 53 THR CB C 53 71.197 71.197 69.855 1.342 17635 2706 1 5 . 1 1 53 53 THR H H 53 8.087 8.087 8.269 -0.182 17635 2707 1 5 . 1 1 54 54 GLY N N 54 111.295 111.295 108.599 2.696 17635 2708 1 5 . 1 1 54 54 GLY C C 54 176.747 176.747 174.728 2.019 17635 2709 1 5 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.059 0.644 17635 2710 1 5 . 1 1 54 54 GLY H H 54 8.423 8.423 7.997 0.426 17635 2711 1 5 . 1 1 55 55 LYS N N 55 119.673 119.673 120.794 -1.121 17635 2712 1 5 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.232 0.121 17635 2713 1 5 . 1 1 55 55 LYS C C 55 173.854 173.854 177.018 -3.164 17635 2714 1 5 . 1 1 55 55 LYS CA C 55 55.842 55.842 57.238 -1.396 17635 2715 1 5 . 1 1 55 55 LYS CB C 55 33.821 33.821 32.856 0.965 17635 2716 1 5 . 1 1 55 55 LYS H H 55 7.767 7.767 7.892 -0.125 17635 2717 1 5 . 1 1 56 56 LEU N N 56 122.426 122.426 119.584 2.842 17635 2718 1 5 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.149 0.207 17635 2719 1 5 . 1 1 56 56 LEU C C 56 172.534 172.534 176.572 -4.038 17635 2720 1 5 . 1 1 56 56 LEU CA C 56 56.255 56.255 55.379 0.876 17635 2721 1 5 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.060 -0.406 17635 2722 1 5 . 1 1 56 56 LEU H H 56 8.768 8.768 8.113 0.655 17635 2723 1 5 . 1 1 57 57 LYS N N 57 118.264 118.264 123.818 -5.554 17635 2724 1 5 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.421 -0.133 17635 2725 1 5 . 1 1 57 57 LYS C C 57 173.648 173.648 177.107 -3.459 17635 2726 1 5 . 1 1 57 57 LYS CA C 57 56.264 56.264 55.580 0.684 17635 2727 1 5 . 1 1 57 57 LYS CB C 57 34.062 34.062 33.171 0.891 17635 2728 1 5 . 1 1 57 57 LYS H H 57 8.012 8.012 8.495 -0.483 17635 2729 1 5 . 1 1 58 58 GLY N N 58 108.514 108.514 107.909 0.605 17635 2730 1 5 . 1 1 58 58 GLY C C 58 177.876 177.876 173.199 4.677 17635 2731 1 5 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.540 0.824 17635 2732 1 5 . 1 1 58 58 GLY H H 58 8.334 8.334 8.499 -0.165 17635 2733 1 5 . 1 1 59 59 GLU N N 59 116.119 116.119 119.059 -2.940 17635 2734 1 5 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.222 0.299 17635 2735 1 5 . 1 1 59 59 GLU C C 59 173.860 173.860 174.192 -0.332 17635 2736 1 5 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.477 -2.452 17635 2737 1 5 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.935 0.369 17635 2738 1 5 . 1 1 59 59 GLU H H 59 7.202 7.202 7.730 -0.528 17635 2739 1 5 . 1 1 60 60 ALA N N 60 123.607 123.607 126.510 -2.903 17635 2740 1 5 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.596 0.011 17635 2741 1 5 . 1 1 60 60 ALA C C 60 173.923 173.923 175.632 -1.709 17635 2742 1 5 . 1 1 60 60 ALA CA C 60 50.943 50.943 50.199 0.744 17635 2743 1 5 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.407 0.652 17635 2744 1 5 . 1 1 60 60 ALA H H 60 8.930 8.930 9.325 -0.395 17635 2745 1 5 . 1 1 61 61 THR N N 61 108.384 108.384 113.081 -4.697 17635 2746 1 5 . 1 1 61 61 THR HA H 61 5.743 5.743 4.997 0.746 17635 2747 1 5 . 1 1 61 61 THR C C 61 176.172 176.172 173.583 2.589 17635 2748 1 5 . 1 1 61 61 THR CA C 61 59.625 59.625 60.053 -0.428 17635 2749 1 5 . 1 1 61 61 THR CB C 61 71.224 71.224 70.298 0.926 17635 2750 1 5 . 1 1 61 61 THR H H 61 8.452 8.452 8.534 -0.082 17635 2751 1 5 . 1 1 62 62 VAL N N 62 120.200 120.200 127.627 -7.427 17635 2752 1 5 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.037 0.207 17635 2753 1 5 . 1 1 62 62 VAL C C 62 175.994 175.994 174.606 1.388 17635 2754 1 5 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.031 0.395 17635 2755 1 5 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.198 2.487 17635 2756 1 5 . 1 1 62 62 VAL H H 62 8.071 8.071 8.688 -0.617 17635 2757 1 5 . 1 1 63 63 SER N N 63 121.689 121.689 123.543 -1.854 17635 2758 1 5 . 1 1 63 63 SER HA H 63 5.261 5.261 4.653 0.608 17635 2759 1 5 . 1 1 63 63 SER C C 63 177.943 177.943 173.253 4.690 17635 2760 1 5 . 1 1 63 63 SER CA C 63 57.662 57.662 58.763 -1.101 17635 2761 1 5 . 1 1 63 63 SER CB C 63 64.427 64.427 64.139 0.288 17635 2762 1 5 . 1 1 63 63 SER H H 63 7.695 7.695 8.085 -0.390 17635 2763 1 5 . 1 1 64 64 PHE N N 64 122.640 122.640 120.231 2.409 17635 2764 1 5 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.946 -0.092 17635 2765 1 5 . 1 1 64 64 PHE C C 64 174.605 174.605 175.503 -0.898 17635 2766 1 5 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.429 0.775 17635 2767 1 5 . 1 1 64 64 PHE CB C 64 41.976 41.976 43.170 -1.194 17635 2768 1 5 . 1 1 64 64 PHE H H 64 9.025 9.025 7.909 1.116 17635 2769 1 5 . 1 1 65 65 ASP N N 65 119.943 119.943 122.550 -2.607 17635 2770 1 5 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.560 -0.125 17635 2771 1 5 . 1 1 65 65 ASP C C 65 174.396 174.396 176.320 -1.924 17635 2772 1 5 . 1 1 65 65 ASP CA C 65 57.442 57.442 56.531 0.911 17635 2773 1 5 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.652 0.382 17635 2774 1 5 . 1 1 65 65 ASP H H 65 8.512 8.512 8.733 -0.221 17635 2775 1 5 . 1 1 66 66 ASP N N 66 116.125 116.125 119.106 -2.981 17635 2776 1 5 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.127 0.272 17635 2777 1 5 . 1 1 66 66 ASP C C 66 175.936 175.936 174.867 1.069 17635 2778 1 5 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.258 -0.465 17635 2779 1 5 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.712 0.207 17635 2780 1 5 . 1 1 66 66 ASP H H 66 8.323 8.323 8.041 0.282 17635 2781 1 5 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.395 0.055 17635 2782 1 5 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.364 0.560 17635 2783 1 5 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.547 -0.717 17635 2784 1 5 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.219 0.200 17635 2785 1 5 . 1 1 68 68 PRO C C 68 171.345 171.345 179.041 -7.696 17635 2786 1 5 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.874 0.361 17635 2787 1 5 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.996 0.001 17635 2788 1 5 . 1 1 69 69 SER N N 69 114.544 114.544 114.299 0.245 17635 2789 1 5 . 1 1 69 69 SER HA H 69 4.036 4.036 3.859 0.177 17635 2790 1 5 . 1 1 69 69 SER C C 69 176.535 176.535 175.792 0.743 17635 2791 1 5 . 1 1 69 69 SER CA C 69 61.837 61.837 61.713 0.124 17635 2792 1 5 . 1 1 69 69 SER CB C 69 62.773 62.773 62.637 0.136 17635 2793 1 5 . 1 1 69 69 SER H H 69 8.004 8.004 8.204 -0.200 17635 2794 1 5 . 1 1 70 70 ALA N N 70 122.649 122.649 122.067 0.582 17635 2795 1 5 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.411 0.182 17635 2796 1 5 . 1 1 70 70 ALA C C 70 172.686 172.686 179.026 -6.340 17635 2797 1 5 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.109 -0.073 17635 2798 1 5 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.005 -0.141 17635 2799 1 5 . 1 1 70 70 ALA H H 70 7.383 7.383 7.381 0.002 17635 2800 1 5 . 1 1 71 71 LYS N N 71 116.308 116.308 119.661 -3.353 17635 2801 1 5 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.320 0.455 17635 2802 1 5 . 1 1 71 71 LYS C C 71 172.333 172.333 178.322 -5.989 17635 2803 1 5 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.039 0.963 17635 2804 1 5 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.408 1.034 17635 2805 1 5 . 1 1 71 71 LYS H H 71 7.159 7.159 7.169 -0.010 17635 2806 1 5 . 1 1 72 72 ALA N N 72 119.806 119.806 120.656 -0.850 17635 2807 1 5 . 1 1 72 72 ALA HA H 72 4.166 4.166 3.937 0.229 17635 2808 1 5 . 1 1 72 72 ALA C C 72 170.530 170.530 179.462 -8.932 17635 2809 1 5 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.839 -0.124 17635 2810 1 5 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.013 -0.193 17635 2811 1 5 . 1 1 72 72 ALA H H 72 7.924 7.924 7.835 0.089 17635 2812 1 5 . 1 1 73 73 ALA N N 73 120.524 120.524 120.721 -0.197 17635 2813 1 5 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.085 0.194 17635 2814 1 5 . 1 1 73 73 ALA C C 73 171.039 171.039 179.384 -8.345 17635 2815 1 5 . 1 1 73 73 ALA CA C 73 55.379 55.379 55.137 0.242 17635 2816 1 5 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.801 0.330 17635 2817 1 5 . 1 1 73 73 ALA H H 73 8.104 8.104 7.673 0.431 17635 2818 1 5 . 1 1 74 74 ILE N N 74 119.875 119.875 118.236 1.639 17635 2819 1 5 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.791 -0.377 17635 2820 1 5 . 1 1 74 74 ILE C C 74 172.435 172.435 177.575 -5.140 17635 2821 1 5 . 1 1 74 74 ILE CA C 74 65.844 65.844 64.793 1.051 17635 2822 1 5 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.554 1.189 17635 2823 1 5 . 1 1 74 74 ILE H H 74 7.574 7.574 7.269 0.305 17635 2824 1 5 . 1 1 75 75 ASP N N 75 117.867 117.867 118.502 -0.635 17635 2825 1 5 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.434 -0.123 17635 2826 1 5 . 1 1 75 75 ASP C C 75 172.054 172.054 176.487 -4.433 17635 2827 1 5 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.497 0.664 17635 2828 1 5 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.432 -0.902 17635 2829 1 5 . 1 1 75 75 ASP H H 75 7.937 7.937 7.976 -0.039 17635 2830 1 5 . 1 1 76 76 TRP N N 76 117.313 117.313 120.272 -2.959 17635 2831 1 5 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.412 -0.056 17635 2832 1 5 . 1 1 76 76 TRP C C 76 173.272 173.272 176.528 -3.256 17635 2833 1 5 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.370 1.093 17635 2834 1 5 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.466 1.311 17635 2835 1 5 . 1 1 76 76 TRP H H 76 8.475 8.475 7.451 1.024 17635 2836 1 5 . 1 1 77 77 PHE N N 77 112.019 112.019 116.727 -4.708 17635 2837 1 5 . 1 1 77 77 PHE HA H 77 4.648 4.648 3.874 0.774 17635 2838 1 5 . 1 1 77 77 PHE C C 77 173.747 173.747 175.639 -1.892 17635 2839 1 5 . 1 1 77 77 PHE CA C 77 59.921 59.921 59.825 0.096 17635 2840 1 5 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.215 2.515 17635 2841 1 5 . 1 1 77 77 PHE H H 77 8.488 8.488 7.105 1.383 17635 2842 1 5 . 1 1 78 78 ASP N N 78 118.408 118.408 117.788 0.620 17635 2843 1 5 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.378 0.086 17635 2844 1 5 . 1 1 78 78 ASP C C 78 172.542 172.542 176.946 -4.404 17635 2845 1 5 . 1 1 78 78 ASP CA C 78 58.690 58.690 54.726 3.964 17635 2846 1 5 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.300 2.586 17635 2847 1 5 . 1 1 78 78 ASP H H 78 7.978 7.978 8.367 -0.389 17635 2848 1 5 . 1 1 79 79 GLY N N 79 115.548 115.548 104.650 10.898 17635 2849 1 5 . 1 1 79 79 GLY C C 79 175.680 175.680 174.023 1.657 17635 2850 1 5 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.768 1.304 17635 2851 1 5 . 1 1 79 79 GLY H H 79 8.615 8.615 8.381 0.234 17635 2852 1 5 . 1 1 80 80 LYS N N 80 120.271 120.271 119.832 0.439 17635 2853 1 5 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.411 0.051 17635 2854 1 5 . 1 1 80 80 LYS C C 80 175.853 175.853 176.148 -0.295 17635 2855 1 5 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.428 -0.278 17635 2856 1 5 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.203 -0.777 17635 2857 1 5 . 1 1 80 80 LYS H H 80 8.013 8.013 7.891 0.122 17635 2858 1 5 . 1 1 81 81 GLU N N 81 115.765 115.765 117.268 -1.503 17635 2859 1 5 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.255 -0.557 17635 2860 1 5 . 1 1 81 81 GLU C C 81 173.263 173.263 175.940 -2.677 17635 2861 1 5 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.319 0.605 17635 2862 1 5 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.961 0.081 17635 2863 1 5 . 1 1 81 81 GLU H H 81 8.201 8.201 8.317 -0.116 17635 2864 1 5 . 1 1 82 82 PHE N N 82 127.080 127.080 123.151 3.929 17635 2865 1 5 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.588 -0.092 17635 2866 1 5 . 1 1 82 82 PHE C C 82 175.349 175.349 175.289 0.060 17635 2867 1 5 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.411 0.305 17635 2868 1 5 . 1 1 82 82 PHE CB C 82 41.994 41.994 40.694 1.300 17635 2869 1 5 . 1 1 82 82 PHE H H 82 9.162 9.162 9.059 0.103 17635 2870 1 5 . 1 1 83 83 SER N N 83 125.136 125.136 121.651 3.485 17635 2871 1 5 . 1 1 83 83 SER HA H 83 3.803 3.803 4.143 -0.340 17635 2872 1 5 . 1 1 83 83 SER C C 83 175.543 175.543 174.964 0.579 17635 2873 1 5 . 1 1 83 83 SER CA C 83 58.371 58.371 59.094 -0.723 17635 2874 1 5 . 1 1 83 83 SER CB C 83 62.519 62.519 62.395 0.124 17635 2875 1 5 . 1 1 83 83 SER H H 83 9.193 9.193 9.200 -0.007 17635 2876 1 5 . 1 1 84 84 GLY N N 84 103.581 103.581 105.919 -2.338 17635 2877 1 5 . 1 1 84 84 GLY C C 84 177.188 177.188 173.167 4.021 17635 2878 1 5 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.826 0.226 17635 2879 1 5 . 1 1 84 84 GLY H H 84 8.446 8.446 8.428 0.018 17635 2880 1 5 . 1 1 85 85 ASN N N 85 119.051 119.051 118.263 0.788 17635 2881 1 5 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.182 0.152 17635 2882 1 5 . 1 1 85 85 ASN C C 85 178.020 178.020 172.573 5.447 17635 2883 1 5 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.753 -0.282 17635 2884 1 5 . 1 1 85 85 ASN CB C 85 41.117 41.117 40.888 0.229 17635 2885 1 5 . 1 1 85 85 ASN H H 85 7.762 7.762 8.156 -0.394 17635 2886 1 5 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.429 -0.762 17635 2887 1 5 . 1 1 86 86 PRO C C 86 173.474 173.474 176.408 -2.934 17635 2888 1 5 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.320 0.390 17635 2889 1 5 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.406 -0.536 17635 2890 1 5 . 1 1 87 87 ILE N N 87 117.270 117.270 117.458 -0.188 17635 2891 1 5 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.411 -0.265 17635 2892 1 5 . 1 1 87 87 ILE C C 87 174.495 174.495 174.642 -0.147 17635 2893 1 5 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.618 0.873 17635 2894 1 5 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.176 -0.505 17635 2895 1 5 . 1 1 87 87 ILE H H 87 8.469 8.469 8.282 0.187 17635 2896 1 5 . 1 1 88 88 LYS N N 88 122.271 122.271 124.211 -1.940 17635 2897 1 5 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.781 0.411 17635 2898 1 5 . 1 1 88 88 LYS C C 88 174.393 174.393 175.580 -1.187 17635 2899 1 5 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.404 -0.266 17635 2900 1 5 . 1 1 88 88 LYS CB C 88 35.049 35.049 33.309 1.740 17635 2901 1 5 . 1 1 88 88 LYS H H 88 8.353 8.353 8.294 0.059 17635 2902 1 5 . 1 1 89 89 VAL N N 89 125.661 125.661 126.772 -1.111 17635 2903 1 5 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.565 0.398 17635 2904 1 5 . 1 1 89 89 VAL C C 89 177.160 177.160 175.854 1.306 17635 2905 1 5 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.599 -1.238 17635 2906 1 5 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.608 2.162 17635 2907 1 5 . 1 1 89 89 VAL H H 89 9.414 9.414 8.673 0.741 17635 2908 1 5 . 1 1 90 90 SER N N 90 119.538 119.538 121.053 -1.515 17635 2909 1 5 . 1 1 90 90 SER HA H 90 4.710 4.710 4.777 -0.067 17635 2910 1 5 . 1 1 90 90 SER C C 90 176.533 176.533 173.644 2.889 17635 2911 1 5 . 1 1 90 90 SER CA C 90 56.936 56.936 57.677 -0.741 17635 2912 1 5 . 1 1 90 90 SER CB C 90 66.470 66.470 65.591 0.880 17635 2913 1 5 . 1 1 90 90 SER H H 90 8.945 8.945 8.170 0.775 17635 2914 1 5 . 1 1 91 91 PHE N N 91 120.115 120.115 121.790 -1.675 17635 2915 1 5 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.676 -0.003 17635 2916 1 5 . 1 1 91 91 PHE C C 91 173.349 173.349 175.837 -2.488 17635 2917 1 5 . 1 1 91 91 PHE CA C 91 61.155 61.155 57.372 3.783 17635 2918 1 5 . 1 1 91 91 PHE CB C 91 39.503 39.503 39.493 0.010 17635 2919 1 5 . 1 1 91 91 PHE H H 91 8.919 8.919 9.000 -0.081 17635 2920 1 5 . 1 1 92 92 ALA N N 92 124.386 124.386 119.795 4.591 17635 2921 1 5 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.225 0.131 17635 2922 1 5 . 1 1 92 92 ALA C C 92 172.984 172.984 176.415 -3.431 17635 2923 1 5 . 1 1 92 92 ALA CA C 92 52.098 52.098 53.104 -1.006 17635 2924 1 5 . 1 1 92 92 ALA CB C 92 19.406 19.406 16.919 2.487 17635 2925 1 5 . 1 1 92 92 ALA H H 92 8.563 8.563 8.346 0.217 17635 2926 1 5 . 1 1 93 93 THR N N 93 116.073 116.073 109.500 6.573 17635 2927 1 5 . 1 1 93 93 THR HA H 93 4.208 4.208 4.716 -0.508 17635 2928 1 5 . 1 1 93 93 THR C C 93 176.032 176.032 174.634 1.398 17635 2929 1 5 . 1 1 93 93 THR CA C 93 62.255 62.255 60.516 1.739 17635 2930 1 5 . 1 1 93 93 THR CB C 93 69.708 69.708 70.664 -0.956 17635 2931 1 5 . 1 1 93 93 THR H H 93 8.312 8.312 7.753 0.559 17635 2932 1 5 . 1 1 94 94 ARG N N 94 124.359 124.359 119.245 5.114 17635 2933 1 5 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.122 0.215 17635 2934 1 5 . 1 1 94 94 ARG C C 94 174.426 174.426 175.770 -1.344 17635 2935 1 5 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.980 -0.925 17635 2936 1 5 . 1 1 94 94 ARG CB C 94 30.911 30.911 29.843 1.068 17635 2937 1 5 . 1 1 94 94 ARG H H 94 8.493 8.493 8.649 -0.156 17635 2938 1 5 . 1 1 95 95 ARG N N 95 122.515 122.515 118.049 4.466 17635 2939 1 5 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.088 0.140 17635 2940 1 5 . 1 1 95 95 ARG C C 95 174.306 174.306 175.223 -0.917 17635 2941 1 5 . 1 1 95 95 ARG CA C 95 56.142 56.142 55.904 0.238 17635 2942 1 5 . 1 1 95 95 ARG CB C 95 30.966 30.966 27.133 3.833 17635 2943 1 5 . 1 1 95 95 ARG H H 95 8.343 8.343 8.317 0.026 17635 2944 1 5 . 1 1 96 96 ALA N N 96 125.127 125.127 124.111 1.016 17635 2945 1 5 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.134 0.075 17635 2946 1 5 . 1 1 96 96 ALA C C 96 173.226 173.226 178.895 -5.669 17635 2947 1 5 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.935 -0.165 17635 2948 1 5 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.563 -0.370 17635 2949 1 5 . 1 1 96 96 ALA H H 96 8.402 8.402 8.124 0.278 17635 2950 1 5 . 1 1 97 97 ASP N N 97 118.483 118.483 116.797 1.686 17635 2951 1 5 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.351 0.147 17635 2952 1 5 . 1 1 97 97 ASP C C 97 174.302 174.302 175.990 -1.688 17635 2953 1 5 . 1 1 97 97 ASP CA C 97 54.091 54.091 56.510 -2.419 17635 2954 1 5 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.646 0.261 17635 2955 1 5 . 1 1 97 97 ASP H H 97 8.206 8.206 8.699 -0.493 17635 2956 1 5 . 1 1 98 98 PHE N N 98 120.321 120.321 118.392 1.929 17635 2957 1 5 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.171 0.319 17635 2958 1 5 . 1 1 98 98 PHE C C 98 174.878 174.878 174.280 0.598 17635 2959 1 5 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.468 -0.308 17635 2960 1 5 . 1 1 98 98 PHE CB C 98 39.303 39.303 37.708 1.595 17635 2961 1 5 . 1 1 98 98 PHE H H 98 7.990 7.990 8.129 -0.139 17635 2962 1 5 . 1 1 99 99 ASN N N 99 120.016 120.016 117.067 2.949 17635 2963 1 5 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.463 0.146 17635 2964 1 5 . 1 1 99 99 ASN C C 99 175.348 175.348 174.779 0.569 17635 2965 1 5 . 1 1 99 99 ASN CA C 99 53.313 53.313 54.607 -1.294 17635 2966 1 5 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.317 0.410 17635 2967 1 5 . 1 1 99 99 ASN H H 99 8.336 8.336 8.391 -0.055 17635 2968 1 5 . 1 1 100 100 ARG N N 100 121.374 121.374 121.093 0.281 17635 2969 1 5 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.444 -0.171 17635 2970 1 5 . 1 1 100 100 ARG C C 100 173.627 173.627 175.499 -1.872 17635 2971 1 5 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.815 -0.322 17635 2972 1 5 . 1 1 100 100 ARG CB C 100 30.519 30.519 29.894 0.625 17635 2973 1 5 . 1 1 100 100 ARG H H 100 8.181 8.181 8.595 -0.414 17635 2974 1 5 . 1 1 101 101 GLY N N 101 109.586 109.586 111.472 -1.886 17635 2975 1 5 . 1 1 101 101 GLY C C 101 175.739 175.739 174.105 1.634 17635 2976 1 5 . 1 1 101 101 GLY CA C 101 45.380 45.380 45.110 0.270 17635 2977 1 5 . 1 1 101 101 GLY H H 101 8.413 8.413 8.486 -0.073 17635 2978 1 5 . 1 1 102 102 GLY N N 102 108.692 108.692 108.874 -0.182 17635 2979 1 5 . 1 1 102 102 GLY C C 102 176.286 176.286 173.681 2.605 17635 2980 1 5 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.575 0.763 17635 2981 1 5 . 1 1 102 102 GLY H H 102 8.281 8.281 8.344 -0.063 17635 2982 1 5 . 1 1 103 103 GLY N N 103 108.844 108.844 106.675 2.169 17635 2983 1 5 . 1 1 103 103 GLY C C 103 175.798 175.798 172.901 2.897 17635 2984 1 5 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.786 0.560 17635 2985 1 5 . 1 1 103 103 GLY H H 103 8.364 8.364 8.159 0.205 17635 2986 1 5 . 1 1 104 104 ASN N N 104 118.527 118.527 117.241 1.286 17635 2987 1 5 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.595 0.123 17635 2988 1 5 . 1 1 104 104 ASN C C 104 174.547 174.547 174.975 -0.428 17635 2989 1 5 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.618 -0.409 17635 2990 1 5 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.942 -0.063 17635 2991 1 5 . 1 1 104 104 ASN H H 104 8.438 8.438 8.617 -0.179 17635 2992 1 5 . 1 1 105 105 GLY N N 105 109.166 109.166 109.605 -0.439 17635 2993 1 5 . 1 1 105 105 GLY C C 105 176.074 176.074 173.901 2.173 17635 2994 1 5 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.410 0.192 17635 2995 1 5 . 1 1 105 105 GLY H H 105 8.477 8.477 8.501 -0.024 17635 2996 1 5 . 1 1 106 106 ARG N N 106 120.341 120.341 123.020 -2.679 17635 2997 1 5 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.502 -0.151 17635 2998 1 5 . 1 1 106 106 ARG C C 106 173.491 173.491 176.512 -3.021 17635 2999 1 5 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.520 0.707 17635 3000 1 5 . 1 1 106 106 ARG CB C 106 30.629 30.629 31.916 -1.287 17635 3001 1 5 . 1 1 106 106 ARG H H 106 8.244 8.244 8.107 0.137 17635 3002 1 5 . 1 1 107 107 GLY N N 107 109.856 109.856 109.437 0.419 17635 3003 1 5 . 1 1 107 107 GLY C C 107 175.834 175.834 174.256 1.578 17635 3004 1 5 . 1 1 107 107 GLY CA C 107 45.441 45.441 45.328 0.113 17635 3005 1 5 . 1 1 107 107 GLY H H 107 8.522 8.522 9.120 -0.598 17635 3006 1 6 . 1 1 2 2 GLN N N 2 121.692 121.692 119.563 2.129 17635 3007 1 6 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.113 0.153 17635 3008 1 6 . 1 1 2 2 GLN C C 2 175.248 175.248 174.621 0.627 17635 3009 1 6 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.280 -0.284 17635 3010 1 6 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.017 1.621 17635 3011 1 6 . 1 1 2 2 GLN H H 2 8.621 8.621 8.260 0.361 17635 3012 1 6 . 1 1 3 3 ASP N N 3 121.801 121.801 117.288 4.513 17635 3013 1 6 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.620 -0.052 17635 3014 1 6 . 1 1 3 3 ASP C C 3 174.336 174.336 176.140 -1.804 17635 3015 1 6 . 1 1 3 3 ASP CA C 3 54.062 54.062 53.163 0.899 17635 3016 1 6 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.763 0.308 17635 3017 1 6 . 1 1 3 3 ASP H H 3 8.436 8.436 8.471 -0.035 17635 3018 1 6 . 1 1 4 4 ASN N N 4 120.292 120.292 117.936 2.356 17635 3019 1 6 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.779 -0.142 17635 3020 1 6 . 1 1 4 4 ASN C C 4 174.415 174.415 175.816 -1.401 17635 3021 1 6 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.862 0.999 17635 3022 1 6 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.434 0.100 17635 3023 1 6 . 1 1 4 4 ASN H H 4 8.528 8.528 8.071 0.457 17635 3024 1 6 . 1 1 5 5 SER N N 5 117.091 117.091 114.516 2.575 17635 3025 1 6 . 1 1 5 5 SER HA H 5 4.163 4.163 4.379 -0.216 17635 3026 1 6 . 1 1 5 5 SER C C 5 176.370 176.370 174.269 2.101 17635 3027 1 6 . 1 1 5 5 SER CA C 5 60.846 60.846 59.664 1.182 17635 3028 1 6 . 1 1 5 5 SER CB C 5 63.136 63.136 63.494 -0.358 17635 3029 1 6 . 1 1 5 5 SER H H 5 8.470 8.470 8.238 0.232 17635 3030 1 6 . 1 1 6 6 ASP N N 6 119.436 119.436 120.567 -1.131 17635 3031 1 6 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.730 -0.035 17635 3032 1 6 . 1 1 6 6 ASP C C 6 175.048 175.048 174.585 0.463 17635 3033 1 6 . 1 1 6 6 ASP CA C 6 53.094 53.094 52.877 0.217 17635 3034 1 6 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.590 0.345 17635 3035 1 6 . 1 1 6 6 ASP H H 6 8.218 8.218 8.313 -0.095 17635 3036 1 6 . 1 1 7 7 ASN N N 7 119.696 119.696 117.247 2.449 17635 3037 1 6 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.492 0.136 17635 3038 1 6 . 1 1 7 7 ASN C C 7 176.539 176.539 175.633 0.906 17635 3039 1 6 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.787 -0.629 17635 3040 1 6 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.764 0.095 17635 3041 1 6 . 1 1 7 7 ASN H H 7 7.734 7.734 7.797 -0.063 17635 3042 1 6 . 1 1 8 8 ASN N N 8 119.436 119.436 118.565 0.871 17635 3043 1 6 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.615 0.253 17635 3044 1 6 . 1 1 8 8 ASN C C 8 175.327 175.327 175.390 -0.063 17635 3045 1 6 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.720 -1.516 17635 3046 1 6 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.337 0.158 17635 3047 1 6 . 1 1 8 8 ASN H H 8 8.350 8.350 8.614 -0.264 17635 3048 1 6 . 1 1 9 9 THR N N 9 118.650 118.650 114.593 4.057 17635 3049 1 6 . 1 1 9 9 THR HA H 9 5.557 5.557 4.498 1.059 17635 3050 1 6 . 1 1 9 9 THR C C 9 177.117 177.117 174.781 2.336 17635 3051 1 6 . 1 1 9 9 THR CA C 9 62.314 62.314 63.490 -1.176 17635 3052 1 6 . 1 1 9 9 THR CB C 9 71.225 71.225 69.276 1.949 17635 3053 1 6 . 1 1 9 9 THR H H 9 8.428 8.428 7.591 0.837 17635 3054 1 6 . 1 1 10 10 ILE N N 10 118.556 118.556 119.532 -0.976 17635 3055 1 6 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.137 0.028 17635 3056 1 6 . 1 1 10 10 ILE C C 10 176.837 176.837 173.899 2.938 17635 3057 1 6 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.565 0.733 17635 3058 1 6 . 1 1 10 10 ILE CB C 10 39.880 39.880 42.335 -2.455 17635 3059 1 6 . 1 1 10 10 ILE H H 10 8.770 8.770 8.583 0.187 17635 3060 1 6 . 1 1 11 11 PHE N N 11 123.798 123.798 121.521 2.277 17635 3061 1 6 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.120 0.300 17635 3062 1 6 . 1 1 11 11 PHE C C 11 177.066 177.066 175.526 1.540 17635 3063 1 6 . 1 1 11 11 PHE CA C 11 55.362 55.362 56.379 -1.017 17635 3064 1 6 . 1 1 11 11 PHE CB C 11 41.868 41.868 40.890 0.978 17635 3065 1 6 . 1 1 11 11 PHE H H 11 9.548 9.548 8.200 1.348 17635 3066 1 6 . 1 1 12 12 VAL N N 12 127.993 127.993 126.850 1.143 17635 3067 1 6 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.503 0.455 17635 3068 1 6 . 1 1 12 12 VAL C C 12 176.965 176.965 174.833 2.132 17635 3069 1 6 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.396 -1.561 17635 3070 1 6 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.159 2.641 17635 3071 1 6 . 1 1 12 12 VAL H H 12 8.940 8.940 8.970 -0.030 17635 3072 1 6 . 1 1 13 13 GLN N N 13 122.289 122.289 127.363 -5.074 17635 3073 1 6 . 1 1 13 13 GLN HA H 13 4.779 4.779 5.005 -0.226 17635 3074 1 6 . 1 1 13 13 GLN C C 13 175.631 175.631 176.011 -0.380 17635 3075 1 6 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.812 0.298 17635 3076 1 6 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.556 3.576 17635 3077 1 6 . 1 1 13 13 GLN H H 13 8.747 8.747 8.157 0.590 17635 3078 1 6 . 1 1 14 14 GLY N N 14 109.212 109.212 112.008 -2.796 17635 3079 1 6 . 1 1 14 14 GLY C C 14 175.436 175.436 173.455 1.981 17635 3080 1 6 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.308 0.122 17635 3081 1 6 . 1 1 14 14 GLY H H 14 8.236 8.236 9.122 -0.886 17635 3082 1 6 . 1 1 15 15 LEU N N 15 117.824 117.824 121.947 -4.123 17635 3083 1 6 . 1 1 15 15 LEU HA H 15 3.706 3.706 3.455 0.251 17635 3084 1 6 . 1 1 15 15 LEU C C 15 174.111 174.111 176.293 -2.182 17635 3085 1 6 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.691 0.027 17635 3086 1 6 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.753 0.680 17635 3087 1 6 . 1 1 15 15 LEU H H 15 8.442 8.442 7.917 0.525 17635 3088 1 6 . 1 1 16 16 GLY N N 16 105.063 105.063 103.910 1.153 17635 3089 1 6 . 1 1 16 16 GLY C C 16 177.771 177.771 174.117 3.654 17635 3090 1 6 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.135 -0.040 17635 3091 1 6 . 1 1 16 16 GLY H H 16 8.006 8.006 7.668 0.338 17635 3092 1 6 . 1 1 17 17 GLU N N 17 113.781 113.781 119.367 -5.586 17635 3093 1 6 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.827 0.292 17635 3094 1 6 . 1 1 17 17 GLU C C 17 173.937 173.937 175.275 -1.338 17635 3095 1 6 . 1 1 17 17 GLU CA C 17 57.281 57.281 57.266 0.015 17635 3096 1 6 . 1 1 17 17 GLU CB C 17 30.436 30.436 28.815 1.621 17635 3097 1 6 . 1 1 17 17 GLU H H 17 8.134 8.134 8.875 -0.741 17635 3098 1 6 . 1 1 18 18 ASN N N 18 116.660 116.660 113.667 2.993 17635 3099 1 6 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.696 0.245 17635 3100 1 6 . 1 1 18 18 ASN C C 18 175.900 175.900 173.972 1.928 17635 3101 1 6 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.354 0.124 17635 3102 1 6 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.525 -1.040 17635 3103 1 6 . 1 1 18 18 ASN H H 18 8.407 8.407 7.804 0.603 17635 3104 1 6 . 1 1 19 19 VAL N N 19 118.323 118.323 121.686 -3.363 17635 3105 1 6 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.782 0.370 17635 3106 1 6 . 1 1 19 19 VAL C C 19 177.655 177.655 174.884 2.771 17635 3107 1 6 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.198 -1.321 17635 3108 1 6 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.642 1.871 17635 3109 1 6 . 1 1 19 19 VAL H H 19 6.855 6.855 7.816 -0.961 17635 3110 1 6 . 1 1 20 20 THR N N 20 111.636 111.636 117.409 -5.773 17635 3111 1 6 . 1 1 20 20 THR HA H 20 4.719 4.719 4.592 0.127 17635 3112 1 6 . 1 1 20 20 THR C C 20 175.266 175.266 174.503 0.763 17635 3113 1 6 . 1 1 20 20 THR CA C 20 58.698 58.698 59.830 -1.132 17635 3114 1 6 . 1 1 20 20 THR CB C 20 72.948 72.948 71.981 0.967 17635 3115 1 6 . 1 1 20 20 THR H H 20 7.328 7.328 7.888 -0.560 17635 3116 1 6 . 1 1 21 21 ILE N N 21 122.147 122.147 123.779 -1.632 17635 3117 1 6 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.847 -0.329 17635 3118 1 6 . 1 1 21 21 ILE C C 21 173.198 173.198 177.519 -4.321 17635 3119 1 6 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.173 1.599 17635 3120 1 6 . 1 1 21 21 ILE CB C 21 37.583 37.583 36.979 0.604 17635 3121 1 6 . 1 1 21 21 ILE H H 21 9.074 9.074 8.795 0.279 17635 3122 1 6 . 1 1 22 22 GLU N N 22 118.154 118.154 120.852 -2.698 17635 3123 1 6 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.165 -0.179 17635 3124 1 6 . 1 1 22 22 GLU C C 22 171.799 171.799 178.798 -6.999 17635 3125 1 6 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.616 0.997 17635 3126 1 6 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.434 0.357 17635 3127 1 6 . 1 1 22 22 GLU H H 22 8.814 8.814 8.523 0.291 17635 3128 1 6 . 1 1 23 23 SER N N 23 115.921 115.921 114.186 1.735 17635 3129 1 6 . 1 1 23 23 SER HA H 23 4.384 4.384 4.319 0.065 17635 3130 1 6 . 1 1 23 23 SER C C 23 172.447 172.447 176.444 -3.997 17635 3131 1 6 . 1 1 23 23 SER CA C 23 61.239 61.239 61.320 -0.081 17635 3132 1 6 . 1 1 23 23 SER CB C 23 62.838 62.838 62.736 0.102 17635 3133 1 6 . 1 1 23 23 SER H H 23 8.236 8.236 8.194 0.042 17635 3134 1 6 . 1 1 24 24 VAL N N 24 124.867 124.867 121.590 3.277 17635 3135 1 6 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.111 -0.363 17635 3136 1 6 . 1 1 24 24 VAL C C 24 173.016 173.016 177.805 -4.789 17635 3137 1 6 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.743 0.511 17635 3138 1 6 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.993 -0.460 17635 3139 1 6 . 1 1 24 24 VAL H H 24 7.973 7.973 8.041 -0.068 17635 3140 1 6 . 1 1 25 25 ALA N N 25 123.198 123.198 120.987 2.211 17635 3141 1 6 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.052 -0.153 17635 3142 1 6 . 1 1 25 25 ALA C C 25 171.061 171.061 178.396 -7.335 17635 3143 1 6 . 1 1 25 25 ALA CA C 25 55.695 55.695 55.014 0.681 17635 3144 1 6 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.228 -0.490 17635 3145 1 6 . 1 1 25 25 ALA H H 25 8.695 8.695 8.458 0.237 17635 3146 1 6 . 1 1 26 26 ASP N N 26 115.503 115.503 117.973 -2.470 17635 3147 1 6 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.529 -0.206 17635 3148 1 6 . 1 1 26 26 ASP C C 26 173.108 173.108 178.379 -5.271 17635 3149 1 6 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.563 0.760 17635 3150 1 6 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.507 -0.455 17635 3151 1 6 . 1 1 26 26 ASP H H 26 8.312 8.312 8.268 0.045 17635 3152 1 6 . 1 1 27 27 TYR N N 27 119.224 119.224 118.870 0.354 17635 3153 1 6 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.445 -0.245 17635 3154 1 6 . 1 1 27 27 TYR C C 27 172.908 172.908 175.912 -3.004 17635 3155 1 6 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.264 1.752 17635 3156 1 6 . 1 1 27 27 TYR CB C 27 39.932 39.932 38.731 1.200 17635 3157 1 6 . 1 1 27 27 TYR H H 27 7.533 7.533 7.812 -0.279 17635 3158 1 6 . 1 1 28 28 PHE N N 28 112.595 112.595 117.802 -5.207 17635 3159 1 6 . 1 1 28 28 PHE HA H 28 4.330 4.330 3.978 0.352 17635 3160 1 6 . 1 1 28 28 PHE C C 28 173.082 173.082 175.116 -2.034 17635 3161 1 6 . 1 1 28 28 PHE CA C 28 61.784 61.784 56.994 4.790 17635 3162 1 6 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.599 1.403 17635 3163 1 6 . 1 1 28 28 PHE H H 28 7.974 7.974 7.662 0.312 17635 3164 1 6 . 1 1 29 29 LYS N N 29 118.820 118.820 118.427 0.393 17635 3165 1 6 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.733 0.184 17635 3166 1 6 . 1 1 29 29 LYS C C 29 173.682 173.682 176.466 -2.784 17635 3167 1 6 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.328 1.952 17635 3168 1 6 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.415 -0.124 17635 3169 1 6 . 1 1 29 29 LYS H H 29 8.325 8.325 7.580 0.745 17635 3170 1 6 . 1 1 30 30 GLN N N 30 116.232 116.232 116.996 -0.764 17635 3171 1 6 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.413 -0.278 17635 3172 1 6 . 1 1 30 30 GLN C C 30 173.790 173.790 176.912 -3.122 17635 3173 1 6 . 1 1 30 30 GLN CA C 30 57.546 57.546 56.499 1.046 17635 3174 1 6 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.024 0.874 17635 3175 1 6 . 1 1 30 30 GLN H H 30 7.518 7.518 8.120 -0.602 17635 3176 1 6 . 1 1 31 31 ILE N N 31 116.489 116.489 120.684 -4.195 17635 3177 1 6 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.247 -0.009 17635 3178 1 6 . 1 1 31 31 ILE C C 31 175.599 175.599 175.683 -0.084 17635 3179 1 6 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.411 -3.190 17635 3180 1 6 . 1 1 31 31 ILE CB C 31 40.334 40.334 39.039 1.295 17635 3181 1 6 . 1 1 31 31 ILE H H 31 7.809 7.809 8.056 -0.247 17635 3182 1 6 . 1 1 32 32 GLY N N 32 107.416 107.416 106.175 1.241 17635 3183 1 6 . 1 1 32 32 GLY C C 32 180.182 180.182 172.079 8.103 17635 3184 1 6 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.781 0.213 17635 3185 1 6 . 1 1 32 32 GLY H H 32 7.344 7.344 7.497 -0.153 17635 3186 1 6 . 1 1 33 33 ILE N N 33 117.784 117.784 121.922 -4.138 17635 3187 1 6 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.522 -0.433 17635 3188 1 6 . 1 1 33 33 ILE C C 33 173.301 173.301 175.405 -2.104 17635 3189 1 6 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.569 1.072 17635 3190 1 6 . 1 1 33 33 ILE CB C 33 38.659 38.659 38.961 -0.302 17635 3191 1 6 . 1 1 33 33 ILE H H 33 8.173 8.173 8.281 -0.108 17635 3192 1 6 . 1 1 34 34 ILE N N 34 131.781 131.781 127.738 4.043 17635 3193 1 6 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.130 -0.343 17635 3194 1 6 . 1 1 34 34 ILE C C 34 174.663 174.663 175.832 -1.169 17635 3195 1 6 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.858 0.512 17635 3196 1 6 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.434 -0.439 17635 3197 1 6 . 1 1 34 34 ILE H H 34 8.687 8.687 8.742 -0.055 17635 3198 1 6 . 1 1 35 35 LYS N N 35 130.372 130.372 128.940 1.432 17635 3199 1 6 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.209 -0.125 17635 3200 1 6 . 1 1 35 35 LYS C C 35 175.376 175.376 176.553 -1.177 17635 3201 1 6 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.908 0.565 17635 3202 1 6 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.587 2.076 17635 3203 1 6 . 1 1 35 35 LYS H H 35 8.680 8.680 8.642 0.038 17635 3204 1 6 . 1 1 36 36 THR N N 36 118.312 118.312 122.004 -3.692 17635 3205 1 6 . 1 1 36 36 THR HA H 36 4.415 4.415 4.431 -0.016 17635 3206 1 6 . 1 1 36 36 THR C C 36 176.394 176.394 174.355 2.039 17635 3207 1 6 . 1 1 36 36 THR CA C 36 61.340 61.340 61.610 -0.270 17635 3208 1 6 . 1 1 36 36 THR CB C 36 70.809 70.809 70.129 0.680 17635 3209 1 6 . 1 1 36 36 THR H H 36 8.456 8.456 8.078 0.378 17635 3210 1 6 . 1 1 37 37 ASN N N 37 124.092 124.092 120.676 3.416 17635 3211 1 6 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.924 -0.394 17635 3212 1 6 . 1 1 37 37 ASN C C 37 174.235 174.235 175.647 -1.412 17635 3213 1 6 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.746 1.317 17635 3214 1 6 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.990 -1.063 17635 3215 1 6 . 1 1 37 37 ASN H H 37 8.794 8.794 8.590 0.204 17635 3216 1 6 . 1 1 38 38 LYS N N 38 127.969 127.969 120.902 7.067 17635 3217 1 6 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.224 -0.220 17635 3218 1 6 . 1 1 38 38 LYS C C 38 172.702 172.702 177.009 -4.307 17635 3219 1 6 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.476 -0.018 17635 3220 1 6 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.973 0.194 17635 3221 1 6 . 1 1 38 38 LYS H H 38 8.962 8.962 8.615 0.347 17635 3222 1 6 . 1 1 39 39 LYS N N 39 117.413 117.413 118.991 -1.578 17635 3223 1 6 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.221 0.037 17635 3224 1 6 . 1 1 39 39 LYS C C 39 172.261 172.261 177.418 -5.157 17635 3225 1 6 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.900 0.419 17635 3226 1 6 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.196 0.601 17635 3227 1 6 . 1 1 39 39 LYS H H 39 8.314 8.314 7.985 0.329 17635 3228 1 6 . 1 1 40 40 THR N N 40 105.547 105.547 110.264 -4.717 17635 3229 1 6 . 1 1 40 40 THR HA H 40 4.465 4.465 4.388 0.077 17635 3230 1 6 . 1 1 40 40 THR C C 40 174.021 174.021 175.817 -1.796 17635 3231 1 6 . 1 1 40 40 THR CA C 40 61.260 61.260 61.765 -0.505 17635 3232 1 6 . 1 1 40 40 THR CB C 40 70.997 70.997 69.549 1.448 17635 3233 1 6 . 1 1 40 40 THR H H 40 7.422 7.422 7.552 -0.130 17635 3234 1 6 . 1 1 41 41 GLY N N 41 111.631 111.631 112.419 -0.788 17635 3235 1 6 . 1 1 41 41 GLY C C 41 176.727 176.727 173.635 3.092 17635 3236 1 6 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.518 0.212 17635 3237 1 6 . 1 1 41 41 GLY H H 41 8.644 8.644 8.324 0.320 17635 3238 1 6 . 1 1 42 42 GLN N N 42 118.894 118.894 118.923 -0.029 17635 3239 1 6 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.822 -0.153 17635 3240 1 6 . 1 1 42 42 GLN C C 42 177.178 177.178 173.309 3.869 17635 3241 1 6 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.618 0.963 17635 3242 1 6 . 1 1 42 42 GLN CB C 42 29.230 29.230 30.103 -0.873 17635 3243 1 6 . 1 1 42 42 GLN H H 42 7.662 7.662 7.645 0.017 17635 3244 1 6 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.312 0.283 17635 3245 1 6 . 1 1 43 43 PRO C C 43 172.629 172.629 175.923 -3.294 17635 3246 1 6 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.704 -0.882 17635 3247 1 6 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.057 0.639 17635 3248 1 6 . 1 1 44 44 MET N N 44 124.162 124.162 122.175 1.987 17635 3249 1 6 . 1 1 44 44 MET HA H 44 4.432 4.432 4.708 -0.276 17635 3250 1 6 . 1 1 44 44 MET C C 44 176.474 176.474 174.402 2.072 17635 3251 1 6 . 1 1 44 44 MET CA C 44 55.419 55.419 54.109 1.310 17635 3252 1 6 . 1 1 44 44 MET CB C 44 30.555 30.555 35.552 -4.997 17635 3253 1 6 . 1 1 44 44 MET H H 44 8.874 8.874 8.346 0.528 17635 3254 1 6 . 1 1 45 45 ILE N N 45 126.237 126.237 122.475 3.762 17635 3255 1 6 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.674 0.128 17635 3256 1 6 . 1 1 45 45 ILE C C 45 176.415 176.415 174.368 2.047 17635 3257 1 6 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.079 -0.863 17635 3258 1 6 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.513 -0.287 17635 3259 1 6 . 1 1 45 45 ILE H H 45 7.730 7.730 8.382 -0.652 17635 3260 1 6 . 1 1 46 46 ASN N N 46 124.735 124.735 124.006 0.729 17635 3261 1 6 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.893 0.048 17635 3262 1 6 . 1 1 46 46 ASN C C 46 176.836 176.836 173.635 3.201 17635 3263 1 6 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.054 -0.493 17635 3264 1 6 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.338 0.132 17635 3265 1 6 . 1 1 46 46 ASN H H 46 8.384 8.384 8.735 -0.351 17635 3266 1 6 . 1 1 47 47 LEU N N 47 122.487 122.487 123.487 -1.000 17635 3267 1 6 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.792 -0.077 17635 3268 1 6 . 1 1 47 47 LEU C C 47 174.190 174.190 175.907 -1.717 17635 3269 1 6 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.762 -0.430 17635 3270 1 6 . 1 1 47 47 LEU CB C 47 42.277 42.277 43.806 -1.529 17635 3271 1 6 . 1 1 47 47 LEU H H 47 8.594 8.594 8.255 0.339 17635 3272 1 6 . 1 1 48 48 TYR N N 48 121.842 121.842 120.279 1.563 17635 3273 1 6 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.787 -0.020 17635 3274 1 6 . 1 1 48 48 TYR C C 48 173.649 173.649 175.128 -1.479 17635 3275 1 6 . 1 1 48 48 TYR CA C 48 57.894 57.894 57.407 0.487 17635 3276 1 6 . 1 1 48 48 TYR CB C 48 39.199 39.199 41.566 -2.367 17635 3277 1 6 . 1 1 48 48 TYR H H 48 7.666 7.666 8.537 -0.871 17635 3278 1 6 . 1 1 49 49 THR N N 49 116.554 116.554 115.243 1.311 17635 3279 1 6 . 1 1 49 49 THR HA H 49 4.806 4.806 4.705 0.101 17635 3280 1 6 . 1 1 49 49 THR C C 49 176.654 176.654 173.247 3.407 17635 3281 1 6 . 1 1 49 49 THR CA C 49 60.693 60.693 61.029 -0.336 17635 3282 1 6 . 1 1 49 49 THR CB C 49 71.437 71.437 69.342 2.095 17635 3283 1 6 . 1 1 49 49 THR H H 49 8.965 8.965 8.689 0.276 17635 3284 1 6 . 1 1 50 50 ASP N N 50 123.826 123.826 124.804 -0.978 17635 3285 1 6 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.727 -0.103 17635 3286 1 6 . 1 1 50 50 ASP C C 50 173.380 173.380 174.370 -0.990 17635 3287 1 6 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.240 -0.152 17635 3288 1 6 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.837 1.030 17635 3289 1 6 . 1 1 50 50 ASP H H 50 8.939 8.939 8.579 0.360 17635 3290 1 6 . 1 1 51 51 ARG N N 51 127.794 127.794 121.232 6.562 17635 3291 1 6 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.470 -0.425 17635 3292 1 6 . 1 1 51 51 ARG C C 51 173.101 173.101 176.141 -3.040 17635 3293 1 6 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.525 2.037 17635 3294 1 6 . 1 1 51 51 ARG CB C 51 30.167 30.167 31.785 -1.618 17635 3295 1 6 . 1 1 51 51 ARG H H 51 8.958 8.958 8.384 0.574 17635 3296 1 6 . 1 1 52 52 GLU N N 52 117.542 117.542 117.403 0.139 17635 3297 1 6 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.514 -0.236 17635 3298 1 6 . 1 1 52 52 GLU C C 52 172.201 172.201 175.091 -2.890 17635 3299 1 6 . 1 1 52 52 GLU CA C 52 58.524 58.524 56.573 1.951 17635 3300 1 6 . 1 1 52 52 GLU CB C 52 30.278 30.278 31.731 -1.453 17635 3301 1 6 . 1 1 52 52 GLU H H 52 8.561 8.561 8.209 0.352 17635 3302 1 6 . 1 1 53 53 THR N N 53 107.065 107.065 113.516 -6.451 17635 3303 1 6 . 1 1 53 53 THR HA H 53 4.436 4.436 4.346 0.090 17635 3304 1 6 . 1 1 53 53 THR C C 53 173.851 173.851 174.217 -0.366 17635 3305 1 6 . 1 1 53 53 THR CA C 53 61.944 61.944 62.368 -0.424 17635 3306 1 6 . 1 1 53 53 THR CB C 53 71.197 71.197 68.687 2.510 17635 3307 1 6 . 1 1 53 53 THR H H 53 8.087 8.087 8.009 0.078 17635 3308 1 6 . 1 1 54 54 GLY N N 54 111.295 111.295 108.549 2.746 17635 3309 1 6 . 1 1 54 54 GLY C C 54 176.747 176.747 172.901 3.846 17635 3310 1 6 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.931 0.772 17635 3311 1 6 . 1 1 54 54 GLY H H 54 8.423 8.423 8.198 0.225 17635 3312 1 6 . 1 1 55 55 LYS N N 55 119.673 119.673 120.386 -0.713 17635 3313 1 6 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.544 -0.191 17635 3314 1 6 . 1 1 55 55 LYS C C 55 173.854 173.854 176.067 -2.213 17635 3315 1 6 . 1 1 55 55 LYS CA C 55 55.842 55.842 54.816 1.026 17635 3316 1 6 . 1 1 55 55 LYS CB C 55 33.821 33.821 33.458 0.363 17635 3317 1 6 . 1 1 55 55 LYS H H 55 7.767 7.767 7.911 -0.144 17635 3318 1 6 . 1 1 56 56 LEU N N 56 122.426 122.426 123.972 -1.546 17635 3319 1 6 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.101 0.255 17635 3320 1 6 . 1 1 56 56 LEU C C 56 172.534 172.534 177.372 -4.838 17635 3321 1 6 . 1 1 56 56 LEU CA C 56 56.255 56.255 55.141 1.114 17635 3322 1 6 . 1 1 56 56 LEU CB C 56 41.654 41.654 39.823 1.831 17635 3323 1 6 . 1 1 56 56 LEU H H 56 8.768 8.768 8.818 -0.050 17635 3324 1 6 . 1 1 57 57 LYS N N 57 118.264 118.264 122.010 -3.746 17635 3325 1 6 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.345 -0.057 17635 3326 1 6 . 1 1 57 57 LYS C C 57 173.648 173.648 177.152 -3.504 17635 3327 1 6 . 1 1 57 57 LYS CA C 57 56.264 56.264 55.773 0.491 17635 3328 1 6 . 1 1 57 57 LYS CB C 57 34.062 34.062 31.931 2.131 17635 3329 1 6 . 1 1 57 57 LYS H H 57 8.012 8.012 7.883 0.129 17635 3330 1 6 . 1 1 58 58 GLY N N 58 108.514 108.514 108.719 -0.205 17635 3331 1 6 . 1 1 58 58 GLY C C 58 177.876 177.876 173.011 4.865 17635 3332 1 6 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.691 0.673 17635 3333 1 6 . 1 1 58 58 GLY H H 58 8.334 8.334 8.183 0.151 17635 3334 1 6 . 1 1 59 59 GLU N N 59 116.119 116.119 119.641 -3.522 17635 3335 1 6 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.416 0.105 17635 3336 1 6 . 1 1 59 59 GLU C C 59 173.860 173.860 173.884 -0.024 17635 3337 1 6 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.330 -2.305 17635 3338 1 6 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.516 0.789 17635 3339 1 6 . 1 1 59 59 GLU H H 59 7.202 7.202 7.975 -0.773 17635 3340 1 6 . 1 1 60 60 ALA N N 60 123.607 123.607 127.188 -3.581 17635 3341 1 6 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.239 0.368 17635 3342 1 6 . 1 1 60 60 ALA C C 60 173.923 173.923 174.798 -0.875 17635 3343 1 6 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.188 -0.245 17635 3344 1 6 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.210 0.849 17635 3345 1 6 . 1 1 60 60 ALA H H 60 8.930 8.930 8.810 0.120 17635 3346 1 6 . 1 1 61 61 THR N N 61 108.384 108.384 113.204 -4.820 17635 3347 1 6 . 1 1 61 61 THR HA H 61 5.743 5.743 5.046 0.697 17635 3348 1 6 . 1 1 61 61 THR C C 61 176.172 176.172 174.171 2.001 17635 3349 1 6 . 1 1 61 61 THR CA C 61 59.625 59.625 60.479 -0.854 17635 3350 1 6 . 1 1 61 61 THR CB C 61 71.224 71.224 70.171 1.052 17635 3351 1 6 . 1 1 61 61 THR H H 61 8.452 8.452 8.661 -0.209 17635 3352 1 6 . 1 1 62 62 VAL N N 62 120.200 120.200 127.991 -7.791 17635 3353 1 6 . 1 1 62 62 VAL HA H 62 4.244 4.244 3.980 0.264 17635 3354 1 6 . 1 1 62 62 VAL C C 62 175.994 175.994 175.036 0.958 17635 3355 1 6 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.575 -0.149 17635 3356 1 6 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.092 2.593 17635 3357 1 6 . 1 1 62 62 VAL H H 62 8.071 8.071 8.096 -0.025 17635 3358 1 6 . 1 1 63 63 SER N N 63 121.689 121.689 124.131 -2.442 17635 3359 1 6 . 1 1 63 63 SER HA H 63 5.261 5.261 4.512 0.749 17635 3360 1 6 . 1 1 63 63 SER C C 63 177.943 177.943 173.539 4.404 17635 3361 1 6 . 1 1 63 63 SER CA C 63 57.662 57.662 58.967 -1.304 17635 3362 1 6 . 1 1 63 63 SER CB C 63 64.427 64.427 63.997 0.430 17635 3363 1 6 . 1 1 63 63 SER H H 63 7.695 7.695 8.078 -0.383 17635 3364 1 6 . 1 1 64 64 PHE N N 64 122.640 122.640 124.527 -1.887 17635 3365 1 6 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.668 0.186 17635 3366 1 6 . 1 1 64 64 PHE C C 64 174.605 174.605 175.587 -0.982 17635 3367 1 6 . 1 1 64 64 PHE CA C 64 58.204 58.204 58.105 0.099 17635 3368 1 6 . 1 1 64 64 PHE CB C 64 41.976 41.976 41.261 0.715 17635 3369 1 6 . 1 1 64 64 PHE H H 64 9.025 9.025 8.352 0.673 17635 3370 1 6 . 1 1 65 65 ASP N N 65 119.943 119.943 120.444 -0.501 17635 3371 1 6 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.566 -0.131 17635 3372 1 6 . 1 1 65 65 ASP C C 65 174.396 174.396 176.135 -1.739 17635 3373 1 6 . 1 1 65 65 ASP CA C 65 57.442 57.442 56.746 0.696 17635 3374 1 6 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.895 0.139 17635 3375 1 6 . 1 1 65 65 ASP H H 65 8.512 8.512 9.017 -0.505 17635 3376 1 6 . 1 1 66 66 ASP N N 66 116.125 116.125 118.062 -1.937 17635 3377 1 6 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.119 0.280 17635 3378 1 6 . 1 1 66 66 ASP C C 66 175.936 175.936 174.264 1.672 17635 3379 1 6 . 1 1 66 66 ASP CA C 66 50.793 50.793 50.940 -0.147 17635 3380 1 6 . 1 1 66 66 ASP CB C 66 42.919 42.919 43.527 -0.608 17635 3381 1 6 . 1 1 66 66 ASP H H 66 8.323 8.323 7.536 0.787 17635 3382 1 6 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.479 -0.029 17635 3383 1 6 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.201 0.723 17635 3384 1 6 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.649 -0.819 17635 3385 1 6 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.293 0.126 17635 3386 1 6 . 1 1 68 68 PRO C C 68 171.345 171.345 178.627 -7.282 17635 3387 1 6 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.686 0.548 17635 3388 1 6 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.037 -0.040 17635 3389 1 6 . 1 1 69 69 SER N N 69 114.544 114.544 114.580 -0.036 17635 3390 1 6 . 1 1 69 69 SER HA H 69 4.036 4.036 3.957 0.079 17635 3391 1 6 . 1 1 69 69 SER C C 69 176.535 176.535 175.817 0.718 17635 3392 1 6 . 1 1 69 69 SER CA C 69 61.837 61.837 61.076 0.761 17635 3393 1 6 . 1 1 69 69 SER CB C 69 62.773 62.773 62.371 0.402 17635 3394 1 6 . 1 1 69 69 SER H H 69 8.004 8.004 7.886 0.118 17635 3395 1 6 . 1 1 70 70 ALA N N 70 122.649 122.649 125.154 -2.505 17635 3396 1 6 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.756 -0.163 17635 3397 1 6 . 1 1 70 70 ALA C C 70 172.686 172.686 179.390 -6.704 17635 3398 1 6 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.172 -0.136 17635 3399 1 6 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.300 -0.436 17635 3400 1 6 . 1 1 70 70 ALA H H 70 7.383 7.383 7.510 -0.127 17635 3401 1 6 . 1 1 71 71 LYS N N 71 116.308 116.308 119.496 -3.188 17635 3402 1 6 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.871 -0.096 17635 3403 1 6 . 1 1 71 71 LYS C C 71 172.333 172.333 178.668 -6.335 17635 3404 1 6 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.270 0.731 17635 3405 1 6 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.159 0.283 17635 3406 1 6 . 1 1 71 71 LYS H H 71 7.159 7.159 7.585 -0.426 17635 3407 1 6 . 1 1 72 72 ALA N N 72 119.806 119.806 120.540 -0.734 17635 3408 1 6 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.058 0.108 17635 3409 1 6 . 1 1 72 72 ALA C C 72 170.530 170.530 179.724 -9.194 17635 3410 1 6 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.930 -0.215 17635 3411 1 6 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.989 -0.169 17635 3412 1 6 . 1 1 72 72 ALA H H 72 7.924 7.924 8.083 -0.159 17635 3413 1 6 . 1 1 73 73 ALA N N 73 120.524 120.524 121.424 -0.900 17635 3414 1 6 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.124 0.155 17635 3415 1 6 . 1 1 73 73 ALA C C 73 171.039 171.039 179.617 -8.578 17635 3416 1 6 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.957 0.422 17635 3417 1 6 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.647 0.484 17635 3418 1 6 . 1 1 73 73 ALA H H 73 8.104 8.104 7.459 0.645 17635 3419 1 6 . 1 1 74 74 ILE N N 74 119.875 119.875 117.817 2.058 17635 3420 1 6 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.804 -0.390 17635 3421 1 6 . 1 1 74 74 ILE C C 74 172.435 172.435 177.786 -5.351 17635 3422 1 6 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.113 0.731 17635 3423 1 6 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.769 0.974 17635 3424 1 6 . 1 1 74 74 ILE H H 74 7.574 7.574 7.817 -0.243 17635 3425 1 6 . 1 1 75 75 ASP N N 75 117.867 117.867 118.352 -0.485 17635 3426 1 6 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.451 -0.140 17635 3427 1 6 . 1 1 75 75 ASP C C 75 172.054 172.054 176.449 -4.395 17635 3428 1 6 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.730 0.431 17635 3429 1 6 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.352 -0.821 17635 3430 1 6 . 1 1 75 75 ASP H H 75 7.937 7.937 8.067 -0.130 17635 3431 1 6 . 1 1 76 76 TRP N N 76 117.313 117.313 120.324 -3.011 17635 3432 1 6 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.524 -0.168 17635 3433 1 6 . 1 1 76 76 TRP C C 76 173.272 173.272 176.802 -3.530 17635 3434 1 6 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.291 1.171 17635 3435 1 6 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.612 1.165 17635 3436 1 6 . 1 1 76 76 TRP H H 76 8.475 8.475 7.503 0.972 17635 3437 1 6 . 1 1 77 77 PHE N N 77 112.019 112.019 115.405 -3.386 17635 3438 1 6 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.016 0.632 17635 3439 1 6 . 1 1 77 77 PHE C C 77 173.747 173.747 175.780 -2.033 17635 3440 1 6 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.654 -0.733 17635 3441 1 6 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.424 2.306 17635 3442 1 6 . 1 1 77 77 PHE H H 77 8.488 8.488 7.622 0.866 17635 3443 1 6 . 1 1 78 78 ASP N N 78 118.408 118.408 119.558 -1.150 17635 3444 1 6 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.530 -0.066 17635 3445 1 6 . 1 1 78 78 ASP C C 78 172.542 172.542 176.523 -3.981 17635 3446 1 6 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.156 3.534 17635 3447 1 6 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.178 2.708 17635 3448 1 6 . 1 1 78 78 ASP H H 78 7.978 7.978 8.420 -0.442 17635 3449 1 6 . 1 1 79 79 GLY N N 79 115.548 115.548 104.010 11.538 17635 3450 1 6 . 1 1 79 79 GLY C C 79 175.680 175.680 173.950 1.730 17635 3451 1 6 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.082 0.990 17635 3452 1 6 . 1 1 79 79 GLY H H 79 8.615 8.615 8.581 0.034 17635 3453 1 6 . 1 1 80 80 LYS N N 80 120.271 120.271 119.744 0.527 17635 3454 1 6 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.501 -0.039 17635 3455 1 6 . 1 1 80 80 LYS C C 80 175.853 175.853 175.443 0.410 17635 3456 1 6 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.655 -0.505 17635 3457 1 6 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.530 -1.104 17635 3458 1 6 . 1 1 80 80 LYS H H 80 8.013 8.013 8.240 -0.227 17635 3459 1 6 . 1 1 81 81 GLU N N 81 115.765 115.765 117.895 -2.130 17635 3460 1 6 . 1 1 81 81 GLU HA H 81 4.698 4.698 4.965 -0.267 17635 3461 1 6 . 1 1 81 81 GLU C C 81 173.263 173.263 175.818 -2.555 17635 3462 1 6 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.516 0.408 17635 3463 1 6 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.472 0.570 17635 3464 1 6 . 1 1 81 81 GLU H H 81 8.201 8.201 8.389 -0.188 17635 3465 1 6 . 1 1 82 82 PHE N N 82 127.080 127.080 125.598 1.482 17635 3466 1 6 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.257 0.239 17635 3467 1 6 . 1 1 82 82 PHE C C 82 175.349 175.349 176.153 -0.804 17635 3468 1 6 . 1 1 82 82 PHE CA C 82 56.716 56.716 57.104 -0.388 17635 3469 1 6 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.713 2.281 17635 3470 1 6 . 1 1 82 82 PHE H H 82 9.162 9.162 9.020 0.142 17635 3471 1 6 . 1 1 83 83 SER N N 83 125.136 125.136 119.003 6.133 17635 3472 1 6 . 1 1 83 83 SER HA H 83 3.803 3.803 4.066 -0.263 17635 3473 1 6 . 1 1 83 83 SER C C 83 175.543 175.543 174.400 1.143 17635 3474 1 6 . 1 1 83 83 SER CA C 83 58.371 58.371 59.342 -0.971 17635 3475 1 6 . 1 1 83 83 SER CB C 83 62.519 62.519 62.660 -0.141 17635 3476 1 6 . 1 1 83 83 SER H H 83 9.193 9.193 9.001 0.192 17635 3477 1 6 . 1 1 84 84 GLY N N 84 103.581 103.581 106.304 -2.723 17635 3478 1 6 . 1 1 84 84 GLY C C 84 177.188 177.188 173.870 3.318 17635 3479 1 6 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.720 0.332 17635 3480 1 6 . 1 1 84 84 GLY H H 84 8.446 8.446 8.096 0.350 17635 3481 1 6 . 1 1 85 85 ASN N N 85 119.051 119.051 121.770 -2.719 17635 3482 1 6 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.166 0.168 17635 3483 1 6 . 1 1 85 85 ASN C C 85 178.020 178.020 172.766 5.254 17635 3484 1 6 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.372 -0.901 17635 3485 1 6 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.443 2.674 17635 3486 1 6 . 1 1 85 85 ASN H H 85 7.762 7.762 8.117 -0.355 17635 3487 1 6 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.448 -0.781 17635 3488 1 6 . 1 1 86 86 PRO C C 86 173.474 173.474 176.340 -2.866 17635 3489 1 6 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.273 0.438 17635 3490 1 6 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.187 -1.317 17635 3491 1 6 . 1 1 87 87 ILE N N 87 117.270 117.270 115.050 2.220 17635 3492 1 6 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.547 -0.401 17635 3493 1 6 . 1 1 87 87 ILE C C 87 174.495 174.495 174.587 -0.092 17635 3494 1 6 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.468 1.023 17635 3495 1 6 . 1 1 87 87 ILE CB C 87 41.671 41.671 43.067 -1.396 17635 3496 1 6 . 1 1 87 87 ILE H H 87 8.469 8.469 9.207 -0.738 17635 3497 1 6 . 1 1 88 88 LYS N N 88 122.271 122.271 120.134 2.137 17635 3498 1 6 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.823 0.369 17635 3499 1 6 . 1 1 88 88 LYS C C 88 174.393 174.393 175.219 -0.826 17635 3500 1 6 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.124 -0.986 17635 3501 1 6 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.375 0.674 17635 3502 1 6 . 1 1 88 88 LYS H H 88 8.353 8.353 8.359 -0.006 17635 3503 1 6 . 1 1 89 89 VAL N N 89 125.661 125.661 125.821 -0.160 17635 3504 1 6 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.745 0.218 17635 3505 1 6 . 1 1 89 89 VAL C C 89 177.160 177.160 175.947 1.213 17635 3506 1 6 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.470 -1.109 17635 3507 1 6 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.707 2.063 17635 3508 1 6 . 1 1 89 89 VAL H H 89 9.414 9.414 8.541 0.873 17635 3509 1 6 . 1 1 90 90 SER N N 90 119.538 119.538 121.135 -1.597 17635 3510 1 6 . 1 1 90 90 SER HA H 90 4.710 4.710 4.662 0.048 17635 3511 1 6 . 1 1 90 90 SER C C 90 176.533 176.533 173.248 3.285 17635 3512 1 6 . 1 1 90 90 SER CA C 90 56.936 56.936 56.198 0.738 17635 3513 1 6 . 1 1 90 90 SER CB C 90 66.470 66.470 65.638 0.832 17635 3514 1 6 . 1 1 90 90 SER H H 90 8.945 8.945 8.169 0.776 17635 3515 1 6 . 1 1 91 91 PHE N N 91 120.115 120.115 121.196 -1.081 17635 3516 1 6 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.717 -0.044 17635 3517 1 6 . 1 1 91 91 PHE C C 91 173.349 173.349 175.890 -2.541 17635 3518 1 6 . 1 1 91 91 PHE CA C 91 61.155 61.155 57.338 3.817 17635 3519 1 6 . 1 1 91 91 PHE CB C 91 39.503 39.503 39.526 -0.024 17635 3520 1 6 . 1 1 91 91 PHE H H 91 8.919 8.919 8.541 0.378 17635 3521 1 6 . 1 1 92 92 ALA N N 92 124.386 124.386 130.077 -5.691 17635 3522 1 6 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.509 -0.153 17635 3523 1 6 . 1 1 92 92 ALA C C 92 172.984 172.984 176.553 -3.569 17635 3524 1 6 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.349 -0.251 17635 3525 1 6 . 1 1 92 92 ALA CB C 92 19.406 19.406 20.801 -1.395 17635 3526 1 6 . 1 1 92 92 ALA H H 92 8.563 8.563 8.251 0.312 17635 3527 1 6 . 1 1 93 93 THR N N 93 116.073 116.073 110.843 5.230 17635 3528 1 6 . 1 1 93 93 THR HA H 93 4.208 4.208 4.598 -0.390 17635 3529 1 6 . 1 1 93 93 THR C C 93 176.032 176.032 175.666 0.366 17635 3530 1 6 . 1 1 93 93 THR CA C 93 62.255 62.255 60.466 1.789 17635 3531 1 6 . 1 1 93 93 THR CB C 93 69.708 69.708 70.784 -1.076 17635 3532 1 6 . 1 1 93 93 THR H H 93 8.312 8.312 8.124 0.188 17635 3533 1 6 . 1 1 94 94 ARG N N 94 124.359 124.359 119.708 4.651 17635 3534 1 6 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.267 0.070 17635 3535 1 6 . 1 1 94 94 ARG C C 94 174.426 174.426 176.351 -1.925 17635 3536 1 6 . 1 1 94 94 ARG CA C 94 56.055 56.055 58.379 -2.324 17635 3537 1 6 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.564 0.346 17635 3538 1 6 . 1 1 94 94 ARG H H 94 8.493 8.493 8.710 -0.217 17635 3539 1 6 . 1 1 95 95 ARG N N 95 122.515 122.515 116.384 6.131 17635 3540 1 6 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.476 -0.248 17635 3541 1 6 . 1 1 95 95 ARG C C 95 174.306 174.306 174.685 -0.379 17635 3542 1 6 . 1 1 95 95 ARG CA C 95 56.142 56.142 55.091 1.051 17635 3543 1 6 . 1 1 95 95 ARG CB C 95 30.966 30.966 31.276 -0.310 17635 3544 1 6 . 1 1 95 95 ARG H H 95 8.343 8.343 7.519 0.825 17635 3545 1 6 . 1 1 96 96 ALA N N 96 125.127 125.127 123.148 1.979 17635 3546 1 6 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.160 0.049 17635 3547 1 6 . 1 1 96 96 ALA C C 96 173.226 173.226 176.529 -3.303 17635 3548 1 6 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.988 -0.218 17635 3549 1 6 . 1 1 96 96 ALA CB C 96 19.193 19.193 18.748 0.445 17635 3550 1 6 . 1 1 96 96 ALA H H 96 8.402 8.402 8.441 -0.039 17635 3551 1 6 . 1 1 97 97 ASP N N 97 118.483 118.483 122.698 -4.215 17635 3552 1 6 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.449 0.049 17635 3553 1 6 . 1 1 97 97 ASP C C 97 174.302 174.302 177.128 -2.826 17635 3554 1 6 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.644 -0.553 17635 3555 1 6 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.369 -0.462 17635 3556 1 6 . 1 1 97 97 ASP H H 97 8.206 8.206 8.361 -0.155 17635 3557 1 6 . 1 1 98 98 PHE N N 98 120.321 120.321 119.608 0.713 17635 3558 1 6 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.298 0.192 17635 3559 1 6 . 1 1 98 98 PHE C C 98 174.878 174.878 175.891 -1.013 17635 3560 1 6 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.837 -0.677 17635 3561 1 6 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.330 0.973 17635 3562 1 6 . 1 1 98 98 PHE H H 98 7.990 7.990 7.760 0.230 17635 3563 1 6 . 1 1 99 99 ASN N N 99 120.016 120.016 117.452 2.564 17635 3564 1 6 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.923 -0.314 17635 3565 1 6 . 1 1 99 99 ASN C C 99 175.348 175.348 175.369 -0.021 17635 3566 1 6 . 1 1 99 99 ASN CA C 99 53.313 53.313 52.219 1.094 17635 3567 1 6 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.575 -0.848 17635 3568 1 6 . 1 1 99 99 ASN H H 99 8.336 8.336 7.911 0.425 17635 3569 1 6 . 1 1 100 100 ARG N N 100 121.374 121.374 120.102 1.272 17635 3570 1 6 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.071 0.202 17635 3571 1 6 . 1 1 100 100 ARG C C 100 173.627 173.627 177.674 -4.047 17635 3572 1 6 . 1 1 100 100 ARG CA C 100 56.492 56.492 58.040 -1.548 17635 3573 1 6 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.534 -0.015 17635 3574 1 6 . 1 1 100 100 ARG H H 100 8.181 8.181 8.548 -0.367 17635 3575 1 6 . 1 1 101 101 GLY N N 101 109.586 109.586 106.127 3.459 17635 3576 1 6 . 1 1 101 101 GLY C C 101 175.739 175.739 173.498 2.241 17635 3577 1 6 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.294 1.086 17635 3578 1 6 . 1 1 101 101 GLY H H 101 8.413 8.413 7.939 0.474 17635 3579 1 6 . 1 1 102 102 GLY N N 102 108.692 108.692 108.127 0.565 17635 3580 1 6 . 1 1 102 102 GLY C C 102 176.286 176.286 174.300 1.986 17635 3581 1 6 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.754 -0.416 17635 3582 1 6 . 1 1 102 102 GLY H H 102 8.281 8.281 8.385 -0.104 17635 3583 1 6 . 1 1 103 103 GLY N N 103 108.844 108.844 109.577 -0.733 17635 3584 1 6 . 1 1 103 103 GLY C C 103 175.798 175.798 174.093 1.705 17635 3585 1 6 . 1 1 103 103 GLY CA C 103 45.346 45.346 45.071 0.275 17635 3586 1 6 . 1 1 103 103 GLY H H 103 8.364 8.364 8.411 -0.047 17635 3587 1 6 . 1 1 104 104 ASN N N 104 118.527 118.527 120.618 -2.091 17635 3588 1 6 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.681 0.037 17635 3589 1 6 . 1 1 104 104 ASN C C 104 174.547 174.547 175.190 -0.643 17635 3590 1 6 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.654 -0.445 17635 3591 1 6 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.007 -0.128 17635 3592 1 6 . 1 1 104 104 ASN H H 104 8.438 8.438 8.307 0.131 17635 3593 1 6 . 1 1 105 105 GLY N N 105 109.166 109.166 108.613 0.553 17635 3594 1 6 . 1 1 105 105 GLY C C 105 176.074 176.074 173.589 2.485 17635 3595 1 6 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.513 1.089 17635 3596 1 6 . 1 1 105 105 GLY H H 105 8.477 8.477 8.249 0.228 17635 3597 1 6 . 1 1 106 106 ARG N N 106 120.341 120.341 121.912 -1.571 17635 3598 1 6 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.562 -0.211 17635 3599 1 6 . 1 1 106 106 ARG C C 106 173.491 173.491 176.748 -3.257 17635 3600 1 6 . 1 1 106 106 ARG CA C 106 56.227 56.227 56.106 0.121 17635 3601 1 6 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.811 -0.182 17635 3602 1 6 . 1 1 106 106 ARG H H 106 8.244 8.244 8.531 -0.287 17635 3603 1 6 . 1 1 107 107 GLY N N 107 109.856 109.856 111.080 -1.224 17635 3604 1 6 . 1 1 107 107 GLY C C 107 175.834 175.834 173.498 2.336 17635 3605 1 6 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.696 0.745 17635 3606 1 6 . 1 1 107 107 GLY H H 107 8.522 8.522 8.657 -0.135 17635 3607 1 7 . 1 1 2 2 GLN N N 2 121.692 121.692 120.070 1.622 17635 3608 1 7 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.316 -0.050 17635 3609 1 7 . 1 1 2 2 GLN C C 2 175.248 175.248 175.667 -0.419 17635 3610 1 7 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.511 0.485 17635 3611 1 7 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.348 0.291 17635 3612 1 7 . 1 1 2 2 GLN H H 2 8.621 8.621 8.272 0.349 17635 3613 1 7 . 1 1 3 3 ASP N N 3 121.801 121.801 120.450 1.351 17635 3614 1 7 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.737 -0.169 17635 3615 1 7 . 1 1 3 3 ASP C C 3 174.336 174.336 174.509 -0.173 17635 3616 1 7 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.059 0.003 17635 3617 1 7 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.538 0.533 17635 3618 1 7 . 1 1 3 3 ASP H H 3 8.436 8.436 8.454 -0.018 17635 3619 1 7 . 1 1 4 4 ASN N N 4 120.292 120.292 120.035 0.257 17635 3620 1 7 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.834 -0.197 17635 3621 1 7 . 1 1 4 4 ASN C C 4 174.415 174.415 174.376 0.039 17635 3622 1 7 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.754 1.107 17635 3623 1 7 . 1 1 4 4 ASN CB C 4 38.534 38.534 39.697 -1.163 17635 3624 1 7 . 1 1 4 4 ASN H H 4 8.528 8.528 8.242 0.286 17635 3625 1 7 . 1 1 5 5 SER N N 5 117.091 117.091 116.160 0.931 17635 3626 1 7 . 1 1 5 5 SER HA H 5 4.163 4.163 4.521 -0.358 17635 3627 1 7 . 1 1 5 5 SER C C 5 176.370 176.370 174.648 1.722 17635 3628 1 7 . 1 1 5 5 SER CA C 5 60.846 60.846 58.536 2.310 17635 3629 1 7 . 1 1 5 5 SER CB C 5 63.136 63.136 63.780 -0.644 17635 3630 1 7 . 1 1 5 5 SER H H 5 8.470 8.470 8.622 -0.152 17635 3631 1 7 . 1 1 6 6 ASP N N 6 119.436 119.436 119.419 0.017 17635 3632 1 7 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.659 0.036 17635 3633 1 7 . 1 1 6 6 ASP C C 6 175.048 175.048 174.781 0.267 17635 3634 1 7 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.401 -0.307 17635 3635 1 7 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.623 0.312 17635 3636 1 7 . 1 1 6 6 ASP H H 6 8.218 8.218 8.230 -0.012 17635 3637 1 7 . 1 1 7 7 ASN N N 7 119.696 119.696 119.172 0.524 17635 3638 1 7 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.726 -0.098 17635 3639 1 7 . 1 1 7 7 ASN C C 7 176.539 176.539 174.577 1.962 17635 3640 1 7 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.228 -0.070 17635 3641 1 7 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.176 0.683 17635 3642 1 7 . 1 1 7 7 ASN H H 7 7.734 7.734 8.351 -0.617 17635 3643 1 7 . 1 1 8 8 ASN N N 8 119.436 119.436 120.332 -0.896 17635 3644 1 7 . 1 1 8 8 ASN HA H 8 4.868 4.868 5.156 -0.288 17635 3645 1 7 . 1 1 8 8 ASN C C 8 175.327 175.327 174.058 1.269 17635 3646 1 7 . 1 1 8 8 ASN CA C 8 53.204 53.204 53.199 0.005 17635 3647 1 7 . 1 1 8 8 ASN CB C 8 38.495 38.495 41.950 -3.454 17635 3648 1 7 . 1 1 8 8 ASN H H 8 8.350 8.350 8.053 0.297 17635 3649 1 7 . 1 1 9 9 THR N N 9 118.650 118.650 116.679 1.971 17635 3650 1 7 . 1 1 9 9 THR HA H 9 5.557 5.557 5.041 0.516 17635 3651 1 7 . 1 1 9 9 THR C C 9 177.117 177.117 173.794 3.323 17635 3652 1 7 . 1 1 9 9 THR CA C 9 62.314 62.314 62.108 0.206 17635 3653 1 7 . 1 1 9 9 THR CB C 9 71.225 71.225 69.945 1.280 17635 3654 1 7 . 1 1 9 9 THR H H 9 8.428 8.428 7.760 0.668 17635 3655 1 7 . 1 1 10 10 ILE N N 10 118.556 118.556 118.910 -0.354 17635 3656 1 7 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.821 0.344 17635 3657 1 7 . 1 1 10 10 ILE C C 10 176.837 176.837 174.196 2.641 17635 3658 1 7 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.558 0.740 17635 3659 1 7 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.388 -1.508 17635 3660 1 7 . 1 1 10 10 ILE H H 10 8.770 8.770 8.821 -0.051 17635 3661 1 7 . 1 1 11 11 PHE N N 11 123.798 123.798 119.901 3.897 17635 3662 1 7 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.013 0.407 17635 3663 1 7 . 1 1 11 11 PHE C C 11 177.066 177.066 175.650 1.416 17635 3664 1 7 . 1 1 11 11 PHE CA C 11 55.362 55.362 54.549 0.813 17635 3665 1 7 . 1 1 11 11 PHE CB C 11 41.868 41.868 40.407 1.461 17635 3666 1 7 . 1 1 11 11 PHE H H 11 9.548 9.548 7.939 1.609 17635 3667 1 7 . 1 1 12 12 VAL N N 12 127.993 127.993 124.654 3.339 17635 3668 1 7 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.536 0.422 17635 3669 1 7 . 1 1 12 12 VAL C C 12 176.965 176.965 175.298 1.667 17635 3670 1 7 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.040 -1.205 17635 3671 1 7 . 1 1 12 12 VAL CB C 12 34.800 34.800 31.967 2.833 17635 3672 1 7 . 1 1 12 12 VAL H H 12 8.940 8.940 9.327 -0.387 17635 3673 1 7 . 1 1 13 13 GLN N N 13 122.289 122.289 126.366 -4.077 17635 3674 1 7 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.595 0.184 17635 3675 1 7 . 1 1 13 13 GLN C C 13 175.631 175.631 176.100 -0.469 17635 3676 1 7 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.583 0.527 17635 3677 1 7 . 1 1 13 13 GLN CB C 13 34.132 34.132 29.505 4.627 17635 3678 1 7 . 1 1 13 13 GLN H H 13 8.747 8.747 8.332 0.415 17635 3679 1 7 . 1 1 14 14 GLY N N 14 109.212 109.212 113.434 -4.222 17635 3680 1 7 . 1 1 14 14 GLY C C 14 175.436 175.436 173.175 2.261 17635 3681 1 7 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.218 0.212 17635 3682 1 7 . 1 1 14 14 GLY H H 14 8.236 8.236 8.524 -0.288 17635 3683 1 7 . 1 1 15 15 LEU N N 15 117.824 117.824 121.082 -3.258 17635 3684 1 7 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.318 -0.612 17635 3685 1 7 . 1 1 15 15 LEU C C 15 174.111 174.111 177.007 -2.896 17635 3686 1 7 . 1 1 15 15 LEU CA C 15 55.718 55.718 56.389 -0.671 17635 3687 1 7 . 1 1 15 15 LEU CB C 15 42.433 42.433 42.156 0.277 17635 3688 1 7 . 1 1 15 15 LEU H H 15 8.442 8.442 7.800 0.642 17635 3689 1 7 . 1 1 16 16 GLY N N 16 105.063 105.063 107.103 -2.040 17635 3690 1 7 . 1 1 16 16 GLY C C 16 177.771 177.771 174.492 3.279 17635 3691 1 7 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.284 -1.190 17635 3692 1 7 . 1 1 16 16 GLY H H 16 8.006 8.006 8.345 -0.339 17635 3693 1 7 . 1 1 17 17 GLU N N 17 113.781 113.781 117.247 -3.466 17635 3694 1 7 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.134 -0.015 17635 3695 1 7 . 1 1 17 17 GLU C C 17 173.937 173.937 175.243 -1.306 17635 3696 1 7 . 1 1 17 17 GLU CA C 17 57.281 57.281 57.014 0.267 17635 3697 1 7 . 1 1 17 17 GLU CB C 17 30.436 30.436 27.733 2.703 17635 3698 1 7 . 1 1 17 17 GLU H H 17 8.134 8.134 8.953 -0.819 17635 3699 1 7 . 1 1 18 18 ASN N N 18 116.660 116.660 112.643 4.017 17635 3700 1 7 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.711 0.230 17635 3701 1 7 . 1 1 18 18 ASN C C 18 175.900 175.900 173.709 2.191 17635 3702 1 7 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.165 0.313 17635 3703 1 7 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.000 -0.515 17635 3704 1 7 . 1 1 18 18 ASN H H 18 8.407 8.407 8.043 0.364 17635 3705 1 7 . 1 1 19 19 VAL N N 19 118.323 118.323 121.977 -3.654 17635 3706 1 7 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.868 0.284 17635 3707 1 7 . 1 1 19 19 VAL C C 19 177.655 177.655 175.240 2.415 17635 3708 1 7 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.169 -1.292 17635 3709 1 7 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.432 2.081 17635 3710 1 7 . 1 1 19 19 VAL H H 19 6.855 6.855 7.736 -0.881 17635 3711 1 7 . 1 1 20 20 THR N N 20 111.636 111.636 116.476 -4.840 17635 3712 1 7 . 1 1 20 20 THR HA H 20 4.719 4.719 4.638 0.081 17635 3713 1 7 . 1 1 20 20 THR C C 20 175.266 175.266 175.196 0.070 17635 3714 1 7 . 1 1 20 20 THR CA C 20 58.698 58.698 59.931 -1.233 17635 3715 1 7 . 1 1 20 20 THR CB C 20 72.948 72.948 71.997 0.951 17635 3716 1 7 . 1 1 20 20 THR H H 20 7.328 7.328 7.682 -0.354 17635 3717 1 7 . 1 1 21 21 ILE N N 21 122.147 122.147 123.290 -1.143 17635 3718 1 7 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.760 -0.242 17635 3719 1 7 . 1 1 21 21 ILE C C 21 173.198 173.198 177.561 -4.363 17635 3720 1 7 . 1 1 21 21 ILE CA C 21 65.772 65.772 65.191 0.582 17635 3721 1 7 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.844 -0.261 17635 3722 1 7 . 1 1 21 21 ILE H H 21 9.074 9.074 8.775 0.299 17635 3723 1 7 . 1 1 22 22 GLU N N 22 118.154 118.154 120.356 -2.202 17635 3724 1 7 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.121 -0.135 17635 3725 1 7 . 1 1 22 22 GLU C C 22 171.799 171.799 178.802 -7.003 17635 3726 1 7 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.285 1.328 17635 3727 1 7 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.714 0.077 17635 3728 1 7 . 1 1 22 22 GLU H H 22 8.814 8.814 8.666 0.148 17635 3729 1 7 . 1 1 23 23 SER N N 23 115.921 115.921 114.941 0.980 17635 3730 1 7 . 1 1 23 23 SER HA H 23 4.384 4.384 4.298 0.086 17635 3731 1 7 . 1 1 23 23 SER C C 23 172.447 172.447 176.789 -4.342 17635 3732 1 7 . 1 1 23 23 SER CA C 23 61.239 61.239 61.698 -0.459 17635 3733 1 7 . 1 1 23 23 SER CB C 23 62.838 62.838 62.900 -0.062 17635 3734 1 7 . 1 1 23 23 SER H H 23 8.236 8.236 8.227 0.009 17635 3735 1 7 . 1 1 24 24 VAL N N 24 124.867 124.867 121.751 3.116 17635 3736 1 7 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.276 -0.528 17635 3737 1 7 . 1 1 24 24 VAL C C 24 173.016 173.016 177.837 -4.821 17635 3738 1 7 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.238 1.016 17635 3739 1 7 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.875 -0.342 17635 3740 1 7 . 1 1 24 24 VAL H H 24 7.973 7.973 8.002 -0.029 17635 3741 1 7 . 1 1 25 25 ALA N N 25 123.198 123.198 121.970 1.228 17635 3742 1 7 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.109 -0.210 17635 3743 1 7 . 1 1 25 25 ALA C C 25 171.061 171.061 179.227 -8.166 17635 3744 1 7 . 1 1 25 25 ALA CA C 25 55.695 55.695 55.297 0.398 17635 3745 1 7 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.199 -0.461 17635 3746 1 7 . 1 1 25 25 ALA H H 25 8.695 8.695 8.672 0.023 17635 3747 1 7 . 1 1 26 26 ASP N N 26 115.503 115.503 118.846 -3.343 17635 3748 1 7 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.533 -0.210 17635 3749 1 7 . 1 1 26 26 ASP C C 26 173.108 173.108 177.632 -4.524 17635 3750 1 7 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.510 0.814 17635 3751 1 7 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.327 -0.275 17635 3752 1 7 . 1 1 26 26 ASP H H 26 8.312 8.312 8.249 0.063 17635 3753 1 7 . 1 1 27 27 TYR N N 27 119.224 119.224 116.970 2.254 17635 3754 1 7 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.606 -0.406 17635 3755 1 7 . 1 1 27 27 TYR C C 27 172.908 172.908 175.911 -3.003 17635 3756 1 7 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.313 2.703 17635 3757 1 7 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.437 0.495 17635 3758 1 7 . 1 1 27 27 TYR H H 27 7.533 7.533 7.957 -0.424 17635 3759 1 7 . 1 1 28 28 PHE N N 28 112.595 112.595 120.046 -7.451 17635 3760 1 7 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.033 0.297 17635 3761 1 7 . 1 1 28 28 PHE C C 28 173.082 173.082 174.981 -1.899 17635 3762 1 7 . 1 1 28 28 PHE CA C 28 61.784 61.784 57.572 4.212 17635 3763 1 7 . 1 1 28 28 PHE CB C 28 40.003 40.003 40.193 -0.190 17635 3764 1 7 . 1 1 28 28 PHE H H 28 7.974 7.974 8.326 -0.352 17635 3765 1 7 . 1 1 29 29 LYS N N 29 118.820 118.820 117.877 0.943 17635 3766 1 7 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.649 0.268 17635 3767 1 7 . 1 1 29 29 LYS C C 29 173.682 173.682 176.208 -2.526 17635 3768 1 7 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.242 2.038 17635 3769 1 7 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.155 0.136 17635 3770 1 7 . 1 1 29 29 LYS H H 29 8.325 8.325 7.472 0.853 17635 3771 1 7 . 1 1 30 30 GLN N N 30 116.232 116.232 118.201 -1.969 17635 3772 1 7 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.236 -0.101 17635 3773 1 7 . 1 1 30 30 GLN C C 30 173.790 173.790 176.491 -2.701 17635 3774 1 7 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.238 0.308 17635 3775 1 7 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.448 1.450 17635 3776 1 7 . 1 1 30 30 GLN H H 30 7.518 7.518 7.965 -0.447 17635 3777 1 7 . 1 1 31 31 ILE N N 31 116.489 116.489 120.134 -3.645 17635 3778 1 7 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.926 0.313 17635 3779 1 7 . 1 1 31 31 ILE C C 31 175.599 175.599 175.637 -0.038 17635 3780 1 7 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.397 -3.176 17635 3781 1 7 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.584 1.750 17635 3782 1 7 . 1 1 31 31 ILE H H 31 7.809 7.809 7.818 -0.009 17635 3783 1 7 . 1 1 32 32 GLY N N 32 107.416 107.416 104.896 2.520 17635 3784 1 7 . 1 1 32 32 GLY C C 32 180.182 180.182 172.250 7.932 17635 3785 1 7 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.369 0.625 17635 3786 1 7 . 1 1 32 32 GLY H H 32 7.344 7.344 7.299 0.045 17635 3787 1 7 . 1 1 33 33 ILE N N 33 117.784 117.784 121.270 -3.486 17635 3788 1 7 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.521 -0.432 17635 3789 1 7 . 1 1 33 33 ILE C C 33 173.301 173.301 175.168 -1.867 17635 3790 1 7 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.780 0.861 17635 3791 1 7 . 1 1 33 33 ILE CB C 33 38.659 38.659 38.462 0.197 17635 3792 1 7 . 1 1 33 33 ILE H H 33 8.173 8.173 7.987 0.186 17635 3793 1 7 . 1 1 34 34 ILE N N 34 131.781 131.781 129.137 2.644 17635 3794 1 7 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.261 -0.474 17635 3795 1 7 . 1 1 34 34 ILE C C 34 174.663 174.663 176.447 -1.784 17635 3796 1 7 . 1 1 34 34 ILE CA C 34 61.370 61.370 61.695 -0.325 17635 3797 1 7 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.250 -0.255 17635 3798 1 7 . 1 1 34 34 ILE H H 34 8.687 8.687 8.847 -0.160 17635 3799 1 7 . 1 1 35 35 LYS N N 35 130.372 130.372 129.688 0.684 17635 3800 1 7 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.076 0.008 17635 3801 1 7 . 1 1 35 35 LYS C C 35 175.376 175.376 176.466 -1.090 17635 3802 1 7 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.972 0.501 17635 3803 1 7 . 1 1 35 35 LYS CB C 35 33.664 33.664 30.899 2.765 17635 3804 1 7 . 1 1 35 35 LYS H H 35 8.680 8.680 8.753 -0.073 17635 3805 1 7 . 1 1 36 36 THR N N 36 118.312 118.312 119.842 -1.530 17635 3806 1 7 . 1 1 36 36 THR HA H 36 4.415 4.415 4.310 0.105 17635 3807 1 7 . 1 1 36 36 THR C C 36 176.394 176.394 174.276 2.118 17635 3808 1 7 . 1 1 36 36 THR CA C 36 61.340 61.340 63.084 -1.744 17635 3809 1 7 . 1 1 36 36 THR CB C 36 70.809 70.809 69.469 1.339 17635 3810 1 7 . 1 1 36 36 THR H H 36 8.456 8.456 8.097 0.359 17635 3811 1 7 . 1 1 37 37 ASN N N 37 124.092 124.092 122.602 1.490 17635 3812 1 7 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.819 -0.289 17635 3813 1 7 . 1 1 37 37 ASN C C 37 174.235 174.235 175.797 -1.562 17635 3814 1 7 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.959 1.105 17635 3815 1 7 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.653 -0.726 17635 3816 1 7 . 1 1 37 37 ASN H H 37 8.794 8.794 8.710 0.084 17635 3817 1 7 . 1 1 38 38 LYS N N 38 127.969 127.969 120.180 7.789 17635 3818 1 7 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.428 -0.424 17635 3819 1 7 . 1 1 38 38 LYS C C 38 172.702 172.702 176.406 -3.704 17635 3820 1 7 . 1 1 38 38 LYS CA C 38 58.458 58.458 57.815 0.643 17635 3821 1 7 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.431 -0.264 17635 3822 1 7 . 1 1 38 38 LYS H H 38 8.962 8.962 8.668 0.294 17635 3823 1 7 . 1 1 39 39 LYS N N 39 117.413 117.413 119.035 -1.622 17635 3824 1 7 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.286 -0.028 17635 3825 1 7 . 1 1 39 39 LYS C C 39 172.261 172.261 177.450 -5.189 17635 3826 1 7 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.719 0.600 17635 3827 1 7 . 1 1 39 39 LYS CB C 39 32.797 32.797 31.891 0.906 17635 3828 1 7 . 1 1 39 39 LYS H H 39 8.314 8.314 7.963 0.351 17635 3829 1 7 . 1 1 40 40 THR N N 40 105.547 105.547 110.579 -5.032 17635 3830 1 7 . 1 1 40 40 THR HA H 40 4.465 4.465 4.362 0.103 17635 3831 1 7 . 1 1 40 40 THR C C 40 174.021 174.021 175.679 -1.658 17635 3832 1 7 . 1 1 40 40 THR CA C 40 61.260 61.260 61.771 -0.511 17635 3833 1 7 . 1 1 40 40 THR CB C 40 70.997 70.997 69.179 1.818 17635 3834 1 7 . 1 1 40 40 THR H H 40 7.422 7.422 7.518 -0.096 17635 3835 1 7 . 1 1 41 41 GLY N N 41 111.631 111.631 110.441 1.190 17635 3836 1 7 . 1 1 41 41 GLY C C 41 176.727 176.727 173.374 3.353 17635 3837 1 7 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.266 0.464 17635 3838 1 7 . 1 1 41 41 GLY H H 41 8.644 8.644 8.303 0.341 17635 3839 1 7 . 1 1 42 42 GLN N N 42 118.894 118.894 119.800 -0.906 17635 3840 1 7 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.834 -0.165 17635 3841 1 7 . 1 1 42 42 GLN C C 42 177.178 177.178 173.680 3.498 17635 3842 1 7 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.645 0.936 17635 3843 1 7 . 1 1 42 42 GLN CB C 42 29.230 29.230 30.142 -0.912 17635 3844 1 7 . 1 1 42 42 GLN H H 42 7.662 7.662 7.492 0.170 17635 3845 1 7 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.374 0.221 17635 3846 1 7 . 1 1 43 43 PRO C C 43 172.629 172.629 175.704 -3.075 17635 3847 1 7 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.878 -1.056 17635 3848 1 7 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.216 0.480 17635 3849 1 7 . 1 1 44 44 MET N N 44 124.162 124.162 120.043 4.119 17635 3850 1 7 . 1 1 44 44 MET HA H 44 4.432 4.432 4.661 -0.229 17635 3851 1 7 . 1 1 44 44 MET C C 44 176.474 176.474 174.349 2.125 17635 3852 1 7 . 1 1 44 44 MET CA C 44 55.419 55.419 54.510 0.909 17635 3853 1 7 . 1 1 44 44 MET CB C 44 30.555 30.555 35.666 -5.111 17635 3854 1 7 . 1 1 44 44 MET H H 44 8.874 8.874 8.093 0.781 17635 3855 1 7 . 1 1 45 45 ILE N N 45 126.237 126.237 122.334 3.903 17635 3856 1 7 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.730 0.072 17635 3857 1 7 . 1 1 45 45 ILE C C 45 176.415 176.415 174.518 1.897 17635 3858 1 7 . 1 1 45 45 ILE CA C 45 59.216 59.216 59.947 -0.730 17635 3859 1 7 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.600 -0.374 17635 3860 1 7 . 1 1 45 45 ILE H H 45 7.730 7.730 8.442 -0.712 17635 3861 1 7 . 1 1 46 46 ASN N N 46 124.735 124.735 124.988 -0.253 17635 3862 1 7 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.939 0.002 17635 3863 1 7 . 1 1 46 46 ASN C C 46 176.836 176.836 174.205 2.631 17635 3864 1 7 . 1 1 46 46 ASN CA C 46 51.561 51.561 51.993 -0.432 17635 3865 1 7 . 1 1 46 46 ASN CB C 46 40.470 40.470 38.950 1.520 17635 3866 1 7 . 1 1 46 46 ASN H H 46 8.384 8.384 8.558 -0.174 17635 3867 1 7 . 1 1 47 47 LEU N N 47 122.487 122.487 119.438 3.049 17635 3868 1 7 . 1 1 47 47 LEU HA H 47 4.715 4.715 5.090 -0.375 17635 3869 1 7 . 1 1 47 47 LEU C C 47 174.190 174.190 176.421 -2.231 17635 3870 1 7 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.532 -0.200 17635 3871 1 7 . 1 1 47 47 LEU CB C 47 42.277 42.277 43.759 -1.482 17635 3872 1 7 . 1 1 47 47 LEU H H 47 8.594 8.594 8.267 0.327 17635 3873 1 7 . 1 1 48 48 TYR N N 48 121.842 121.842 121.931 -0.089 17635 3874 1 7 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.676 0.091 17635 3875 1 7 . 1 1 48 48 TYR C C 48 173.649 173.649 175.360 -1.711 17635 3876 1 7 . 1 1 48 48 TYR CA C 48 57.894 57.894 57.402 0.492 17635 3877 1 7 . 1 1 48 48 TYR CB C 48 39.199 39.199 37.035 2.164 17635 3878 1 7 . 1 1 48 48 TYR H H 48 7.666 7.666 8.648 -0.982 17635 3879 1 7 . 1 1 49 49 THR N N 49 116.554 116.554 116.161 0.393 17635 3880 1 7 . 1 1 49 49 THR HA H 49 4.806 4.806 4.776 0.030 17635 3881 1 7 . 1 1 49 49 THR C C 49 176.654 176.654 174.445 2.209 17635 3882 1 7 . 1 1 49 49 THR CA C 49 60.693 60.693 59.422 1.271 17635 3883 1 7 . 1 1 49 49 THR CB C 49 71.437 71.437 71.289 0.148 17635 3884 1 7 . 1 1 49 49 THR H H 49 8.965 8.965 8.048 0.917 17635 3885 1 7 . 1 1 50 50 ASP N N 50 123.826 123.826 121.233 2.593 17635 3886 1 7 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.703 -0.079 17635 3887 1 7 . 1 1 50 50 ASP C C 50 173.380 173.380 176.682 -3.302 17635 3888 1 7 . 1 1 50 50 ASP CA C 50 54.088 54.088 53.704 0.384 17635 3889 1 7 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.948 0.919 17635 3890 1 7 . 1 1 50 50 ASP H H 50 8.939 8.939 8.975 -0.036 17635 3891 1 7 . 1 1 51 51 ARG N N 51 127.794 127.794 119.758 8.036 17635 3892 1 7 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.314 -0.269 17635 3893 1 7 . 1 1 51 51 ARG C C 51 173.101 173.101 175.724 -2.623 17635 3894 1 7 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.405 2.157 17635 3895 1 7 . 1 1 51 51 ARG CB C 51 30.167 30.167 28.795 1.372 17635 3896 1 7 . 1 1 51 51 ARG H H 51 8.958 8.958 8.594 0.364 17635 3897 1 7 . 1 1 52 52 GLU N N 52 117.542 117.542 120.276 -2.734 17635 3898 1 7 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.408 -0.130 17635 3899 1 7 . 1 1 52 52 GLU C C 52 172.201 172.201 177.393 -5.192 17635 3900 1 7 . 1 1 52 52 GLU CA C 52 58.524 58.524 57.468 1.056 17635 3901 1 7 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.520 -0.242 17635 3902 1 7 . 1 1 52 52 GLU H H 52 8.561 8.561 8.182 0.379 17635 3903 1 7 . 1 1 53 53 THR N N 53 107.065 107.065 110.052 -2.987 17635 3904 1 7 . 1 1 53 53 THR HA H 53 4.436 4.436 4.530 -0.094 17635 3905 1 7 . 1 1 53 53 THR C C 53 173.851 173.851 175.553 -1.702 17635 3906 1 7 . 1 1 53 53 THR CA C 53 61.944 61.944 61.536 0.408 17635 3907 1 7 . 1 1 53 53 THR CB C 53 71.197 71.197 71.074 0.123 17635 3908 1 7 . 1 1 53 53 THR H H 53 8.087 8.087 8.172 -0.085 17635 3909 1 7 . 1 1 54 54 GLY N N 54 111.295 111.295 111.268 0.027 17635 3910 1 7 . 1 1 54 54 GLY C C 54 176.747 176.747 174.119 2.628 17635 3911 1 7 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.779 -0.076 17635 3912 1 7 . 1 1 54 54 GLY H H 54 8.423 8.423 7.957 0.466 17635 3913 1 7 . 1 1 55 55 LYS N N 55 119.673 119.673 119.968 -0.295 17635 3914 1 7 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.751 -0.398 17635 3915 1 7 . 1 1 55 55 LYS C C 55 173.854 173.854 175.249 -1.395 17635 3916 1 7 . 1 1 55 55 LYS CA C 55 55.842 55.842 54.279 1.563 17635 3917 1 7 . 1 1 55 55 LYS CB C 55 33.821 33.821 34.959 -1.137 17635 3918 1 7 . 1 1 55 55 LYS H H 55 7.767 7.767 8.869 -1.102 17635 3919 1 7 . 1 1 56 56 LEU N N 56 122.426 122.426 119.866 2.560 17635 3920 1 7 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.794 -0.438 17635 3921 1 7 . 1 1 56 56 LEU C C 56 172.534 172.534 176.561 -4.027 17635 3922 1 7 . 1 1 56 56 LEU CA C 56 56.255 56.255 52.461 3.794 17635 3923 1 7 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.238 -0.584 17635 3924 1 7 . 1 1 56 56 LEU H H 56 8.768 8.768 8.513 0.255 17635 3925 1 7 . 1 1 57 57 LYS N N 57 118.264 118.264 119.648 -1.384 17635 3926 1 7 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.355 -0.067 17635 3927 1 7 . 1 1 57 57 LYS C C 57 173.648 173.648 174.907 -1.259 17635 3928 1 7 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.661 -0.397 17635 3929 1 7 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.218 1.844 17635 3930 1 7 . 1 1 57 57 LYS H H 57 8.012 8.012 8.186 -0.174 17635 3931 1 7 . 1 1 58 58 GLY N N 58 108.514 108.514 112.051 -3.537 17635 3932 1 7 . 1 1 58 58 GLY C C 58 177.876 177.876 172.683 5.193 17635 3933 1 7 . 1 1 58 58 GLY CA C 58 46.364 46.364 46.381 -0.017 17635 3934 1 7 . 1 1 58 58 GLY H H 58 8.334 8.334 8.150 0.184 17635 3935 1 7 . 1 1 59 59 GLU N N 59 116.119 116.119 119.198 -3.079 17635 3936 1 7 . 1 1 59 59 GLU HA H 59 5.521 5.521 4.746 0.775 17635 3937 1 7 . 1 1 59 59 GLU C C 59 173.860 173.860 173.650 0.210 17635 3938 1 7 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.451 -2.426 17635 3939 1 7 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.080 1.224 17635 3940 1 7 . 1 1 59 59 GLU H H 59 7.202 7.202 7.989 -0.787 17635 3941 1 7 . 1 1 60 60 ALA N N 60 123.607 123.607 119.652 3.955 17635 3942 1 7 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.498 0.109 17635 3943 1 7 . 1 1 60 60 ALA C C 60 173.923 173.923 175.271 -1.348 17635 3944 1 7 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.458 -0.515 17635 3945 1 7 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.076 0.983 17635 3946 1 7 . 1 1 60 60 ALA H H 60 8.930 8.930 8.883 0.047 17635 3947 1 7 . 1 1 61 61 THR N N 61 108.384 108.384 113.789 -5.405 17635 3948 1 7 . 1 1 61 61 THR HA H 61 5.743 5.743 5.340 0.403 17635 3949 1 7 . 1 1 61 61 THR C C 61 176.172 176.172 174.116 2.056 17635 3950 1 7 . 1 1 61 61 THR CA C 61 59.625 59.625 60.235 -0.610 17635 3951 1 7 . 1 1 61 61 THR CB C 61 71.224 71.224 70.206 1.018 17635 3952 1 7 . 1 1 61 61 THR H H 61 8.452 8.452 8.789 -0.337 17635 3953 1 7 . 1 1 62 62 VAL N N 62 120.200 120.200 128.230 -8.030 17635 3954 1 7 . 1 1 62 62 VAL HA H 62 4.244 4.244 3.912 0.332 17635 3955 1 7 . 1 1 62 62 VAL C C 62 175.994 175.994 174.258 1.736 17635 3956 1 7 . 1 1 62 62 VAL CA C 62 61.426 61.426 62.101 -0.675 17635 3957 1 7 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.130 2.555 17635 3958 1 7 . 1 1 62 62 VAL H H 62 8.071 8.071 8.232 -0.161 17635 3959 1 7 . 1 1 63 63 SER N N 63 121.689 121.689 122.417 -0.728 17635 3960 1 7 . 1 1 63 63 SER HA H 63 5.261 5.261 4.657 0.604 17635 3961 1 7 . 1 1 63 63 SER C C 63 177.943 177.943 173.445 4.498 17635 3962 1 7 . 1 1 63 63 SER CA C 63 57.662 57.662 57.880 -0.218 17635 3963 1 7 . 1 1 63 63 SER CB C 63 64.427 64.427 64.122 0.305 17635 3964 1 7 . 1 1 63 63 SER H H 63 7.695 7.695 7.931 -0.236 17635 3965 1 7 . 1 1 64 64 PHE N N 64 122.640 122.640 123.718 -1.078 17635 3966 1 7 . 1 1 64 64 PHE HA H 64 4.854 4.854 5.006 -0.152 17635 3967 1 7 . 1 1 64 64 PHE C C 64 174.605 174.605 175.805 -1.200 17635 3968 1 7 . 1 1 64 64 PHE CA C 64 58.204 58.204 56.991 1.213 17635 3969 1 7 . 1 1 64 64 PHE CB C 64 41.976 41.976 41.461 0.515 17635 3970 1 7 . 1 1 64 64 PHE H H 64 9.025 9.025 8.924 0.101 17635 3971 1 7 . 1 1 65 65 ASP N N 65 119.943 119.943 121.125 -1.182 17635 3972 1 7 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.729 -0.294 17635 3973 1 7 . 1 1 65 65 ASP C C 65 174.396 174.396 175.382 -0.986 17635 3974 1 7 . 1 1 65 65 ASP CA C 65 57.442 57.442 54.833 2.609 17635 3975 1 7 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.965 0.069 17635 3976 1 7 . 1 1 65 65 ASP H H 65 8.512 8.512 8.989 -0.477 17635 3977 1 7 . 1 1 66 66 ASP N N 66 116.125 116.125 117.849 -1.724 17635 3978 1 7 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.070 0.329 17635 3979 1 7 . 1 1 66 66 ASP C C 66 175.936 175.936 174.443 1.493 17635 3980 1 7 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.236 -0.443 17635 3981 1 7 . 1 1 66 66 ASP CB C 66 42.919 42.919 41.498 1.421 17635 3982 1 7 . 1 1 66 66 ASP H H 66 8.323 8.323 7.713 0.610 17635 3983 1 7 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.706 -0.256 17635 3984 1 7 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.209 0.715 17635 3985 1 7 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.633 -0.803 17635 3986 1 7 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.269 0.150 17635 3987 1 7 . 1 1 68 68 PRO C C 68 171.345 171.345 178.581 -7.236 17635 3988 1 7 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.952 0.283 17635 3989 1 7 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.933 0.064 17635 3990 1 7 . 1 1 69 69 SER N N 69 114.544 114.544 115.177 -0.633 17635 3991 1 7 . 1 1 69 69 SER HA H 69 4.036 4.036 4.004 0.032 17635 3992 1 7 . 1 1 69 69 SER C C 69 176.535 176.535 176.108 0.427 17635 3993 1 7 . 1 1 69 69 SER CA C 69 61.837 61.837 61.781 0.056 17635 3994 1 7 . 1 1 69 69 SER CB C 69 62.773 62.773 62.330 0.443 17635 3995 1 7 . 1 1 69 69 SER H H 69 8.004 8.004 7.767 0.237 17635 3996 1 7 . 1 1 70 70 ALA N N 70 122.649 122.649 125.025 -2.376 17635 3997 1 7 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.920 -0.327 17635 3998 1 7 . 1 1 70 70 ALA C C 70 172.686 172.686 179.513 -6.827 17635 3999 1 7 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.385 -0.348 17635 4000 1 7 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.410 -0.546 17635 4001 1 7 . 1 1 70 70 ALA H H 70 7.383 7.383 7.510 -0.127 17635 4002 1 7 . 1 1 71 71 LYS N N 71 116.308 116.308 120.109 -3.801 17635 4003 1 7 . 1 1 71 71 LYS HA H 71 3.775 3.775 4.102 -0.327 17635 4004 1 7 . 1 1 71 71 LYS C C 71 172.333 172.333 178.626 -6.293 17635 4005 1 7 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.721 0.281 17635 4006 1 7 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.931 0.511 17635 4007 1 7 . 1 1 71 71 LYS H H 71 7.159 7.159 7.609 -0.450 17635 4008 1 7 . 1 1 72 72 ALA N N 72 119.806 119.806 121.043 -1.237 17635 4009 1 7 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.063 0.103 17635 4010 1 7 . 1 1 72 72 ALA C C 72 170.530 170.530 179.561 -9.031 17635 4011 1 7 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.877 -0.162 17635 4012 1 7 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.110 -0.290 17635 4013 1 7 . 1 1 72 72 ALA H H 72 7.924 7.924 8.427 -0.503 17635 4014 1 7 . 1 1 73 73 ALA N N 73 120.524 120.524 121.229 -0.705 17635 4015 1 7 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.024 0.255 17635 4016 1 7 . 1 1 73 73 ALA C C 73 171.039 171.039 179.536 -8.497 17635 4017 1 7 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.888 0.491 17635 4018 1 7 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.623 0.508 17635 4019 1 7 . 1 1 73 73 ALA H H 73 8.104 8.104 7.692 0.412 17635 4020 1 7 . 1 1 74 74 ILE N N 74 119.875 119.875 118.117 1.758 17635 4021 1 7 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.784 -0.370 17635 4022 1 7 . 1 1 74 74 ILE C C 74 172.435 172.435 177.548 -5.113 17635 4023 1 7 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.206 0.638 17635 4024 1 7 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.547 1.196 17635 4025 1 7 . 1 1 74 74 ILE H H 74 7.574 7.574 7.818 -0.244 17635 4026 1 7 . 1 1 75 75 ASP N N 75 117.867 117.867 118.127 -0.260 17635 4027 1 7 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.386 -0.075 17635 4028 1 7 . 1 1 75 75 ASP C C 75 172.054 172.054 176.525 -4.471 17635 4029 1 7 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.673 0.488 17635 4030 1 7 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.372 -0.841 17635 4031 1 7 . 1 1 75 75 ASP H H 75 7.937 7.937 7.916 0.021 17635 4032 1 7 . 1 1 76 76 TRP N N 76 117.313 117.313 121.052 -3.739 17635 4033 1 7 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.257 0.099 17635 4034 1 7 . 1 1 76 76 TRP C C 76 173.272 173.272 176.995 -3.723 17635 4035 1 7 . 1 1 76 76 TRP CA C 76 59.462 59.462 59.179 0.283 17635 4036 1 7 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.210 1.567 17635 4037 1 7 . 1 1 76 76 TRP H H 76 8.475 8.475 7.515 0.960 17635 4038 1 7 . 1 1 77 77 PHE N N 77 112.019 112.019 117.284 -5.265 17635 4039 1 7 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.491 0.157 17635 4040 1 7 . 1 1 77 77 PHE C C 77 173.747 173.747 175.503 -1.756 17635 4041 1 7 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.137 -0.216 17635 4042 1 7 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.957 1.773 17635 4043 1 7 . 1 1 77 77 PHE H H 77 8.488 8.488 7.331 1.157 17635 4044 1 7 . 1 1 78 78 ASP N N 78 118.408 118.408 117.860 0.548 17635 4045 1 7 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.515 -0.051 17635 4046 1 7 . 1 1 78 78 ASP C C 78 172.542 172.542 176.005 -3.463 17635 4047 1 7 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.100 3.590 17635 4048 1 7 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.716 2.170 17635 4049 1 7 . 1 1 78 78 ASP H H 78 7.978 7.978 8.752 -0.774 17635 4050 1 7 . 1 1 79 79 GLY N N 79 115.548 115.548 102.926 12.622 17635 4051 1 7 . 1 1 79 79 GLY C C 79 175.680 175.680 173.692 1.988 17635 4052 1 7 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.042 1.030 17635 4053 1 7 . 1 1 79 79 GLY H H 79 8.615 8.615 8.455 0.160 17635 4054 1 7 . 1 1 80 80 LYS N N 80 120.271 120.271 119.940 0.331 17635 4055 1 7 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.582 -0.120 17635 4056 1 7 . 1 1 80 80 LYS C C 80 175.853 175.853 175.768 0.085 17635 4057 1 7 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.961 0.189 17635 4058 1 7 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.920 -1.494 17635 4059 1 7 . 1 1 80 80 LYS H H 80 8.013 8.013 8.205 -0.192 17635 4060 1 7 . 1 1 81 81 GLU N N 81 115.765 115.765 117.983 -2.218 17635 4061 1 7 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.340 -0.642 17635 4062 1 7 . 1 1 81 81 GLU C C 81 173.263 173.263 176.101 -2.838 17635 4063 1 7 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.318 0.606 17635 4064 1 7 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.705 0.337 17635 4065 1 7 . 1 1 81 81 GLU H H 81 8.201 8.201 8.530 -0.329 17635 4066 1 7 . 1 1 82 82 PHE N N 82 127.080 127.080 122.771 4.309 17635 4067 1 7 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.663 -0.167 17635 4068 1 7 . 1 1 82 82 PHE C C 82 175.349 175.349 175.418 -0.069 17635 4069 1 7 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.169 0.547 17635 4070 1 7 . 1 1 82 82 PHE CB C 82 41.994 41.994 40.553 1.440 17635 4071 1 7 . 1 1 82 82 PHE H H 82 9.162 9.162 9.237 -0.075 17635 4072 1 7 . 1 1 83 83 SER N N 83 125.136 125.136 120.943 4.193 17635 4073 1 7 . 1 1 83 83 SER HA H 83 3.803 3.803 4.198 -0.395 17635 4074 1 7 . 1 1 83 83 SER C C 83 175.543 175.543 174.938 0.605 17635 4075 1 7 . 1 1 83 83 SER CA C 83 58.371 58.371 59.423 -1.052 17635 4076 1 7 . 1 1 83 83 SER CB C 83 62.519 62.519 62.698 -0.179 17635 4077 1 7 . 1 1 83 83 SER H H 83 9.193 9.193 9.179 0.014 17635 4078 1 7 . 1 1 84 84 GLY N N 84 103.581 103.581 103.784 -0.203 17635 4079 1 7 . 1 1 84 84 GLY C C 84 177.188 177.188 173.166 4.022 17635 4080 1 7 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.909 0.143 17635 4081 1 7 . 1 1 84 84 GLY H H 84 8.446 8.446 8.244 0.202 17635 4082 1 7 . 1 1 85 85 ASN N N 85 119.051 119.051 118.114 0.937 17635 4083 1 7 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.213 0.121 17635 4084 1 7 . 1 1 85 85 ASN C C 85 178.020 178.020 172.572 5.448 17635 4085 1 7 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.717 -0.246 17635 4086 1 7 . 1 1 85 85 ASN CB C 85 41.117 41.117 40.989 0.128 17635 4087 1 7 . 1 1 85 85 ASN H H 85 7.762 7.762 8.126 -0.364 17635 4088 1 7 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.301 -0.634 17635 4089 1 7 . 1 1 86 86 PRO C C 86 173.474 173.474 176.730 -3.256 17635 4090 1 7 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.484 0.226 17635 4091 1 7 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.104 -0.234 17635 4092 1 7 . 1 1 87 87 ILE N N 87 117.270 117.270 118.602 -1.332 17635 4093 1 7 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.517 -0.371 17635 4094 1 7 . 1 1 87 87 ILE C C 87 174.495 174.495 174.809 -0.314 17635 4095 1 7 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.639 0.852 17635 4096 1 7 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.211 -0.540 17635 4097 1 7 . 1 1 87 87 ILE H H 87 8.469 8.469 8.458 0.011 17635 4098 1 7 . 1 1 88 88 LYS N N 88 122.271 122.271 122.675 -0.404 17635 4099 1 7 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.719 0.473 17635 4100 1 7 . 1 1 88 88 LYS C C 88 174.393 174.393 175.133 -0.740 17635 4101 1 7 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.201 -1.063 17635 4102 1 7 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.401 0.648 17635 4103 1 7 . 1 1 88 88 LYS H H 88 8.353 8.353 8.263 0.090 17635 4104 1 7 . 1 1 89 89 VAL N N 89 125.661 125.661 125.631 0.030 17635 4105 1 7 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.714 0.249 17635 4106 1 7 . 1 1 89 89 VAL C C 89 177.160 177.160 176.126 1.034 17635 4107 1 7 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.575 -0.214 17635 4108 1 7 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.346 2.424 17635 4109 1 7 . 1 1 89 89 VAL H H 89 9.414 9.414 8.624 0.790 17635 4110 1 7 . 1 1 90 90 SER N N 90 119.538 119.538 121.464 -1.926 17635 4111 1 7 . 1 1 90 90 SER HA H 90 4.710 4.710 4.696 0.014 17635 4112 1 7 . 1 1 90 90 SER C C 90 176.533 176.533 173.778 2.755 17635 4113 1 7 . 1 1 90 90 SER CA C 90 56.936 56.936 56.741 0.195 17635 4114 1 7 . 1 1 90 90 SER CB C 90 66.470 66.470 65.888 0.582 17635 4115 1 7 . 1 1 90 90 SER H H 90 8.945 8.945 8.182 0.763 17635 4116 1 7 . 1 1 91 91 PHE N N 91 120.115 120.115 119.682 0.433 17635 4117 1 7 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.478 0.195 17635 4118 1 7 . 1 1 91 91 PHE C C 91 173.349 173.349 175.122 -1.773 17635 4119 1 7 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.832 4.323 17635 4120 1 7 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.513 1.990 17635 4121 1 7 . 1 1 91 91 PHE H H 91 8.919 8.919 8.461 0.458 17635 4122 1 7 . 1 1 92 92 ALA N N 92 124.386 124.386 120.688 3.698 17635 4123 1 7 . 1 1 92 92 ALA HA H 92 4.356 4.356 1.648 2.708 17635 4124 1 7 . 1 1 92 92 ALA C C 92 172.984 172.984 176.495 -3.511 17635 4125 1 7 . 1 1 92 92 ALA CA C 92 52.098 52.098 51.771 0.327 17635 4126 1 7 . 1 1 92 92 ALA CB C 92 19.406 19.406 16.099 3.307 17635 4127 1 7 . 1 1 92 92 ALA H H 92 8.563 8.563 7.256 1.307 17635 4128 1 7 . 1 1 93 93 THR N N 93 116.073 116.073 112.674 3.399 17635 4129 1 7 . 1 1 93 93 THR HA H 93 4.208 4.208 4.178 0.030 17635 4130 1 7 . 1 1 93 93 THR C C 93 176.032 176.032 175.135 0.897 17635 4131 1 7 . 1 1 93 93 THR CA C 93 62.255 62.255 62.743 -0.488 17635 4132 1 7 . 1 1 93 93 THR CB C 93 69.708 69.708 70.406 -0.698 17635 4133 1 7 . 1 1 93 93 THR H H 93 8.312 8.312 7.492 0.820 17635 4134 1 7 . 1 1 94 94 ARG N N 94 124.359 124.359 118.938 5.421 17635 4135 1 7 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.137 0.200 17635 4136 1 7 . 1 1 94 94 ARG C C 94 174.426 174.426 176.132 -1.706 17635 4137 1 7 . 1 1 94 94 ARG CA C 94 56.055 56.055 57.587 -1.532 17635 4138 1 7 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.451 0.460 17635 4139 1 7 . 1 1 94 94 ARG H H 94 8.493 8.493 8.630 -0.137 17635 4140 1 7 . 1 1 95 95 ARG N N 95 122.515 122.515 124.675 -2.160 17635 4141 1 7 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.596 -0.368 17635 4142 1 7 . 1 1 95 95 ARG C C 95 174.306 174.306 174.988 -0.682 17635 4143 1 7 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.430 -0.288 17635 4144 1 7 . 1 1 95 95 ARG CB C 95 30.966 30.966 31.598 -0.632 17635 4145 1 7 . 1 1 95 95 ARG H H 95 8.343 8.343 8.941 -0.598 17635 4146 1 7 . 1 1 96 96 ALA N N 96 125.127 125.127 122.799 2.328 17635 4147 1 7 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.332 -0.123 17635 4148 1 7 . 1 1 96 96 ALA C C 96 173.226 173.226 175.444 -2.218 17635 4149 1 7 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.007 0.763 17635 4150 1 7 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.965 -0.772 17635 4151 1 7 . 1 1 96 96 ALA H H 96 8.402 8.402 7.732 0.670 17635 4152 1 7 . 1 1 97 97 ASP N N 97 118.483 118.483 120.896 -2.413 17635 4153 1 7 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.223 0.275 17635 4154 1 7 . 1 1 97 97 ASP C C 97 174.302 174.302 176.023 -1.721 17635 4155 1 7 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.810 -0.719 17635 4156 1 7 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.012 -0.105 17635 4157 1 7 . 1 1 97 97 ASP H H 97 8.206 8.206 8.186 0.020 17635 4158 1 7 . 1 1 98 98 PHE N N 98 120.321 120.321 117.707 2.614 17635 4159 1 7 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.419 0.071 17635 4160 1 7 . 1 1 98 98 PHE C C 98 174.878 174.878 175.443 -0.565 17635 4161 1 7 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.035 0.125 17635 4162 1 7 . 1 1 98 98 PHE CB C 98 39.303 39.303 39.046 0.257 17635 4163 1 7 . 1 1 98 98 PHE H H 98 7.990 7.990 7.520 0.470 17635 4164 1 7 . 1 1 99 99 ASN N N 99 120.016 120.016 119.335 0.681 17635 4165 1 7 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.907 -0.298 17635 4166 1 7 . 1 1 99 99 ASN C C 99 175.348 175.348 175.224 0.124 17635 4167 1 7 . 1 1 99 99 ASN CA C 99 53.313 53.313 52.463 0.850 17635 4168 1 7 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.644 -0.917 17635 4169 1 7 . 1 1 99 99 ASN H H 99 8.336 8.336 8.466 -0.130 17635 4170 1 7 . 1 1 100 100 ARG N N 100 121.374 121.374 119.809 1.565 17635 4171 1 7 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.235 0.038 17635 4172 1 7 . 1 1 100 100 ARG C C 100 173.627 173.627 176.815 -3.188 17635 4173 1 7 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.258 0.234 17635 4174 1 7 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.560 -0.041 17635 4175 1 7 . 1 1 100 100 ARG H H 100 8.181 8.181 8.433 -0.252 17635 4176 1 7 . 1 1 101 101 GLY N N 101 109.586 109.586 108.102 1.484 17635 4177 1 7 . 1 1 101 101 GLY C C 101 175.739 175.739 174.442 1.297 17635 4178 1 7 . 1 1 101 101 GLY CA C 101 45.380 45.380 45.384 -0.004 17635 4179 1 7 . 1 1 101 101 GLY H H 101 8.413 8.413 8.402 0.011 17635 4180 1 7 . 1 1 102 102 GLY N N 102 108.692 108.692 111.218 -2.526 17635 4181 1 7 . 1 1 102 102 GLY C C 102 176.286 176.286 173.894 2.392 17635 4182 1 7 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.446 0.892 17635 4183 1 7 . 1 1 102 102 GLY H H 102 8.281 8.281 7.880 0.401 17635 4184 1 7 . 1 1 103 103 GLY N N 103 108.844 108.844 107.828 1.016 17635 4185 1 7 . 1 1 103 103 GLY C C 103 175.798 175.798 173.218 2.580 17635 4186 1 7 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.621 0.725 17635 4187 1 7 . 1 1 103 103 GLY H H 103 8.364 8.364 8.384 -0.020 17635 4188 1 7 . 1 1 104 104 ASN N N 104 118.527 118.527 120.201 -1.674 17635 4189 1 7 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.757 -0.039 17635 4190 1 7 . 1 1 104 104 ASN C C 104 174.547 174.547 175.154 -0.607 17635 4191 1 7 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.137 0.072 17635 4192 1 7 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.666 -0.786 17635 4193 1 7 . 1 1 104 104 ASN H H 104 8.438 8.438 8.391 0.047 17635 4194 1 7 . 1 1 105 105 GLY N N 105 109.166 109.166 108.791 0.375 17635 4195 1 7 . 1 1 105 105 GLY C C 105 176.074 176.074 173.388 2.686 17635 4196 1 7 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.051 0.551 17635 4197 1 7 . 1 1 105 105 GLY H H 105 8.477 8.477 8.501 -0.024 17635 4198 1 7 . 1 1 106 106 ARG N N 106 120.341 120.341 119.005 1.336 17635 4199 1 7 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.561 -0.210 17635 4200 1 7 . 1 1 106 106 ARG C C 106 173.491 173.491 176.258 -2.767 17635 4201 1 7 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.469 0.758 17635 4202 1 7 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.547 0.082 17635 4203 1 7 . 1 1 106 106 ARG H H 106 8.244 8.244 7.524 0.720 17635 4204 1 7 . 1 1 107 107 GLY N N 107 109.856 109.856 113.662 -3.806 17635 4205 1 7 . 1 1 107 107 GLY C C 107 175.834 175.834 174.584 1.250 17635 4206 1 7 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.746 0.695 17635 4207 1 7 . 1 1 107 107 GLY H H 107 8.522 8.522 8.827 -0.305 17635 4208 1 8 . 1 1 2 2 GLN N N 2 121.692 121.692 119.150 2.542 17635 4209 1 8 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.133 0.133 17635 4210 1 8 . 1 1 2 2 GLN C C 2 175.248 175.248 174.383 0.865 17635 4211 1 8 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.451 -0.455 17635 4212 1 8 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.657 0.982 17635 4213 1 8 . 1 1 2 2 GLN H H 2 8.621 8.621 8.269 0.352 17635 4214 1 8 . 1 1 3 3 ASP N N 3 121.801 121.801 119.389 2.412 17635 4215 1 8 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.633 -0.065 17635 4216 1 8 . 1 1 3 3 ASP C C 3 174.336 174.336 177.151 -2.815 17635 4217 1 8 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.293 -0.231 17635 4218 1 8 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.262 -0.191 17635 4219 1 8 . 1 1 3 3 ASP H H 3 8.436 8.436 8.267 0.169 17635 4220 1 8 . 1 1 4 4 ASN N N 4 120.292 120.292 116.130 4.162 17635 4221 1 8 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.299 0.338 17635 4222 1 8 . 1 1 4 4 ASN C C 4 174.415 174.415 175.715 -1.300 17635 4223 1 8 . 1 1 4 4 ASN CA C 4 53.861 53.861 55.685 -1.824 17635 4224 1 8 . 1 1 4 4 ASN CB C 4 38.534 38.534 37.370 1.164 17635 4225 1 8 . 1 1 4 4 ASN H H 4 8.528 8.528 8.622 -0.094 17635 4226 1 8 . 1 1 5 5 SER N N 5 117.091 117.091 115.801 1.290 17635 4227 1 8 . 1 1 5 5 SER HA H 5 4.163 4.163 4.328 -0.165 17635 4228 1 8 . 1 1 5 5 SER C C 5 176.370 176.370 174.867 1.503 17635 4229 1 8 . 1 1 5 5 SER CA C 5 60.846 60.846 59.021 1.825 17635 4230 1 8 . 1 1 5 5 SER CB C 5 63.136 63.136 64.096 -0.960 17635 4231 1 8 . 1 1 5 5 SER H H 5 8.470 8.470 8.360 0.110 17635 4232 1 8 . 1 1 6 6 ASP N N 6 119.436 119.436 121.038 -1.602 17635 4233 1 8 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.610 0.085 17635 4234 1 8 . 1 1 6 6 ASP C C 6 175.048 175.048 175.646 -0.598 17635 4235 1 8 . 1 1 6 6 ASP CA C 6 53.094 53.094 55.317 -2.223 17635 4236 1 8 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.973 -0.038 17635 4237 1 8 . 1 1 6 6 ASP H H 6 8.218 8.218 8.247 -0.029 17635 4238 1 8 . 1 1 7 7 ASN N N 7 119.696 119.696 116.871 2.825 17635 4239 1 8 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.474 0.154 17635 4240 1 8 . 1 1 7 7 ASN C C 7 176.539 176.539 175.357 1.182 17635 4241 1 8 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.801 -0.643 17635 4242 1 8 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.723 0.136 17635 4243 1 8 . 1 1 7 7 ASN H H 7 7.734 7.734 7.538 0.196 17635 4244 1 8 . 1 1 8 8 ASN N N 8 119.436 119.436 118.376 1.060 17635 4245 1 8 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.739 0.129 17635 4246 1 8 . 1 1 8 8 ASN C C 8 175.327 175.327 174.926 0.401 17635 4247 1 8 . 1 1 8 8 ASN CA C 8 53.204 53.204 53.739 -0.535 17635 4248 1 8 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.458 -0.963 17635 4249 1 8 . 1 1 8 8 ASN H H 8 8.350 8.350 8.432 -0.082 17635 4250 1 8 . 1 1 9 9 THR N N 9 118.650 118.650 114.823 3.827 17635 4251 1 8 . 1 1 9 9 THR HA H 9 5.557 5.557 4.700 0.857 17635 4252 1 8 . 1 1 9 9 THR C C 9 177.117 177.117 174.027 3.090 17635 4253 1 8 . 1 1 9 9 THR CA C 9 62.314 62.314 63.720 -1.406 17635 4254 1 8 . 1 1 9 9 THR CB C 9 71.225 71.225 69.602 1.623 17635 4255 1 8 . 1 1 9 9 THR H H 9 8.428 8.428 7.491 0.937 17635 4256 1 8 . 1 1 10 10 ILE N N 10 118.556 118.556 117.137 1.419 17635 4257 1 8 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.860 0.305 17635 4258 1 8 . 1 1 10 10 ILE C C 10 176.837 176.837 174.128 2.709 17635 4259 1 8 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.353 0.945 17635 4260 1 8 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.762 -1.882 17635 4261 1 8 . 1 1 10 10 ILE H H 10 8.770 8.770 8.832 -0.062 17635 4262 1 8 . 1 1 11 11 PHE N N 11 123.798 123.798 120.590 3.208 17635 4263 1 8 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.757 0.663 17635 4264 1 8 . 1 1 11 11 PHE C C 11 177.066 177.066 174.439 2.627 17635 4265 1 8 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.920 -0.558 17635 4266 1 8 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.173 0.695 17635 4267 1 8 . 1 1 11 11 PHE H H 11 9.548 9.548 7.898 1.650 17635 4268 1 8 . 1 1 12 12 VAL N N 12 127.993 127.993 126.616 1.377 17635 4269 1 8 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.552 0.406 17635 4270 1 8 . 1 1 12 12 VAL C C 12 176.965 176.965 174.464 2.501 17635 4271 1 8 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.408 -1.573 17635 4272 1 8 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.378 2.422 17635 4273 1 8 . 1 1 12 12 VAL H H 12 8.940 8.940 9.172 -0.232 17635 4274 1 8 . 1 1 13 13 GLN N N 13 122.289 122.289 127.129 -4.840 17635 4275 1 8 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.614 0.165 17635 4276 1 8 . 1 1 13 13 GLN C C 13 175.631 175.631 175.665 -0.034 17635 4277 1 8 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.623 -0.513 17635 4278 1 8 . 1 1 13 13 GLN CB C 13 34.132 34.132 32.249 1.883 17635 4279 1 8 . 1 1 13 13 GLN H H 13 8.747 8.747 8.023 0.724 17635 4280 1 8 . 1 1 14 14 GLY N N 14 109.212 109.212 112.395 -3.183 17635 4281 1 8 . 1 1 14 14 GLY C C 14 175.436 175.436 173.562 1.874 17635 4282 1 8 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.139 0.291 17635 4283 1 8 . 1 1 14 14 GLY H H 14 8.236 8.236 8.335 -0.099 17635 4284 1 8 . 1 1 15 15 LEU N N 15 117.824 117.824 121.678 -3.854 17635 4285 1 8 . 1 1 15 15 LEU HA H 15 3.706 3.706 3.900 -0.194 17635 4286 1 8 . 1 1 15 15 LEU C C 15 174.111 174.111 176.461 -2.350 17635 4287 1 8 . 1 1 15 15 LEU CA C 15 55.718 55.718 56.900 -1.182 17635 4288 1 8 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.864 0.569 17635 4289 1 8 . 1 1 15 15 LEU H H 15 8.442 8.442 8.234 0.208 17635 4290 1 8 . 1 1 16 16 GLY N N 16 105.063 105.063 104.347 0.716 17635 4291 1 8 . 1 1 16 16 GLY C C 16 177.771 177.771 173.295 4.476 17635 4292 1 8 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.940 -0.846 17635 4293 1 8 . 1 1 16 16 GLY H H 16 8.006 8.006 7.706 0.300 17635 4294 1 8 . 1 1 17 17 GLU N N 17 113.781 113.781 119.998 -6.217 17635 4295 1 8 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.493 -0.374 17635 4296 1 8 . 1 1 17 17 GLU C C 17 173.937 173.937 175.614 -1.677 17635 4297 1 8 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.266 1.015 17635 4298 1 8 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.913 0.523 17635 4299 1 8 . 1 1 17 17 GLU H H 17 8.134 8.134 8.399 -0.265 17635 4300 1 8 . 1 1 18 18 ASN N N 18 116.660 116.660 116.262 0.398 17635 4301 1 8 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.738 0.203 17635 4302 1 8 . 1 1 18 18 ASN C C 18 175.900 175.900 174.722 1.178 17635 4303 1 8 . 1 1 18 18 ASN CA C 18 52.478 52.478 53.047 -0.569 17635 4304 1 8 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.854 -1.369 17635 4305 1 8 . 1 1 18 18 ASN H H 18 8.407 8.407 7.983 0.424 17635 4306 1 8 . 1 1 19 19 VAL N N 19 118.323 118.323 123.647 -5.324 17635 4307 1 8 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.748 0.404 17635 4308 1 8 . 1 1 19 19 VAL C C 19 177.655 177.655 174.766 2.889 17635 4309 1 8 . 1 1 19 19 VAL CA C 19 61.877 61.877 64.160 -2.283 17635 4310 1 8 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.582 1.931 17635 4311 1 8 . 1 1 19 19 VAL H H 19 6.855 6.855 7.918 -1.063 17635 4312 1 8 . 1 1 20 20 THR N N 20 111.636 111.636 117.699 -6.063 17635 4313 1 8 . 1 1 20 20 THR HA H 20 4.719 4.719 4.644 0.075 17635 4314 1 8 . 1 1 20 20 THR C C 20 175.266 175.266 174.713 0.553 17635 4315 1 8 . 1 1 20 20 THR CA C 20 58.698 58.698 59.891 -1.193 17635 4316 1 8 . 1 1 20 20 THR CB C 20 72.948 72.948 72.287 0.661 17635 4317 1 8 . 1 1 20 20 THR H H 20 7.328 7.328 7.564 -0.236 17635 4318 1 8 . 1 1 21 21 ILE N N 21 122.147 122.147 123.532 -1.385 17635 4319 1 8 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.656 -0.138 17635 4320 1 8 . 1 1 21 21 ILE C C 21 173.198 173.198 177.397 -4.199 17635 4321 1 8 . 1 1 21 21 ILE CA C 21 65.772 65.772 66.067 -0.295 17635 4322 1 8 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.552 0.031 17635 4323 1 8 . 1 1 21 21 ILE H H 21 9.074 9.074 8.756 0.318 17635 4324 1 8 . 1 1 22 22 GLU N N 22 118.154 118.154 120.077 -1.923 17635 4325 1 8 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.005 -0.019 17635 4326 1 8 . 1 1 22 22 GLU C C 22 171.799 171.799 178.693 -6.894 17635 4327 1 8 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.624 0.989 17635 4328 1 8 . 1 1 22 22 GLU CB C 22 28.791 28.791 27.968 0.823 17635 4329 1 8 . 1 1 22 22 GLU H H 22 8.814 8.814 8.501 0.313 17635 4330 1 8 . 1 1 23 23 SER N N 23 115.921 115.921 115.169 0.752 17635 4331 1 8 . 1 1 23 23 SER HA H 23 4.384 4.384 4.279 0.105 17635 4332 1 8 . 1 1 23 23 SER C C 23 172.447 172.447 176.676 -4.229 17635 4333 1 8 . 1 1 23 23 SER CA C 23 61.239 61.239 61.883 -0.644 17635 4334 1 8 . 1 1 23 23 SER CB C 23 62.838 62.838 62.796 0.042 17635 4335 1 8 . 1 1 23 23 SER H H 23 8.236 8.236 8.031 0.205 17635 4336 1 8 . 1 1 24 24 VAL N N 24 124.867 124.867 121.919 2.948 17635 4337 1 8 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.157 -0.409 17635 4338 1 8 . 1 1 24 24 VAL C C 24 173.016 173.016 177.672 -4.656 17635 4339 1 8 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.479 0.775 17635 4340 1 8 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.911 -0.378 17635 4341 1 8 . 1 1 24 24 VAL H H 24 7.973 7.973 8.504 -0.531 17635 4342 1 8 . 1 1 25 25 ALA N N 25 123.198 123.198 121.461 1.737 17635 4343 1 8 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.044 -0.145 17635 4344 1 8 . 1 1 25 25 ALA C C 25 171.061 171.061 178.534 -7.473 17635 4345 1 8 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.799 0.896 17635 4346 1 8 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.290 -0.552 17635 4347 1 8 . 1 1 25 25 ALA H H 25 8.695 8.695 8.423 0.272 17635 4348 1 8 . 1 1 26 26 ASP N N 26 115.503 115.503 117.976 -2.473 17635 4349 1 8 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.526 -0.203 17635 4350 1 8 . 1 1 26 26 ASP C C 26 173.108 173.108 178.269 -5.161 17635 4351 1 8 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.745 0.578 17635 4352 1 8 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.432 -0.380 17635 4353 1 8 . 1 1 26 26 ASP H H 26 8.312 8.312 8.042 0.270 17635 4354 1 8 . 1 1 27 27 TYR N N 27 119.224 119.224 118.882 0.342 17635 4355 1 8 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.651 -0.451 17635 4356 1 8 . 1 1 27 27 TYR C C 27 172.908 172.908 176.253 -3.345 17635 4357 1 8 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.719 2.297 17635 4358 1 8 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.487 0.445 17635 4359 1 8 . 1 1 27 27 TYR H H 27 7.533 7.533 7.863 -0.330 17635 4360 1 8 . 1 1 28 28 PHE N N 28 112.595 112.595 120.144 -7.549 17635 4361 1 8 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.109 0.221 17635 4362 1 8 . 1 1 28 28 PHE C C 28 173.082 173.082 174.717 -1.635 17635 4363 1 8 . 1 1 28 28 PHE CA C 28 61.784 61.784 56.278 5.506 17635 4364 1 8 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.531 1.472 17635 4365 1 8 . 1 1 28 28 PHE H H 28 7.974 7.974 8.143 -0.169 17635 4366 1 8 . 1 1 29 29 LYS N N 29 118.820 118.820 117.762 1.058 17635 4367 1 8 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.791 0.126 17635 4368 1 8 . 1 1 29 29 LYS C C 29 173.682 173.682 176.480 -2.798 17635 4369 1 8 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.272 3.008 17635 4370 1 8 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.357 -1.066 17635 4371 1 8 . 1 1 29 29 LYS H H 29 8.325 8.325 7.807 0.518 17635 4372 1 8 . 1 1 30 30 GLN N N 30 116.232 116.232 119.391 -3.159 17635 4373 1 8 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.364 -0.229 17635 4374 1 8 . 1 1 30 30 GLN C C 30 173.790 173.790 177.086 -3.296 17635 4375 1 8 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.520 0.026 17635 4376 1 8 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.011 0.887 17635 4377 1 8 . 1 1 30 30 GLN H H 30 7.518 7.518 8.167 -0.649 17635 4378 1 8 . 1 1 31 31 ILE N N 31 116.489 116.489 118.678 -2.189 17635 4379 1 8 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.083 0.156 17635 4380 1 8 . 1 1 31 31 ILE C C 31 175.599 175.599 175.160 0.439 17635 4381 1 8 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.871 -3.650 17635 4382 1 8 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.593 1.740 17635 4383 1 8 . 1 1 31 31 ILE H H 31 7.809 7.809 8.548 -0.739 17635 4384 1 8 . 1 1 32 32 GLY N N 32 107.416 107.416 103.601 3.815 17635 4385 1 8 . 1 1 32 32 GLY C C 32 180.182 180.182 172.586 7.596 17635 4386 1 8 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.788 0.206 17635 4387 1 8 . 1 1 32 32 GLY H H 32 7.344 7.344 7.762 -0.418 17635 4388 1 8 . 1 1 33 33 ILE N N 33 117.784 117.784 121.323 -3.539 17635 4389 1 8 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.467 -0.378 17635 4390 1 8 . 1 1 33 33 ILE C C 33 173.301 173.301 175.149 -1.848 17635 4391 1 8 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.850 0.791 17635 4392 1 8 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.444 -0.785 17635 4393 1 8 . 1 1 33 33 ILE H H 33 8.173 8.173 8.430 -0.257 17635 4394 1 8 . 1 1 34 34 ILE N N 34 131.781 131.781 127.114 4.667 17635 4395 1 8 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.045 -0.258 17635 4396 1 8 . 1 1 34 34 ILE C C 34 174.663 174.663 176.046 -1.383 17635 4397 1 8 . 1 1 34 34 ILE CA C 34 61.370 61.370 59.749 1.621 17635 4398 1 8 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.729 -0.734 17635 4399 1 8 . 1 1 34 34 ILE H H 34 8.687 8.687 8.497 0.190 17635 4400 1 8 . 1 1 35 35 LYS N N 35 130.372 130.372 129.097 1.275 17635 4401 1 8 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.330 -0.246 17635 4402 1 8 . 1 1 35 35 LYS C C 35 175.376 175.376 177.103 -1.727 17635 4403 1 8 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.129 0.344 17635 4404 1 8 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.306 2.358 17635 4405 1 8 . 1 1 35 35 LYS H H 35 8.680 8.680 8.597 0.083 17635 4406 1 8 . 1 1 36 36 THR N N 36 118.312 118.312 120.374 -2.062 17635 4407 1 8 . 1 1 36 36 THR HA H 36 4.415 4.415 4.149 0.266 17635 4408 1 8 . 1 1 36 36 THR C C 36 176.394 176.394 174.009 2.385 17635 4409 1 8 . 1 1 36 36 THR CA C 36 61.340 61.340 63.823 -2.483 17635 4410 1 8 . 1 1 36 36 THR CB C 36 70.809 70.809 69.455 1.354 17635 4411 1 8 . 1 1 36 36 THR H H 36 8.456 8.456 8.079 0.377 17635 4412 1 8 . 1 1 37 37 ASN N N 37 124.092 124.092 117.936 6.156 17635 4413 1 8 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.592 -0.062 17635 4414 1 8 . 1 1 37 37 ASN C C 37 174.235 174.235 175.521 -1.286 17635 4415 1 8 . 1 1 37 37 ASN CA C 37 53.064 53.064 54.092 -1.028 17635 4416 1 8 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.703 -0.776 17635 4417 1 8 . 1 1 37 37 ASN H H 37 8.794 8.794 8.334 0.460 17635 4418 1 8 . 1 1 38 38 LYS N N 38 127.969 127.969 115.600 12.369 17635 4419 1 8 . 1 1 38 38 LYS HA H 38 4.004 4.004 3.951 0.053 17635 4420 1 8 . 1 1 38 38 LYS C C 38 172.702 172.702 176.476 -3.774 17635 4421 1 8 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.503 -0.045 17635 4422 1 8 . 1 1 38 38 LYS CB C 38 32.167 32.167 30.599 1.569 17635 4423 1 8 . 1 1 38 38 LYS H H 38 8.962 8.962 8.653 0.309 17635 4424 1 8 . 1 1 39 39 LYS N N 39 117.413 117.413 118.833 -1.420 17635 4425 1 8 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.272 -0.014 17635 4426 1 8 . 1 1 39 39 LYS C C 39 172.261 172.261 177.685 -5.424 17635 4427 1 8 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.184 0.135 17635 4428 1 8 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.635 0.162 17635 4429 1 8 . 1 1 39 39 LYS H H 39 8.314 8.314 8.272 0.042 17635 4430 1 8 . 1 1 40 40 THR N N 40 105.547 105.547 108.230 -2.683 17635 4431 1 8 . 1 1 40 40 THR HA H 40 4.465 4.465 4.482 -0.017 17635 4432 1 8 . 1 1 40 40 THR C C 40 174.021 174.021 175.574 -1.553 17635 4433 1 8 . 1 1 40 40 THR CA C 40 61.260 61.260 62.114 -0.854 17635 4434 1 8 . 1 1 40 40 THR CB C 40 70.997 70.997 69.257 1.740 17635 4435 1 8 . 1 1 40 40 THR H H 40 7.422 7.422 7.602 -0.180 17635 4436 1 8 . 1 1 41 41 GLY N N 41 111.631 111.631 109.905 1.726 17635 4437 1 8 . 1 1 41 41 GLY C C 41 176.727 176.727 173.535 3.192 17635 4438 1 8 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.267 0.463 17635 4439 1 8 . 1 1 41 41 GLY H H 41 8.644 8.644 8.561 0.083 17635 4440 1 8 . 1 1 42 42 GLN N N 42 118.894 118.894 118.210 0.684 17635 4441 1 8 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.821 -0.152 17635 4442 1 8 . 1 1 42 42 GLN C C 42 177.178 177.178 173.248 3.930 17635 4443 1 8 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.206 1.375 17635 4444 1 8 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.307 -0.077 17635 4445 1 8 . 1 1 42 42 GLN H H 42 7.662 7.662 7.594 0.068 17635 4446 1 8 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.198 0.397 17635 4447 1 8 . 1 1 43 43 PRO C C 43 172.629 172.629 176.312 -3.683 17635 4448 1 8 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.630 -0.808 17635 4449 1 8 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.234 0.462 17635 4450 1 8 . 1 1 44 44 MET N N 44 124.162 124.162 120.393 3.769 17635 4451 1 8 . 1 1 44 44 MET HA H 44 4.432 4.432 4.637 -0.205 17635 4452 1 8 . 1 1 44 44 MET C C 44 176.474 176.474 174.392 2.082 17635 4453 1 8 . 1 1 44 44 MET CA C 44 55.419 55.419 54.978 0.441 17635 4454 1 8 . 1 1 44 44 MET CB C 44 30.555 30.555 35.788 -5.233 17635 4455 1 8 . 1 1 44 44 MET H H 44 8.874 8.874 8.514 0.360 17635 4456 1 8 . 1 1 45 45 ILE N N 45 126.237 126.237 121.943 4.294 17635 4457 1 8 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.545 0.257 17635 4458 1 8 . 1 1 45 45 ILE C C 45 176.415 176.415 174.352 2.063 17635 4459 1 8 . 1 1 45 45 ILE CA C 45 59.216 59.216 59.896 -0.680 17635 4460 1 8 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.273 -0.047 17635 4461 1 8 . 1 1 45 45 ILE H H 45 7.730 7.730 8.301 -0.571 17635 4462 1 8 . 1 1 46 46 ASN N N 46 124.735 124.735 124.457 0.278 17635 4463 1 8 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.002 -0.061 17635 4464 1 8 . 1 1 46 46 ASN C C 46 176.836 176.836 173.606 3.230 17635 4465 1 8 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.208 -0.647 17635 4466 1 8 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.611 -0.141 17635 4467 1 8 . 1 1 46 46 ASN H H 46 8.384 8.384 8.729 -0.345 17635 4468 1 8 . 1 1 47 47 LEU N N 47 122.487 122.487 118.624 3.863 17635 4469 1 8 . 1 1 47 47 LEU HA H 47 4.715 4.715 5.085 -0.370 17635 4470 1 8 . 1 1 47 47 LEU C C 47 174.190 174.190 175.750 -1.560 17635 4471 1 8 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.842 -0.510 17635 4472 1 8 . 1 1 47 47 LEU CB C 47 42.277 42.277 45.671 -3.394 17635 4473 1 8 . 1 1 47 47 LEU H H 47 8.594 8.594 8.132 0.462 17635 4474 1 8 . 1 1 48 48 TYR N N 48 121.842 121.842 122.230 -0.388 17635 4475 1 8 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.898 -0.131 17635 4476 1 8 . 1 1 48 48 TYR C C 48 173.649 173.649 175.388 -1.739 17635 4477 1 8 . 1 1 48 48 TYR CA C 48 57.894 57.894 55.430 2.464 17635 4478 1 8 . 1 1 48 48 TYR CB C 48 39.199 39.199 38.118 1.081 17635 4479 1 8 . 1 1 48 48 TYR H H 48 7.666 7.666 9.037 -1.371 17635 4480 1 8 . 1 1 49 49 THR N N 49 116.554 116.554 115.419 1.135 17635 4481 1 8 . 1 1 49 49 THR HA H 49 4.806 4.806 4.447 0.359 17635 4482 1 8 . 1 1 49 49 THR C C 49 176.654 176.654 174.257 2.397 17635 4483 1 8 . 1 1 49 49 THR CA C 49 60.693 60.693 60.256 0.437 17635 4484 1 8 . 1 1 49 49 THR CB C 49 71.437 71.437 70.761 0.676 17635 4485 1 8 . 1 1 49 49 THR H H 49 8.965 8.965 8.386 0.579 17635 4486 1 8 . 1 1 50 50 ASP N N 50 123.826 123.826 123.384 0.442 17635 4487 1 8 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.458 0.166 17635 4488 1 8 . 1 1 50 50 ASP C C 50 173.380 173.380 176.311 -2.931 17635 4489 1 8 . 1 1 50 50 ASP CA C 50 54.088 54.088 55.056 -0.968 17635 4490 1 8 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.147 0.720 17635 4491 1 8 . 1 1 50 50 ASP H H 50 8.939 8.939 8.597 0.342 17635 4492 1 8 . 1 1 51 51 ARG N N 51 127.794 127.794 126.164 1.630 17635 4493 1 8 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.321 -0.276 17635 4494 1 8 . 1 1 51 51 ARG C C 51 173.101 173.101 176.628 -3.527 17635 4495 1 8 . 1 1 51 51 ARG CA C 51 58.562 58.562 57.050 1.512 17635 4496 1 8 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.683 0.484 17635 4497 1 8 . 1 1 51 51 ARG H H 51 8.958 8.958 8.679 0.279 17635 4498 1 8 . 1 1 52 52 GLU N N 52 117.542 117.542 119.776 -2.234 17635 4499 1 8 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.340 -0.062 17635 4500 1 8 . 1 1 52 52 GLU C C 52 172.201 172.201 177.773 -5.572 17635 4501 1 8 . 1 1 52 52 GLU CA C 52 58.524 58.524 58.368 0.156 17635 4502 1 8 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.807 -0.529 17635 4503 1 8 . 1 1 52 52 GLU H H 52 8.561 8.561 8.372 0.189 17635 4504 1 8 . 1 1 53 53 THR N N 53 107.065 107.065 107.611 -0.546 17635 4505 1 8 . 1 1 53 53 THR HA H 53 4.436 4.436 4.589 -0.153 17635 4506 1 8 . 1 1 53 53 THR C C 53 173.851 173.851 175.844 -1.993 17635 4507 1 8 . 1 1 53 53 THR CA C 53 61.944 61.944 61.874 0.070 17635 4508 1 8 . 1 1 53 53 THR CB C 53 71.197 71.197 71.653 -0.456 17635 4509 1 8 . 1 1 53 53 THR H H 53 8.087 8.087 8.565 -0.478 17635 4510 1 8 . 1 1 54 54 GLY N N 54 111.295 111.295 111.089 0.206 17635 4511 1 8 . 1 1 54 54 GLY C C 54 176.747 176.747 175.155 1.592 17635 4512 1 8 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.077 0.626 17635 4513 1 8 . 1 1 54 54 GLY H H 54 8.423 8.423 8.048 0.375 17635 4514 1 8 . 1 1 55 55 LYS N N 55 119.673 119.673 121.001 -1.328 17635 4515 1 8 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.366 -0.013 17635 4516 1 8 . 1 1 55 55 LYS C C 55 173.854 173.854 176.628 -2.774 17635 4517 1 8 . 1 1 55 55 LYS CA C 55 55.842 55.842 56.533 -0.691 17635 4518 1 8 . 1 1 55 55 LYS CB C 55 33.821 33.821 33.092 0.729 17635 4519 1 8 . 1 1 55 55 LYS H H 55 7.767 7.767 7.583 0.184 17635 4520 1 8 . 1 1 56 56 LEU N N 56 122.426 122.426 119.056 3.370 17635 4521 1 8 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.372 -0.016 17635 4522 1 8 . 1 1 56 56 LEU C C 56 172.534 172.534 177.326 -4.792 17635 4523 1 8 . 1 1 56 56 LEU CA C 56 56.255 56.255 55.026 1.229 17635 4524 1 8 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.741 -1.087 17635 4525 1 8 . 1 1 56 56 LEU H H 56 8.768 8.768 7.997 0.771 17635 4526 1 8 . 1 1 57 57 LYS N N 57 118.264 118.264 118.087 0.177 17635 4527 1 8 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.536 -0.248 17635 4528 1 8 . 1 1 57 57 LYS C C 57 173.648 173.648 176.818 -3.170 17635 4529 1 8 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.310 -0.046 17635 4530 1 8 . 1 1 57 57 LYS CB C 57 34.062 34.062 34.549 -0.487 17635 4531 1 8 . 1 1 57 57 LYS H H 57 8.012 8.012 8.593 -0.581 17635 4532 1 8 . 1 1 58 58 GLY N N 58 108.514 108.514 106.735 1.779 17635 4533 1 8 . 1 1 58 58 GLY C C 58 177.876 177.876 172.740 5.136 17635 4534 1 8 . 1 1 58 58 GLY CA C 58 46.364 46.364 44.759 1.605 17635 4535 1 8 . 1 1 58 58 GLY H H 58 8.334 8.334 8.150 0.184 17635 4536 1 8 . 1 1 59 59 GLU N N 59 116.119 116.119 120.724 -4.605 17635 4537 1 8 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.099 0.422 17635 4538 1 8 . 1 1 59 59 GLU C C 59 173.860 173.860 173.951 -0.091 17635 4539 1 8 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.243 -2.218 17635 4540 1 8 . 1 1 59 59 GLU CB C 59 34.304 34.304 32.745 1.559 17635 4541 1 8 . 1 1 59 59 GLU H H 59 7.202 7.202 7.742 -0.540 17635 4542 1 8 . 1 1 60 60 ALA N N 60 123.607 123.607 126.303 -2.696 17635 4543 1 8 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.925 0.682 17635 4544 1 8 . 1 1 60 60 ALA C C 60 173.923 173.923 174.908 -0.985 17635 4545 1 8 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.412 -0.469 17635 4546 1 8 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.081 0.978 17635 4547 1 8 . 1 1 60 60 ALA H H 60 8.930 8.930 9.154 -0.224 17635 4548 1 8 . 1 1 61 61 THR N N 61 108.384 108.384 114.245 -5.861 17635 4549 1 8 . 1 1 61 61 THR HA H 61 5.743 5.743 4.614 1.129 17635 4550 1 8 . 1 1 61 61 THR C C 61 176.172 176.172 173.958 2.214 17635 4551 1 8 . 1 1 61 61 THR CA C 61 59.625 59.625 60.208 -0.583 17635 4552 1 8 . 1 1 61 61 THR CB C 61 71.224 71.224 69.963 1.261 17635 4553 1 8 . 1 1 61 61 THR H H 61 8.452 8.452 8.585 -0.134 17635 4554 1 8 . 1 1 62 62 VAL N N 62 120.200 120.200 126.835 -6.635 17635 4555 1 8 . 1 1 62 62 VAL HA H 62 4.244 4.244 3.983 0.261 17635 4556 1 8 . 1 1 62 62 VAL C C 62 175.994 175.994 175.233 0.761 17635 4557 1 8 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.526 -0.100 17635 4558 1 8 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.475 2.210 17635 4559 1 8 . 1 1 62 62 VAL H H 62 8.071 8.071 7.941 0.130 17635 4560 1 8 . 1 1 63 63 SER N N 63 121.689 121.689 123.666 -1.977 17635 4561 1 8 . 1 1 63 63 SER HA H 63 5.261 5.261 4.542 0.719 17635 4562 1 8 . 1 1 63 63 SER C C 63 177.943 177.943 172.936 5.007 17635 4563 1 8 . 1 1 63 63 SER CA C 63 57.662 57.662 58.670 -1.008 17635 4564 1 8 . 1 1 63 63 SER CB C 63 64.427 64.427 64.400 0.027 17635 4565 1 8 . 1 1 63 63 SER H H 63 7.695 7.695 8.068 -0.373 17635 4566 1 8 . 1 1 64 64 PHE N N 64 122.640 122.640 120.532 2.108 17635 4567 1 8 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.970 -0.116 17635 4568 1 8 . 1 1 64 64 PHE C C 64 174.605 174.605 175.283 -0.678 17635 4569 1 8 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.843 0.361 17635 4570 1 8 . 1 1 64 64 PHE CB C 64 41.976 41.976 43.734 -1.758 17635 4571 1 8 . 1 1 64 64 PHE H H 64 9.025 9.025 8.764 0.261 17635 4572 1 8 . 1 1 65 65 ASP N N 65 119.943 119.943 122.508 -2.565 17635 4573 1 8 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.613 -0.178 17635 4574 1 8 . 1 1 65 65 ASP C C 65 174.396 174.396 175.743 -1.347 17635 4575 1 8 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.657 1.785 17635 4576 1 8 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.021 0.013 17635 4577 1 8 . 1 1 65 65 ASP H H 65 8.512 8.512 9.030 -0.518 17635 4578 1 8 . 1 1 66 66 ASP N N 66 116.125 116.125 117.689 -1.564 17635 4579 1 8 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.075 0.324 17635 4580 1 8 . 1 1 66 66 ASP C C 66 175.936 175.936 174.464 1.472 17635 4581 1 8 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.943 -1.150 17635 4582 1 8 . 1 1 66 66 ASP CB C 66 42.919 42.919 43.339 -0.420 17635 4583 1 8 . 1 1 66 66 ASP H H 66 8.323 8.323 7.802 0.521 17635 4584 1 8 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.329 0.121 17635 4585 1 8 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.294 0.630 17635 4586 1 8 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.458 -0.628 17635 4587 1 8 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.240 0.179 17635 4588 1 8 . 1 1 68 68 PRO C C 68 171.345 171.345 179.102 -7.757 17635 4589 1 8 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.228 0.007 17635 4590 1 8 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.117 -0.120 17635 4591 1 8 . 1 1 69 69 SER N N 69 114.544 114.544 114.097 0.447 17635 4592 1 8 . 1 1 69 69 SER HA H 69 4.036 4.036 4.006 0.030 17635 4593 1 8 . 1 1 69 69 SER C C 69 176.535 176.535 175.957 0.578 17635 4594 1 8 . 1 1 69 69 SER CA C 69 61.837 61.837 61.153 0.684 17635 4595 1 8 . 1 1 69 69 SER CB C 69 62.773 62.773 62.726 0.047 17635 4596 1 8 . 1 1 69 69 SER H H 69 8.004 8.004 7.859 0.145 17635 4597 1 8 . 1 1 70 70 ALA N N 70 122.649 122.649 123.680 -1.031 17635 4598 1 8 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.547 0.046 17635 4599 1 8 . 1 1 70 70 ALA C C 70 172.686 172.686 179.171 -6.485 17635 4600 1 8 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.070 -0.034 17635 4601 1 8 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.447 -0.583 17635 4602 1 8 . 1 1 70 70 ALA H H 70 7.383 7.383 7.421 -0.038 17635 4603 1 8 . 1 1 71 71 LYS N N 71 116.308 116.308 119.940 -3.632 17635 4604 1 8 . 1 1 71 71 LYS HA H 71 3.775 3.775 4.033 -0.258 17635 4605 1 8 . 1 1 71 71 LYS C C 71 172.333 172.333 178.637 -6.304 17635 4606 1 8 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.667 0.335 17635 4607 1 8 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.931 0.511 17635 4608 1 8 . 1 1 71 71 LYS H H 71 7.159 7.159 7.606 -0.447 17635 4609 1 8 . 1 1 72 72 ALA N N 72 119.806 119.806 120.736 -0.930 17635 4610 1 8 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.093 0.073 17635 4611 1 8 . 1 1 72 72 ALA C C 72 170.530 170.530 179.699 -9.169 17635 4612 1 8 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.785 -0.070 17635 4613 1 8 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.895 -0.075 17635 4614 1 8 . 1 1 72 72 ALA H H 72 7.924 7.924 8.173 -0.249 17635 4615 1 8 . 1 1 73 73 ALA N N 73 120.524 120.524 121.582 -1.058 17635 4616 1 8 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.213 0.066 17635 4617 1 8 . 1 1 73 73 ALA C C 73 171.039 171.039 179.645 -8.606 17635 4618 1 8 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.938 0.442 17635 4619 1 8 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.716 0.415 17635 4620 1 8 . 1 1 73 73 ALA H H 73 8.104 8.104 7.490 0.614 17635 4621 1 8 . 1 1 74 74 ILE N N 74 119.875 119.875 118.441 1.434 17635 4622 1 8 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.709 -0.295 17635 4623 1 8 . 1 1 74 74 ILE C C 74 172.435 172.435 177.609 -5.174 17635 4624 1 8 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.134 0.710 17635 4625 1 8 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.607 1.136 17635 4626 1 8 . 1 1 74 74 ILE H H 74 7.574 7.574 7.960 -0.386 17635 4627 1 8 . 1 1 75 75 ASP N N 75 117.867 117.867 118.473 -0.606 17635 4628 1 8 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.451 -0.140 17635 4629 1 8 . 1 1 75 75 ASP C C 75 172.054 172.054 176.741 -4.687 17635 4630 1 8 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.650 0.511 17635 4631 1 8 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.310 -0.779 17635 4632 1 8 . 1 1 75 75 ASP H H 75 7.937 7.937 7.837 0.100 17635 4633 1 8 . 1 1 76 76 TRP N N 76 117.313 117.313 120.094 -2.781 17635 4634 1 8 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.510 -0.154 17635 4635 1 8 . 1 1 76 76 TRP C C 76 173.272 173.272 176.305 -3.033 17635 4636 1 8 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.358 1.104 17635 4637 1 8 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.637 1.140 17635 4638 1 8 . 1 1 76 76 TRP H H 76 8.475 8.475 7.809 0.666 17635 4639 1 8 . 1 1 77 77 PHE N N 77 112.019 112.019 117.010 -4.991 17635 4640 1 8 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.112 0.536 17635 4641 1 8 . 1 1 77 77 PHE C C 77 173.747 173.747 176.671 -2.924 17635 4642 1 8 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.016 -0.095 17635 4643 1 8 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.183 2.547 17635 4644 1 8 . 1 1 77 77 PHE H H 77 8.488 8.488 7.266 1.222 17635 4645 1 8 . 1 1 78 78 ASP N N 78 118.408 118.408 121.562 -3.154 17635 4646 1 8 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.570 -0.106 17635 4647 1 8 . 1 1 78 78 ASP C C 78 172.542 172.542 176.535 -3.993 17635 4648 1 8 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.339 3.351 17635 4649 1 8 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.026 1.860 17635 4650 1 8 . 1 1 78 78 ASP H H 78 7.978 7.978 8.534 -0.556 17635 4651 1 8 . 1 1 79 79 GLY N N 79 115.548 115.548 104.655 10.893 17635 4652 1 8 . 1 1 79 79 GLY C C 79 175.680 175.680 173.182 2.498 17635 4653 1 8 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.218 0.854 17635 4654 1 8 . 1 1 79 79 GLY H H 79 8.615 8.615 8.496 0.119 17635 4655 1 8 . 1 1 80 80 LYS N N 80 120.271 120.271 117.920 2.351 17635 4656 1 8 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.518 -0.056 17635 4657 1 8 . 1 1 80 80 LYS C C 80 175.853 175.853 174.871 0.982 17635 4658 1 8 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.758 0.392 17635 4659 1 8 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.213 -1.787 17635 4660 1 8 . 1 1 80 80 LYS H H 80 8.013 8.013 8.077 -0.064 17635 4661 1 8 . 1 1 81 81 GLU N N 81 115.765 115.765 118.054 -2.289 17635 4662 1 8 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.134 -0.436 17635 4663 1 8 . 1 1 81 81 GLU C C 81 173.263 173.263 175.694 -2.431 17635 4664 1 8 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.321 0.603 17635 4665 1 8 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.720 0.322 17635 4666 1 8 . 1 1 81 81 GLU H H 81 8.201 8.201 8.496 -0.295 17635 4667 1 8 . 1 1 82 82 PHE N N 82 127.080 127.080 125.297 1.783 17635 4668 1 8 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.529 -0.033 17635 4669 1 8 . 1 1 82 82 PHE C C 82 175.349 175.349 175.461 -0.112 17635 4670 1 8 . 1 1 82 82 PHE CA C 82 56.716 56.716 57.668 -0.952 17635 4671 1 8 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.676 2.318 17635 4672 1 8 . 1 1 82 82 PHE H H 82 9.162 9.162 9.167 -0.005 17635 4673 1 8 . 1 1 83 83 SER N N 83 125.136 125.136 119.506 5.630 17635 4674 1 8 . 1 1 83 83 SER HA H 83 3.803 3.803 4.094 -0.291 17635 4675 1 8 . 1 1 83 83 SER C C 83 175.543 175.543 174.429 1.114 17635 4676 1 8 . 1 1 83 83 SER CA C 83 58.371 58.371 59.209 -0.838 17635 4677 1 8 . 1 1 83 83 SER CB C 83 62.519 62.519 62.201 0.318 17635 4678 1 8 . 1 1 83 83 SER H H 83 9.193 9.193 9.019 0.174 17635 4679 1 8 . 1 1 84 84 GLY N N 84 103.581 103.581 104.471 -0.890 17635 4680 1 8 . 1 1 84 84 GLY C C 84 177.188 177.188 174.051 3.137 17635 4681 1 8 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.893 0.159 17635 4682 1 8 . 1 1 84 84 GLY H H 84 8.446 8.446 8.077 0.369 17635 4683 1 8 . 1 1 85 85 ASN N N 85 119.051 119.051 121.761 -2.710 17635 4684 1 8 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.178 0.156 17635 4685 1 8 . 1 1 85 85 ASN C C 85 178.020 178.020 172.839 5.181 17635 4686 1 8 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.427 -0.956 17635 4687 1 8 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.413 2.704 17635 4688 1 8 . 1 1 85 85 ASN H H 85 7.762 7.762 8.306 -0.544 17635 4689 1 8 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.459 -0.792 17635 4690 1 8 . 1 1 86 86 PRO C C 86 173.474 173.474 176.223 -2.749 17635 4691 1 8 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.155 0.555 17635 4692 1 8 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.207 -1.337 17635 4693 1 8 . 1 1 87 87 ILE N N 87 117.270 117.270 115.583 1.687 17635 4694 1 8 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.234 -0.088 17635 4695 1 8 . 1 1 87 87 ILE C C 87 174.495 174.495 174.500 -0.005 17635 4696 1 8 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.664 0.827 17635 4697 1 8 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.969 -1.298 17635 4698 1 8 . 1 1 87 87 ILE H H 87 8.469 8.469 8.953 -0.484 17635 4699 1 8 . 1 1 88 88 LYS N N 88 122.271 122.271 120.280 1.991 17635 4700 1 8 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.683 0.509 17635 4701 1 8 . 1 1 88 88 LYS C C 88 174.393 174.393 174.945 -0.552 17635 4702 1 8 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.714 -0.576 17635 4703 1 8 . 1 1 88 88 LYS CB C 88 35.049 35.049 33.903 1.146 17635 4704 1 8 . 1 1 88 88 LYS H H 88 8.353 8.353 8.273 0.080 17635 4705 1 8 . 1 1 89 89 VAL N N 89 125.661 125.661 125.136 0.525 17635 4706 1 8 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.862 0.101 17635 4707 1 8 . 1 1 89 89 VAL C C 89 177.160 177.160 176.417 0.743 17635 4708 1 8 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.853 -0.492 17635 4709 1 8 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.719 2.051 17635 4710 1 8 . 1 1 89 89 VAL H H 89 9.414 9.414 8.508 0.906 17635 4711 1 8 . 1 1 90 90 SER N N 90 119.538 119.538 121.480 -1.942 17635 4712 1 8 . 1 1 90 90 SER HA H 90 4.710 4.710 4.648 0.062 17635 4713 1 8 . 1 1 90 90 SER C C 90 176.533 176.533 174.396 2.137 17635 4714 1 8 . 1 1 90 90 SER CA C 90 56.936 56.936 56.906 0.030 17635 4715 1 8 . 1 1 90 90 SER CB C 90 66.470 66.470 65.454 1.016 17635 4716 1 8 . 1 1 90 90 SER H H 90 8.945 8.945 8.246 0.699 17635 4717 1 8 . 1 1 91 91 PHE N N 91 120.115 120.115 121.222 -1.107 17635 4718 1 8 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.685 -0.012 17635 4719 1 8 . 1 1 91 91 PHE C C 91 173.349 173.349 175.832 -2.483 17635 4720 1 8 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.052 5.103 17635 4721 1 8 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.855 1.648 17635 4722 1 8 . 1 1 91 91 PHE H H 91 8.919 8.919 8.623 0.296 17635 4723 1 8 . 1 1 92 92 ALA N N 92 124.386 124.386 122.101 2.285 17635 4724 1 8 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.228 0.128 17635 4725 1 8 . 1 1 92 92 ALA C C 92 172.984 172.984 176.855 -3.871 17635 4726 1 8 . 1 1 92 92 ALA CA C 92 52.098 52.098 53.407 -1.309 17635 4727 1 8 . 1 1 92 92 ALA CB C 92 19.406 19.406 17.070 2.336 17635 4728 1 8 . 1 1 92 92 ALA H H 92 8.563 8.563 7.783 0.780 17635 4729 1 8 . 1 1 93 93 THR N N 93 116.073 116.073 112.269 3.804 17635 4730 1 8 . 1 1 93 93 THR HA H 93 4.208 4.208 4.451 -0.243 17635 4731 1 8 . 1 1 93 93 THR C C 93 176.032 176.032 173.320 2.712 17635 4732 1 8 . 1 1 93 93 THR CA C 93 62.255 62.255 61.531 0.724 17635 4733 1 8 . 1 1 93 93 THR CB C 93 69.708 69.708 71.483 -1.775 17635 4734 1 8 . 1 1 93 93 THR H H 93 8.312 8.312 7.943 0.369 17635 4735 1 8 . 1 1 94 94 ARG N N 94 124.359 124.359 120.129 4.230 17635 4736 1 8 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.113 0.224 17635 4737 1 8 . 1 1 94 94 ARG C C 94 174.426 174.426 175.413 -0.987 17635 4738 1 8 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.844 -0.789 17635 4739 1 8 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.168 0.743 17635 4740 1 8 . 1 1 94 94 ARG H H 94 8.493 8.493 8.568 -0.075 17635 4741 1 8 . 1 1 95 95 ARG N N 95 122.515 122.515 124.460 -1.945 17635 4742 1 8 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.493 -0.265 17635 4743 1 8 . 1 1 95 95 ARG C C 95 174.306 174.306 175.654 -1.348 17635 4744 1 8 . 1 1 95 95 ARG CA C 95 56.142 56.142 55.521 0.621 17635 4745 1 8 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.852 1.114 17635 4746 1 8 . 1 1 95 95 ARG H H 95 8.343 8.343 8.445 -0.102 17635 4747 1 8 . 1 1 96 96 ALA N N 96 125.127 125.127 124.194 0.933 17635 4748 1 8 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.205 0.004 17635 4749 1 8 . 1 1 96 96 ALA C C 96 173.226 173.226 177.262 -4.036 17635 4750 1 8 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.078 0.692 17635 4751 1 8 . 1 1 96 96 ALA CB C 96 19.193 19.193 18.354 0.839 17635 4752 1 8 . 1 1 96 96 ALA H H 96 8.402 8.402 8.084 0.318 17635 4753 1 8 . 1 1 97 97 ASP N N 97 118.483 118.483 119.880 -1.397 17635 4754 1 8 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.122 0.376 17635 4755 1 8 . 1 1 97 97 ASP C C 97 174.302 174.302 175.821 -1.519 17635 4756 1 8 . 1 1 97 97 ASP CA C 97 54.091 54.091 53.760 0.332 17635 4757 1 8 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.986 -0.079 17635 4758 1 8 . 1 1 97 97 ASP H H 97 8.206 8.206 8.375 -0.169 17635 4759 1 8 . 1 1 98 98 PHE N N 98 120.321 120.321 114.288 6.033 17635 4760 1 8 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.898 -0.408 17635 4761 1 8 . 1 1 98 98 PHE C C 98 174.878 174.878 174.041 0.837 17635 4762 1 8 . 1 1 98 98 PHE CA C 98 58.160 58.160 56.885 1.275 17635 4763 1 8 . 1 1 98 98 PHE CB C 98 39.303 39.303 39.886 -0.583 17635 4764 1 8 . 1 1 98 98 PHE H H 98 7.990 7.990 8.197 -0.207 17635 4765 1 8 . 1 1 99 99 ASN N N 99 120.016 120.016 117.658 2.358 17635 4766 1 8 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.870 -0.261 17635 4767 1 8 . 1 1 99 99 ASN C C 99 175.348 175.348 173.779 1.569 17635 4768 1 8 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.079 0.234 17635 4769 1 8 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.361 -0.634 17635 4770 1 8 . 1 1 99 99 ASN H H 99 8.336 8.336 8.625 -0.289 17635 4771 1 8 . 1 1 100 100 ARG N N 100 121.374 121.374 120.476 0.898 17635 4772 1 8 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.652 -0.379 17635 4773 1 8 . 1 1 100 100 ARG C C 100 173.627 173.627 176.677 -3.050 17635 4774 1 8 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.704 0.788 17635 4775 1 8 . 1 1 100 100 ARG CB C 100 30.519 30.519 31.103 -0.584 17635 4776 1 8 . 1 1 100 100 ARG H H 100 8.181 8.181 8.113 0.068 17635 4777 1 8 . 1 1 101 101 GLY N N 101 109.586 109.586 108.260 1.326 17635 4778 1 8 . 1 1 101 101 GLY C C 101 175.739 175.739 174.022 1.717 17635 4779 1 8 . 1 1 101 101 GLY CA C 101 45.380 45.380 43.977 1.403 17635 4780 1 8 . 1 1 101 101 GLY H H 101 8.413 8.413 8.566 -0.153 17635 4781 1 8 . 1 1 102 102 GLY N N 102 108.692 108.692 106.625 2.067 17635 4782 1 8 . 1 1 102 102 GLY C C 102 176.286 176.286 174.363 1.923 17635 4783 1 8 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.370 0.968 17635 4784 1 8 . 1 1 102 102 GLY H H 102 8.281 8.281 8.072 0.209 17635 4785 1 8 . 1 1 103 103 GLY N N 103 108.844 108.844 107.810 1.034 17635 4786 1 8 . 1 1 103 103 GLY C C 103 175.798 175.798 173.850 1.948 17635 4787 1 8 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.836 0.510 17635 4788 1 8 . 1 1 103 103 GLY H H 103 8.364 8.364 8.448 -0.084 17635 4789 1 8 . 1 1 104 104 ASN N N 104 118.527 118.527 122.420 -3.893 17635 4790 1 8 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.670 0.048 17635 4791 1 8 . 1 1 104 104 ASN C C 104 174.547 174.547 176.297 -1.750 17635 4792 1 8 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.323 -0.114 17635 4793 1 8 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.204 -0.325 17635 4794 1 8 . 1 1 104 104 ASN H H 104 8.438 8.438 8.459 -0.021 17635 4795 1 8 . 1 1 105 105 GLY N N 105 109.166 109.166 112.744 -3.578 17635 4796 1 8 . 1 1 105 105 GLY C C 105 176.074 176.074 174.479 1.595 17635 4797 1 8 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.309 0.293 17635 4798 1 8 . 1 1 105 105 GLY H H 105 8.477 8.477 8.417 0.060 17635 4799 1 8 . 1 1 106 106 ARG N N 106 120.341 120.341 120.528 -0.187 17635 4800 1 8 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.173 0.178 17635 4801 1 8 . 1 1 106 106 ARG C C 106 173.491 173.491 177.088 -3.597 17635 4802 1 8 . 1 1 106 106 ARG CA C 106 56.227 56.227 56.489 -0.262 17635 4803 1 8 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.828 -0.200 17635 4804 1 8 . 1 1 106 106 ARG H H 106 8.244 8.244 8.159 0.085 17635 4805 1 8 . 1 1 107 107 GLY N N 107 109.856 109.856 108.987 0.869 17635 4806 1 8 . 1 1 107 107 GLY C C 107 175.834 175.834 173.671 2.163 17635 4807 1 8 . 1 1 107 107 GLY CA C 107 45.441 45.441 45.343 0.098 17635 4808 1 8 . 1 1 107 107 GLY H H 107 8.522 8.522 9.019 -0.497 17635 4809 1 9 . 1 1 2 2 GLN N N 2 121.692 121.692 122.219 -0.527 17635 4810 1 9 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.300 -0.034 17635 4811 1 9 . 1 1 2 2 GLN C C 2 175.248 175.248 175.087 0.161 17635 4812 1 9 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.794 0.202 17635 4813 1 9 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.057 0.582 17635 4814 1 9 . 1 1 2 2 GLN H H 2 8.621 8.621 8.265 0.356 17635 4815 1 9 . 1 1 3 3 ASP N N 3 121.801 121.801 121.249 0.552 17635 4816 1 9 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.539 0.029 17635 4817 1 9 . 1 1 3 3 ASP C C 3 174.336 174.336 175.442 -1.106 17635 4818 1 9 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.101 -0.039 17635 4819 1 9 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.007 0.064 17635 4820 1 9 . 1 1 3 3 ASP H H 3 8.436 8.436 8.570 -0.134 17635 4821 1 9 . 1 1 4 4 ASN N N 4 120.292 120.292 119.965 0.327 17635 4822 1 9 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.781 -0.144 17635 4823 1 9 . 1 1 4 4 ASN C C 4 174.415 174.415 174.528 -0.113 17635 4824 1 9 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.413 1.448 17635 4825 1 9 . 1 1 4 4 ASN CB C 4 38.534 38.534 39.572 -1.038 17635 4826 1 9 . 1 1 4 4 ASN H H 4 8.528 8.528 8.239 0.289 17635 4827 1 9 . 1 1 5 5 SER N N 5 117.091 117.091 114.552 2.539 17635 4828 1 9 . 1 1 5 5 SER HA H 5 4.163 4.163 4.505 -0.342 17635 4829 1 9 . 1 1 5 5 SER C C 5 176.370 176.370 174.897 1.473 17635 4830 1 9 . 1 1 5 5 SER CA C 5 60.846 60.846 60.472 0.374 17635 4831 1 9 . 1 1 5 5 SER CB C 5 63.136 63.136 63.431 -0.295 17635 4832 1 9 . 1 1 5 5 SER H H 5 8.470 8.470 8.667 -0.197 17635 4833 1 9 . 1 1 6 6 ASP N N 6 119.436 119.436 117.588 1.848 17635 4834 1 9 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.579 0.116 17635 4835 1 9 . 1 1 6 6 ASP C C 6 175.048 175.048 176.337 -1.289 17635 4836 1 9 . 1 1 6 6 ASP CA C 6 53.094 53.094 54.516 -1.422 17635 4837 1 9 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.750 0.185 17635 4838 1 9 . 1 1 6 6 ASP H H 6 8.218 8.218 8.030 0.188 17635 4839 1 9 . 1 1 7 7 ASN N N 7 119.696 119.696 118.913 0.783 17635 4840 1 9 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.414 0.214 17635 4841 1 9 . 1 1 7 7 ASN C C 7 176.539 176.539 175.088 1.451 17635 4842 1 9 . 1 1 7 7 ASN CA C 7 53.158 53.158 54.257 -1.099 17635 4843 1 9 . 1 1 7 7 ASN CB C 7 38.859 38.859 37.718 1.141 17635 4844 1 9 . 1 1 7 7 ASN H H 7 7.734 7.734 8.811 -1.077 17635 4845 1 9 . 1 1 8 8 ASN N N 8 119.436 119.436 118.194 1.242 17635 4846 1 9 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.543 0.325 17635 4847 1 9 . 1 1 8 8 ASN C C 8 175.327 175.327 175.255 0.072 17635 4848 1 9 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.702 -1.498 17635 4849 1 9 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.216 -0.721 17635 4850 1 9 . 1 1 8 8 ASN H H 8 8.350 8.350 8.461 -0.111 17635 4851 1 9 . 1 1 9 9 THR N N 9 118.650 118.650 114.886 3.764 17635 4852 1 9 . 1 1 9 9 THR HA H 9 5.557 5.557 4.498 1.059 17635 4853 1 9 . 1 1 9 9 THR C C 9 177.117 177.117 174.106 3.011 17635 4854 1 9 . 1 1 9 9 THR CA C 9 62.314 62.314 62.876 -0.562 17635 4855 1 9 . 1 1 9 9 THR CB C 9 71.225 71.225 69.615 1.610 17635 4856 1 9 . 1 1 9 9 THR H H 9 8.428 8.428 7.582 0.846 17635 4857 1 9 . 1 1 10 10 ILE N N 10 118.556 118.556 119.623 -1.067 17635 4858 1 9 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.077 0.088 17635 4859 1 9 . 1 1 10 10 ILE C C 10 176.837 176.837 174.266 2.571 17635 4860 1 9 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.471 0.827 17635 4861 1 9 . 1 1 10 10 ILE CB C 10 39.880 39.880 42.135 -2.255 17635 4862 1 9 . 1 1 10 10 ILE H H 10 8.770 8.770 8.424 0.346 17635 4863 1 9 . 1 1 11 11 PHE N N 11 123.798 123.798 118.993 4.805 17635 4864 1 9 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.170 0.250 17635 4865 1 9 . 1 1 11 11 PHE C C 11 177.066 177.066 173.810 3.256 17635 4866 1 9 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.748 -0.387 17635 4867 1 9 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.447 0.421 17635 4868 1 9 . 1 1 11 11 PHE H H 11 9.548 9.548 7.854 1.694 17635 4869 1 9 . 1 1 12 12 VAL N N 12 127.993 127.993 125.199 2.794 17635 4870 1 9 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.596 0.362 17635 4871 1 9 . 1 1 12 12 VAL C C 12 176.965 176.965 175.283 1.682 17635 4872 1 9 . 1 1 12 12 VAL CA C 12 59.835 59.835 60.167 -0.332 17635 4873 1 9 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.192 2.608 17635 4874 1 9 . 1 1 12 12 VAL H H 12 8.940 8.940 9.339 -0.399 17635 4875 1 9 . 1 1 13 13 GLN N N 13 122.289 122.289 126.277 -3.988 17635 4876 1 9 . 1 1 13 13 GLN HA H 13 4.779 4.779 5.223 -0.444 17635 4877 1 9 . 1 1 13 13 GLN C C 13 175.631 175.631 175.865 -0.234 17635 4878 1 9 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.605 -0.494 17635 4879 1 9 . 1 1 13 13 GLN CB C 13 34.132 34.132 32.434 1.698 17635 4880 1 9 . 1 1 13 13 GLN H H 13 8.747 8.747 8.569 0.178 17635 4881 1 9 . 1 1 14 14 GLY N N 14 109.212 109.212 114.284 -5.072 17635 4882 1 9 . 1 1 14 14 GLY C C 14 175.436 175.436 172.792 2.644 17635 4883 1 9 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.540 -0.110 17635 4884 1 9 . 1 1 14 14 GLY H H 14 8.236 8.236 8.967 -0.731 17635 4885 1 9 . 1 1 15 15 LEU N N 15 117.824 117.824 118.836 -1.012 17635 4886 1 9 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.665 -0.959 17635 4887 1 9 . 1 1 15 15 LEU C C 15 174.111 174.111 176.443 -2.332 17635 4888 1 9 . 1 1 15 15 LEU CA C 15 55.718 55.718 54.371 1.347 17635 4889 1 9 . 1 1 15 15 LEU CB C 15 42.433 42.433 42.319 0.114 17635 4890 1 9 . 1 1 15 15 LEU H H 15 8.442 8.442 7.560 0.882 17635 4891 1 9 . 1 1 16 16 GLY N N 16 105.063 105.063 107.738 -2.675 17635 4892 1 9 . 1 1 16 16 GLY C C 16 177.771 177.771 173.845 3.926 17635 4893 1 9 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.568 -0.474 17635 4894 1 9 . 1 1 16 16 GLY H H 16 8.006 8.006 7.739 0.267 17635 4895 1 9 . 1 1 17 17 GLU N N 17 113.781 113.781 119.156 -5.375 17635 4896 1 9 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.840 0.279 17635 4897 1 9 . 1 1 17 17 GLU C C 17 173.937 173.937 175.323 -1.386 17635 4898 1 9 . 1 1 17 17 GLU CA C 17 57.281 57.281 57.198 0.083 17635 4899 1 9 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.048 1.388 17635 4900 1 9 . 1 1 17 17 GLU H H 17 8.134 8.134 8.556 -0.422 17635 4901 1 9 . 1 1 18 18 ASN N N 18 116.660 116.660 113.445 3.215 17635 4902 1 9 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.570 0.371 17635 4903 1 9 . 1 1 18 18 ASN C C 18 175.900 175.900 174.092 1.808 17635 4904 1 9 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.764 -0.286 17635 4905 1 9 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.511 -1.026 17635 4906 1 9 . 1 1 18 18 ASN H H 18 8.407 8.407 7.890 0.517 17635 4907 1 9 . 1 1 19 19 VAL N N 19 118.323 118.323 122.231 -3.908 17635 4908 1 9 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.911 0.241 17635 4909 1 9 . 1 1 19 19 VAL C C 19 177.655 177.655 174.961 2.694 17635 4910 1 9 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.044 -1.167 17635 4911 1 9 . 1 1 19 19 VAL CB C 19 32.513 32.513 31.313 1.200 17635 4912 1 9 . 1 1 19 19 VAL H H 19 6.855 6.855 7.719 -0.864 17635 4913 1 9 . 1 1 20 20 THR N N 20 111.636 111.636 118.961 -7.325 17635 4914 1 9 . 1 1 20 20 THR HA H 20 4.719 4.719 4.652 0.067 17635 4915 1 9 . 1 1 20 20 THR C C 20 175.266 175.266 174.761 0.505 17635 4916 1 9 . 1 1 20 20 THR CA C 20 58.698 58.698 59.408 -0.710 17635 4917 1 9 . 1 1 20 20 THR CB C 20 72.948 72.948 72.120 0.828 17635 4918 1 9 . 1 1 20 20 THR H H 20 7.328 7.328 7.602 -0.274 17635 4919 1 9 . 1 1 21 21 ILE N N 21 122.147 122.147 123.202 -1.055 17635 4920 1 9 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.714 -0.196 17635 4921 1 9 . 1 1 21 21 ILE C C 21 173.198 173.198 177.716 -4.518 17635 4922 1 9 . 1 1 21 21 ILE CA C 21 65.772 65.772 63.885 1.887 17635 4923 1 9 . 1 1 21 21 ILE CB C 21 37.583 37.583 36.985 0.598 17635 4924 1 9 . 1 1 21 21 ILE H H 21 9.074 9.074 8.694 0.380 17635 4925 1 9 . 1 1 22 22 GLU N N 22 118.154 118.154 118.945 -0.791 17635 4926 1 9 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.055 -0.069 17635 4927 1 9 . 1 1 22 22 GLU C C 22 171.799 171.799 178.280 -6.481 17635 4928 1 9 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.693 0.920 17635 4929 1 9 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.501 0.290 17635 4930 1 9 . 1 1 22 22 GLU H H 22 8.814 8.814 8.472 0.342 17635 4931 1 9 . 1 1 23 23 SER N N 23 115.921 115.921 115.580 0.341 17635 4932 1 9 . 1 1 23 23 SER HA H 23 4.384 4.384 4.356 0.028 17635 4933 1 9 . 1 1 23 23 SER C C 23 172.447 172.447 176.902 -4.455 17635 4934 1 9 . 1 1 23 23 SER CA C 23 61.239 61.239 61.537 -0.298 17635 4935 1 9 . 1 1 23 23 SER CB C 23 62.838 62.838 62.704 0.134 17635 4936 1 9 . 1 1 23 23 SER H H 23 8.236 8.236 8.334 -0.098 17635 4937 1 9 . 1 1 24 24 VAL N N 24 124.867 124.867 122.935 1.932 17635 4938 1 9 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.164 -0.416 17635 4939 1 9 . 1 1 24 24 VAL C C 24 173.016 173.016 177.662 -4.646 17635 4940 1 9 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.262 0.992 17635 4941 1 9 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.588 -0.055 17635 4942 1 9 . 1 1 24 24 VAL H H 24 7.973 7.973 8.266 -0.293 17635 4943 1 9 . 1 1 25 25 ALA N N 25 123.198 123.198 120.953 2.245 17635 4944 1 9 . 1 1 25 25 ALA HA H 25 3.899 3.899 3.944 -0.045 17635 4945 1 9 . 1 1 25 25 ALA C C 25 171.061 171.061 178.491 -7.430 17635 4946 1 9 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.864 0.831 17635 4947 1 9 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.299 -0.561 17635 4948 1 9 . 1 1 25 25 ALA H H 25 8.695 8.695 8.465 0.230 17635 4949 1 9 . 1 1 26 26 ASP N N 26 115.503 115.503 117.954 -2.451 17635 4950 1 9 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.522 -0.199 17635 4951 1 9 . 1 1 26 26 ASP C C 26 173.108 173.108 178.000 -4.892 17635 4952 1 9 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.422 0.901 17635 4953 1 9 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.308 -0.256 17635 4954 1 9 . 1 1 26 26 ASP H H 26 8.312 8.312 8.067 0.245 17635 4955 1 9 . 1 1 27 27 TYR N N 27 119.224 119.224 118.187 1.037 17635 4956 1 9 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.566 -0.366 17635 4957 1 9 . 1 1 27 27 TYR C C 27 172.908 172.908 176.269 -3.361 17635 4958 1 9 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.944 2.072 17635 4959 1 9 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.207 0.725 17635 4960 1 9 . 1 1 27 27 TYR H H 27 7.533 7.533 7.656 -0.123 17635 4961 1 9 . 1 1 28 28 PHE N N 28 112.595 112.595 118.824 -6.229 17635 4962 1 9 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.094 0.236 17635 4963 1 9 . 1 1 28 28 PHE C C 28 173.082 173.082 174.937 -1.855 17635 4964 1 9 . 1 1 28 28 PHE CA C 28 61.784 61.784 57.455 4.329 17635 4965 1 9 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.974 1.029 17635 4966 1 9 . 1 1 28 28 PHE H H 28 7.974 7.974 8.087 -0.113 17635 4967 1 9 . 1 1 29 29 LYS N N 29 118.820 118.820 117.832 0.988 17635 4968 1 9 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.739 0.178 17635 4969 1 9 . 1 1 29 29 LYS C C 29 173.682 173.682 176.609 -2.927 17635 4970 1 9 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.161 2.119 17635 4971 1 9 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.651 -0.360 17635 4972 1 9 . 1 1 29 29 LYS H H 29 8.325 8.325 7.685 0.640 17635 4973 1 9 . 1 1 30 30 GLN N N 30 116.232 116.232 117.426 -1.194 17635 4974 1 9 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.164 -0.029 17635 4975 1 9 . 1 1 30 30 GLN C C 30 173.790 173.790 176.702 -2.912 17635 4976 1 9 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.301 0.245 17635 4977 1 9 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.759 1.139 17635 4978 1 9 . 1 1 30 30 GLN H H 30 7.518 7.518 8.078 -0.560 17635 4979 1 9 . 1 1 31 31 ILE N N 31 116.489 116.489 119.073 -2.584 17635 4980 1 9 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.860 0.379 17635 4981 1 9 . 1 1 31 31 ILE C C 31 175.599 175.599 175.875 -0.276 17635 4982 1 9 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.395 -3.174 17635 4983 1 9 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.490 1.844 17635 4984 1 9 . 1 1 31 31 ILE H H 31 7.809 7.809 7.680 0.129 17635 4985 1 9 . 1 1 32 32 GLY N N 32 107.416 107.416 104.036 3.380 17635 4986 1 9 . 1 1 32 32 GLY C C 32 180.182 180.182 172.233 7.949 17635 4987 1 9 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.413 0.581 17635 4988 1 9 . 1 1 32 32 GLY H H 32 7.344 7.344 7.294 0.050 17635 4989 1 9 . 1 1 33 33 ILE N N 33 117.784 117.784 120.922 -3.138 17635 4990 1 9 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.258 -0.169 17635 4991 1 9 . 1 1 33 33 ILE C C 33 173.301 173.301 176.187 -2.886 17635 4992 1 9 . 1 1 33 33 ILE CA C 33 61.641 61.641 61.862 -0.222 17635 4993 1 9 . 1 1 33 33 ILE CB C 33 38.659 38.659 38.350 0.309 17635 4994 1 9 . 1 1 33 33 ILE H H 33 8.173 8.173 8.449 -0.276 17635 4995 1 9 . 1 1 34 34 ILE N N 34 131.781 131.781 126.479 5.302 17635 4996 1 9 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.258 -0.471 17635 4997 1 9 . 1 1 34 34 ILE C C 34 174.663 174.663 175.935 -1.272 17635 4998 1 9 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.307 1.063 17635 4999 1 9 . 1 1 34 34 ILE CB C 34 37.995 37.995 39.085 -1.090 17635 5000 1 9 . 1 1 34 34 ILE H H 34 8.687 8.687 8.250 0.437 17635 5001 1 9 . 1 1 35 35 LYS N N 35 130.372 130.372 128.438 1.934 17635 5002 1 9 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.010 0.074 17635 5003 1 9 . 1 1 35 35 LYS C C 35 175.376 175.376 176.004 -0.628 17635 5004 1 9 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.940 0.533 17635 5005 1 9 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.526 2.138 17635 5006 1 9 . 1 1 35 35 LYS H H 35 8.680 8.680 8.836 -0.156 17635 5007 1 9 . 1 1 36 36 THR N N 36 118.312 118.312 122.377 -4.065 17635 5008 1 9 . 1 1 36 36 THR HA H 36 4.415 4.415 4.260 0.155 17635 5009 1 9 . 1 1 36 36 THR C C 36 176.394 176.394 173.929 2.465 17635 5010 1 9 . 1 1 36 36 THR CA C 36 61.340 61.340 63.444 -2.104 17635 5011 1 9 . 1 1 36 36 THR CB C 36 70.809 70.809 69.802 1.007 17635 5012 1 9 . 1 1 36 36 THR H H 36 8.456 8.456 8.034 0.422 17635 5013 1 9 . 1 1 37 37 ASN N N 37 124.092 124.092 122.300 1.792 17635 5014 1 9 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.659 -0.129 17635 5015 1 9 . 1 1 37 37 ASN C C 37 174.235 174.235 175.887 -1.652 17635 5016 1 9 . 1 1 37 37 ASN CA C 37 53.064 53.064 53.295 -0.231 17635 5017 1 9 . 1 1 37 37 ASN CB C 37 38.927 38.927 40.350 -1.423 17635 5018 1 9 . 1 1 37 37 ASN H H 37 8.794 8.794 8.781 0.013 17635 5019 1 9 . 1 1 38 38 LYS N N 38 127.969 127.969 121.777 6.192 17635 5020 1 9 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.406 -0.402 17635 5021 1 9 . 1 1 38 38 LYS C C 38 172.702 172.702 176.607 -3.905 17635 5022 1 9 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.426 0.032 17635 5023 1 9 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.823 -0.656 17635 5024 1 9 . 1 1 38 38 LYS H H 38 8.962 8.962 8.615 0.347 17635 5025 1 9 . 1 1 39 39 LYS N N 39 117.413 117.413 118.015 -0.602 17635 5026 1 9 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.321 -0.063 17635 5027 1 9 . 1 1 39 39 LYS C C 39 172.261 172.261 177.585 -5.324 17635 5028 1 9 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.997 0.322 17635 5029 1 9 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.411 0.386 17635 5030 1 9 . 1 1 39 39 LYS H H 39 8.314 8.314 8.269 0.045 17635 5031 1 9 . 1 1 40 40 THR N N 40 105.547 105.547 108.619 -3.072 17635 5032 1 9 . 1 1 40 40 THR HA H 40 4.465 4.465 4.535 -0.070 17635 5033 1 9 . 1 1 40 40 THR C C 40 174.021 174.021 175.542 -1.521 17635 5034 1 9 . 1 1 40 40 THR CA C 40 61.260 61.260 61.783 -0.524 17635 5035 1 9 . 1 1 40 40 THR CB C 40 70.997 70.997 69.514 1.483 17635 5036 1 9 . 1 1 40 40 THR H H 40 7.422 7.422 7.605 -0.183 17635 5037 1 9 . 1 1 41 41 GLY N N 41 111.631 111.631 111.689 -0.058 17635 5038 1 9 . 1 1 41 41 GLY C C 41 176.727 176.727 173.438 3.289 17635 5039 1 9 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.453 0.278 17635 5040 1 9 . 1 1 41 41 GLY H H 41 8.644 8.644 8.507 0.137 17635 5041 1 9 . 1 1 42 42 GLN N N 42 118.894 118.894 118.197 0.697 17635 5042 1 9 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.808 -0.139 17635 5043 1 9 . 1 1 42 42 GLN C C 42 177.178 177.178 173.556 3.622 17635 5044 1 9 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.218 1.363 17635 5045 1 9 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.235 -0.005 17635 5046 1 9 . 1 1 42 42 GLN H H 42 7.662 7.662 7.614 0.048 17635 5047 1 9 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.197 0.398 17635 5048 1 9 . 1 1 43 43 PRO C C 43 172.629 172.629 176.143 -3.514 17635 5049 1 9 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.734 -0.912 17635 5050 1 9 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.136 0.560 17635 5051 1 9 . 1 1 44 44 MET N N 44 124.162 124.162 120.453 3.709 17635 5052 1 9 . 1 1 44 44 MET HA H 44 4.432 4.432 4.603 -0.171 17635 5053 1 9 . 1 1 44 44 MET C C 44 176.474 176.474 174.369 2.105 17635 5054 1 9 . 1 1 44 44 MET CA C 44 55.419 55.419 54.794 0.625 17635 5055 1 9 . 1 1 44 44 MET CB C 44 30.555 30.555 35.510 -4.955 17635 5056 1 9 . 1 1 44 44 MET H H 44 8.874 8.874 8.455 0.419 17635 5057 1 9 . 1 1 45 45 ILE N N 45 126.237 126.237 123.234 3.003 17635 5058 1 9 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.577 0.225 17635 5059 1 9 . 1 1 45 45 ILE C C 45 176.415 176.415 174.297 2.118 17635 5060 1 9 . 1 1 45 45 ILE CA C 45 59.216 59.216 59.857 -0.641 17635 5061 1 9 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.594 -0.368 17635 5062 1 9 . 1 1 45 45 ILE H H 45 7.730 7.730 8.359 -0.629 17635 5063 1 9 . 1 1 46 46 ASN N N 46 124.735 124.735 124.075 0.660 17635 5064 1 9 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.006 -0.065 17635 5065 1 9 . 1 1 46 46 ASN C C 46 176.836 176.836 173.569 3.267 17635 5066 1 9 . 1 1 46 46 ASN CA C 46 51.561 51.561 51.305 0.256 17635 5067 1 9 . 1 1 46 46 ASN CB C 46 40.470 40.470 39.670 0.800 17635 5068 1 9 . 1 1 46 46 ASN H H 46 8.384 8.384 8.784 -0.400 17635 5069 1 9 . 1 1 47 47 LEU N N 47 122.487 122.487 116.560 5.927 17635 5070 1 9 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.811 -0.096 17635 5071 1 9 . 1 1 47 47 LEU C C 47 174.190 174.190 175.017 -0.827 17635 5072 1 9 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.104 -0.772 17635 5073 1 9 . 1 1 47 47 LEU CB C 47 42.277 42.277 45.006 -2.729 17635 5074 1 9 . 1 1 47 47 LEU H H 47 8.594 8.594 7.823 0.771 17635 5075 1 9 . 1 1 48 48 TYR N N 48 121.842 121.842 119.297 2.545 17635 5076 1 9 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.957 -0.190 17635 5077 1 9 . 1 1 48 48 TYR C C 48 173.649 173.649 175.100 -1.451 17635 5078 1 9 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.463 1.431 17635 5079 1 9 . 1 1 48 48 TYR CB C 48 39.199 39.199 41.796 -2.597 17635 5080 1 9 . 1 1 48 48 TYR H H 48 7.666 7.666 8.399 -0.733 17635 5081 1 9 . 1 1 49 49 THR N N 49 116.554 116.554 115.178 1.376 17635 5082 1 9 . 1 1 49 49 THR HA H 49 4.806 4.806 4.522 0.284 17635 5083 1 9 . 1 1 49 49 THR C C 49 176.654 176.654 172.838 3.816 17635 5084 1 9 . 1 1 49 49 THR CA C 49 60.693 60.693 60.351 0.342 17635 5085 1 9 . 1 1 49 49 THR CB C 49 71.437 71.437 70.862 0.575 17635 5086 1 9 . 1 1 49 49 THR H H 49 8.965 8.965 8.363 0.602 17635 5087 1 9 . 1 1 50 50 ASP N N 50 123.826 123.826 122.986 0.840 17635 5088 1 9 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.678 -0.054 17635 5089 1 9 . 1 1 50 50 ASP C C 50 173.380 173.380 177.043 -3.663 17635 5090 1 9 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.382 -0.294 17635 5091 1 9 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.719 0.148 17635 5092 1 9 . 1 1 50 50 ASP H H 50 8.939 8.939 8.846 0.093 17635 5093 1 9 . 1 1 51 51 ARG N N 51 127.794 127.794 123.585 4.209 17635 5094 1 9 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.390 -0.345 17635 5095 1 9 . 1 1 51 51 ARG C C 51 173.101 173.101 177.049 -3.948 17635 5096 1 9 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.940 1.622 17635 5097 1 9 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.954 0.213 17635 5098 1 9 . 1 1 51 51 ARG H H 51 8.958 8.958 8.499 0.459 17635 5099 1 9 . 1 1 52 52 GLU N N 52 117.542 117.542 121.487 -3.945 17635 5100 1 9 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.166 0.112 17635 5101 1 9 . 1 1 52 52 GLU C C 52 172.201 172.201 177.318 -5.117 17635 5102 1 9 . 1 1 52 52 GLU CA C 52 58.524 58.524 58.787 -0.263 17635 5103 1 9 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.604 0.674 17635 5104 1 9 . 1 1 52 52 GLU H H 52 8.561 8.561 8.206 0.355 17635 5105 1 9 . 1 1 53 53 THR N N 53 107.065 107.065 108.165 -1.100 17635 5106 1 9 . 1 1 53 53 THR HA H 53 4.436 4.436 4.484 -0.048 17635 5107 1 9 . 1 1 53 53 THR C C 53 173.851 173.851 175.284 -1.433 17635 5108 1 9 . 1 1 53 53 THR CA C 53 61.944 61.944 62.319 -0.375 17635 5109 1 9 . 1 1 53 53 THR CB C 53 71.197 71.197 70.009 1.188 17635 5110 1 9 . 1 1 53 53 THR H H 53 8.087 8.087 7.492 0.595 17635 5111 1 9 . 1 1 54 54 GLY N N 54 111.295 111.295 111.123 0.172 17635 5112 1 9 . 1 1 54 54 GLY C C 54 176.747 176.747 173.567 3.180 17635 5113 1 9 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.064 0.639 17635 5114 1 9 . 1 1 54 54 GLY H H 54 8.423 8.423 8.156 0.267 17635 5115 1 9 . 1 1 55 55 LYS N N 55 119.673 119.673 120.054 -0.381 17635 5116 1 9 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.676 -0.323 17635 5117 1 9 . 1 1 55 55 LYS C C 55 173.854 173.854 176.081 -2.227 17635 5118 1 9 . 1 1 55 55 LYS CA C 55 55.842 55.842 54.460 1.382 17635 5119 1 9 . 1 1 55 55 LYS CB C 55 33.821 33.821 34.164 -0.343 17635 5120 1 9 . 1 1 55 55 LYS H H 55 7.767 7.767 7.475 0.292 17635 5121 1 9 . 1 1 56 56 LEU N N 56 122.426 122.426 124.577 -2.151 17635 5122 1 9 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.207 0.149 17635 5123 1 9 . 1 1 56 56 LEU C C 56 172.534 172.534 177.409 -4.875 17635 5124 1 9 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.796 1.459 17635 5125 1 9 . 1 1 56 56 LEU CB C 56 41.654 41.654 41.028 0.626 17635 5126 1 9 . 1 1 56 56 LEU H H 56 8.768 8.768 8.837 -0.069 17635 5127 1 9 . 1 1 57 57 LYS N N 57 118.264 118.264 122.374 -4.110 17635 5128 1 9 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.343 -0.055 17635 5129 1 9 . 1 1 57 57 LYS C C 57 173.648 173.648 176.804 -3.156 17635 5130 1 9 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.057 0.207 17635 5131 1 9 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.306 1.756 17635 5132 1 9 . 1 1 57 57 LYS H H 57 8.012 8.012 8.012 0.000 17635 5133 1 9 . 1 1 58 58 GLY N N 58 108.514 108.514 108.692 -0.178 17635 5134 1 9 . 1 1 58 58 GLY C C 58 177.876 177.876 173.274 4.602 17635 5135 1 9 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.742 0.622 17635 5136 1 9 . 1 1 58 58 GLY H H 58 8.334 8.334 8.302 0.032 17635 5137 1 9 . 1 1 59 59 GLU N N 59 116.119 116.119 119.523 -3.404 17635 5138 1 9 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.560 -0.039 17635 5139 1 9 . 1 1 59 59 GLU C C 59 173.860 173.860 174.121 -0.261 17635 5140 1 9 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.212 -2.187 17635 5141 1 9 . 1 1 59 59 GLU CB C 59 34.304 34.304 34.081 0.223 17635 5142 1 9 . 1 1 59 59 GLU H H 59 7.202 7.202 7.774 -0.572 17635 5143 1 9 . 1 1 60 60 ALA N N 60 123.607 123.607 127.029 -3.422 17635 5144 1 9 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.940 0.667 17635 5145 1 9 . 1 1 60 60 ALA C C 60 173.923 173.923 175.218 -1.295 17635 5146 1 9 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.578 -0.635 17635 5147 1 9 . 1 1 60 60 ALA CB C 60 24.059 24.059 22.979 1.080 17635 5148 1 9 . 1 1 60 60 ALA H H 60 8.930 8.930 9.192 -0.262 17635 5149 1 9 . 1 1 61 61 THR N N 61 108.384 108.384 115.795 -7.411 17635 5150 1 9 . 1 1 61 61 THR HA H 61 5.743 5.743 4.978 0.765 17635 5151 1 9 . 1 1 61 61 THR C C 61 176.172 176.172 173.711 2.461 17635 5152 1 9 . 1 1 61 61 THR CA C 61 59.625 59.625 60.351 -0.726 17635 5153 1 9 . 1 1 61 61 THR CB C 61 71.224 71.224 69.521 1.703 17635 5154 1 9 . 1 1 61 61 THR H H 61 8.452 8.452 8.655 -0.203 17635 5155 1 9 . 1 1 62 62 VAL N N 62 120.200 120.200 127.272 -7.072 17635 5156 1 9 . 1 1 62 62 VAL HA H 62 4.244 4.244 3.871 0.373 17635 5157 1 9 . 1 1 62 62 VAL C C 62 175.994 175.994 174.439 1.555 17635 5158 1 9 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.151 0.275 17635 5159 1 9 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.805 1.880 17635 5160 1 9 . 1 1 62 62 VAL H H 62 8.071 8.071 8.097 -0.026 17635 5161 1 9 . 1 1 63 63 SER N N 63 121.689 121.689 122.900 -1.211 17635 5162 1 9 . 1 1 63 63 SER HA H 63 5.261 5.261 4.448 0.813 17635 5163 1 9 . 1 1 63 63 SER C C 63 177.943 177.943 173.572 4.371 17635 5164 1 9 . 1 1 63 63 SER CA C 63 57.662 57.662 57.740 -0.078 17635 5165 1 9 . 1 1 63 63 SER CB C 63 64.427 64.427 64.741 -0.314 17635 5166 1 9 . 1 1 63 63 SER H H 63 7.695 7.695 7.983 -0.288 17635 5167 1 9 . 1 1 64 64 PHE N N 64 122.640 122.640 121.860 0.780 17635 5168 1 9 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.888 -0.034 17635 5169 1 9 . 1 1 64 64 PHE C C 64 174.605 174.605 176.328 -1.723 17635 5170 1 9 . 1 1 64 64 PHE CA C 64 58.204 58.204 56.730 1.474 17635 5171 1 9 . 1 1 64 64 PHE CB C 64 41.976 41.976 42.204 -0.228 17635 5172 1 9 . 1 1 64 64 PHE H H 64 9.025 9.025 8.208 0.817 17635 5173 1 9 . 1 1 65 65 ASP N N 65 119.943 119.943 124.599 -4.656 17635 5174 1 9 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.639 -0.204 17635 5175 1 9 . 1 1 65 65 ASP C C 65 174.396 174.396 174.756 -0.360 17635 5176 1 9 . 1 1 65 65 ASP CA C 65 57.442 57.442 54.187 3.255 17635 5177 1 9 . 1 1 65 65 ASP CB C 65 42.034 42.034 39.753 2.281 17635 5178 1 9 . 1 1 65 65 ASP H H 65 8.512 8.512 8.573 -0.061 17635 5179 1 9 . 1 1 66 66 ASP N N 66 116.125 116.125 116.646 -0.521 17635 5180 1 9 . 1 1 66 66 ASP HA H 66 5.399 5.399 4.665 0.734 17635 5181 1 9 . 1 1 66 66 ASP C C 66 175.936 175.936 174.159 1.777 17635 5182 1 9 . 1 1 66 66 ASP CA C 66 50.793 50.793 53.023 -2.230 17635 5183 1 9 . 1 1 66 66 ASP CB C 66 42.919 42.919 39.602 3.317 17635 5184 1 9 . 1 1 66 66 ASP H H 66 8.323 8.323 7.996 0.327 17635 5185 1 9 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.339 0.111 17635 5186 1 9 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.302 0.622 17635 5187 1 9 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.541 -0.711 17635 5188 1 9 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.182 0.237 17635 5189 1 9 . 1 1 68 68 PRO C C 68 171.345 171.345 178.852 -7.507 17635 5190 1 9 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.019 0.216 17635 5191 1 9 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.012 -0.015 17635 5192 1 9 . 1 1 69 69 SER N N 69 114.544 114.544 113.956 0.588 17635 5193 1 9 . 1 1 69 69 SER HA H 69 4.036 4.036 3.903 0.133 17635 5194 1 9 . 1 1 69 69 SER C C 69 176.535 176.535 175.922 0.613 17635 5195 1 9 . 1 1 69 69 SER CA C 69 61.837 61.837 61.058 0.779 17635 5196 1 9 . 1 1 69 69 SER CB C 69 62.773 62.773 62.495 0.279 17635 5197 1 9 . 1 1 69 69 SER H H 69 8.004 8.004 7.807 0.197 17635 5198 1 9 . 1 1 70 70 ALA N N 70 122.649 122.649 124.479 -1.830 17635 5199 1 9 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.882 -0.289 17635 5200 1 9 . 1 1 70 70 ALA C C 70 172.686 172.686 179.417 -6.731 17635 5201 1 9 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.315 -0.279 17635 5202 1 9 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.100 -0.236 17635 5203 1 9 . 1 1 70 70 ALA H H 70 7.383 7.383 7.523 -0.140 17635 5204 1 9 . 1 1 71 71 LYS N N 71 116.308 116.308 119.182 -2.874 17635 5205 1 9 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.901 -0.126 17635 5206 1 9 . 1 1 71 71 LYS C C 71 172.333 172.333 178.687 -6.354 17635 5207 1 9 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.175 0.827 17635 5208 1 9 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.011 0.431 17635 5209 1 9 . 1 1 71 71 LYS H H 71 7.159 7.159 7.361 -0.202 17635 5210 1 9 . 1 1 72 72 ALA N N 72 119.806 119.806 120.692 -0.886 17635 5211 1 9 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.059 0.107 17635 5212 1 9 . 1 1 72 72 ALA C C 72 170.530 170.530 179.764 -9.234 17635 5213 1 9 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.889 -0.174 17635 5214 1 9 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.001 -0.181 17635 5215 1 9 . 1 1 72 72 ALA H H 72 7.924 7.924 8.035 -0.111 17635 5216 1 9 . 1 1 73 73 ALA N N 73 120.524 120.524 121.517 -0.993 17635 5217 1 9 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.172 0.107 17635 5218 1 9 . 1 1 73 73 ALA C C 73 171.039 171.039 179.658 -8.619 17635 5219 1 9 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.990 0.389 17635 5220 1 9 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.526 0.605 17635 5221 1 9 . 1 1 73 73 ALA H H 73 8.104 8.104 7.628 0.476 17635 5222 1 9 . 1 1 74 74 ILE N N 74 119.875 119.875 118.241 1.634 17635 5223 1 9 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.844 -0.430 17635 5224 1 9 . 1 1 74 74 ILE C C 74 172.435 172.435 177.799 -5.364 17635 5225 1 9 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.313 0.531 17635 5226 1 9 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.922 0.821 17635 5227 1 9 . 1 1 74 74 ILE H H 74 7.574 7.574 7.996 -0.422 17635 5228 1 9 . 1 1 75 75 ASP N N 75 117.867 117.867 118.030 -0.163 17635 5229 1 9 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.469 -0.158 17635 5230 1 9 . 1 1 75 75 ASP C C 75 172.054 172.054 176.791 -4.737 17635 5231 1 9 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.776 0.385 17635 5232 1 9 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.426 -0.895 17635 5233 1 9 . 1 1 75 75 ASP H H 75 7.937 7.937 8.006 -0.069 17635 5234 1 9 . 1 1 76 76 TRP N N 76 117.313 117.313 120.477 -3.164 17635 5235 1 9 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.293 0.063 17635 5236 1 9 . 1 1 76 76 TRP C C 76 173.272 173.272 177.212 -3.940 17635 5237 1 9 . 1 1 76 76 TRP CA C 76 59.462 59.462 59.381 0.081 17635 5238 1 9 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.633 1.144 17635 5239 1 9 . 1 1 76 76 TRP H H 76 8.475 8.475 7.611 0.864 17635 5240 1 9 . 1 1 77 77 PHE N N 77 112.019 112.019 117.311 -5.292 17635 5241 1 9 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.489 0.159 17635 5242 1 9 . 1 1 77 77 PHE C C 77 173.747 173.747 175.497 -1.750 17635 5243 1 9 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.115 -0.194 17635 5244 1 9 . 1 1 77 77 PHE CB C 77 40.730 40.730 39.055 1.675 17635 5245 1 9 . 1 1 77 77 PHE H H 77 8.488 8.488 7.686 0.802 17635 5246 1 9 . 1 1 78 78 ASP N N 78 118.408 118.408 119.544 -1.136 17635 5247 1 9 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.575 -0.111 17635 5248 1 9 . 1 1 78 78 ASP C C 78 172.542 172.542 176.483 -3.941 17635 5249 1 9 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.139 3.550 17635 5250 1 9 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.462 2.424 17635 5251 1 9 . 1 1 78 78 ASP H H 78 7.978 7.978 8.668 -0.690 17635 5252 1 9 . 1 1 79 79 GLY N N 79 115.548 115.548 103.869 11.679 17635 5253 1 9 . 1 1 79 79 GLY C C 79 175.680 175.680 173.752 1.928 17635 5254 1 9 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.922 1.150 17635 5255 1 9 . 1 1 79 79 GLY H H 79 8.615 8.615 8.555 0.060 17635 5256 1 9 . 1 1 80 80 LYS N N 80 120.271 120.271 119.978 0.293 17635 5257 1 9 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.453 0.009 17635 5258 1 9 . 1 1 80 80 LYS C C 80 175.853 175.853 175.016 0.837 17635 5259 1 9 . 1 1 80 80 LYS CA C 80 55.150 55.150 56.015 -0.865 17635 5260 1 9 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.997 -1.571 17635 5261 1 9 . 1 1 80 80 LYS H H 80 8.013 8.013 8.195 -0.182 17635 5262 1 9 . 1 1 81 81 GLU N N 81 115.765 115.765 118.117 -2.352 17635 5263 1 9 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.037 -0.339 17635 5264 1 9 . 1 1 81 81 GLU C C 81 173.263 173.263 175.805 -2.542 17635 5265 1 9 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.083 0.841 17635 5266 1 9 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.410 0.632 17635 5267 1 9 . 1 1 81 81 GLU H H 81 8.201 8.201 8.479 -0.278 17635 5268 1 9 . 1 1 82 82 PHE N N 82 127.080 127.080 125.161 1.919 17635 5269 1 9 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.441 0.055 17635 5270 1 9 . 1 1 82 82 PHE C C 82 175.349 175.349 175.347 0.002 17635 5271 1 9 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.605 1.111 17635 5272 1 9 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.185 2.809 17635 5273 1 9 . 1 1 82 82 PHE H H 82 9.162 9.162 9.048 0.114 17635 5274 1 9 . 1 1 83 83 SER N N 83 125.136 125.136 119.157 5.979 17635 5275 1 9 . 1 1 83 83 SER HA H 83 3.803 3.803 4.146 -0.343 17635 5276 1 9 . 1 1 83 83 SER C C 83 175.543 175.543 174.189 1.354 17635 5277 1 9 . 1 1 83 83 SER CA C 83 58.371 58.371 59.267 -0.896 17635 5278 1 9 . 1 1 83 83 SER CB C 83 62.519 62.519 62.439 0.080 17635 5279 1 9 . 1 1 83 83 SER H H 83 9.193 9.193 9.094 0.099 17635 5280 1 9 . 1 1 84 84 GLY N N 84 103.581 103.581 105.635 -2.054 17635 5281 1 9 . 1 1 84 84 GLY C C 84 177.188 177.188 174.064 3.124 17635 5282 1 9 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.875 0.177 17635 5283 1 9 . 1 1 84 84 GLY H H 84 8.446 8.446 8.111 0.335 17635 5284 1 9 . 1 1 85 85 ASN N N 85 119.051 119.051 121.667 -2.616 17635 5285 1 9 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.198 0.136 17635 5286 1 9 . 1 1 85 85 ASN C C 85 178.020 178.020 172.811 5.209 17635 5287 1 9 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.370 -0.899 17635 5288 1 9 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.465 2.652 17635 5289 1 9 . 1 1 85 85 ASN H H 85 7.762 7.762 8.155 -0.393 17635 5290 1 9 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.401 -0.734 17635 5291 1 9 . 1 1 86 86 PRO C C 86 173.474 173.474 176.330 -2.856 17635 5292 1 9 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.317 0.393 17635 5293 1 9 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.256 -1.386 17635 5294 1 9 . 1 1 87 87 ILE N N 87 117.270 117.270 117.027 0.243 17635 5295 1 9 . 1 1 87 87 ILE HA H 87 5.146 5.146 4.995 0.151 17635 5296 1 9 . 1 1 87 87 ILE C C 87 174.495 174.495 174.231 0.264 17635 5297 1 9 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.601 0.890 17635 5298 1 9 . 1 1 87 87 ILE CB C 87 41.671 41.671 41.852 -0.181 17635 5299 1 9 . 1 1 87 87 ILE H H 87 8.469 8.469 9.112 -0.643 17635 5300 1 9 . 1 1 88 88 LYS N N 88 122.271 122.271 122.527 -0.256 17635 5301 1 9 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.576 0.616 17635 5302 1 9 . 1 1 88 88 LYS C C 88 174.393 174.393 174.844 -0.451 17635 5303 1 9 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.188 -1.050 17635 5304 1 9 . 1 1 88 88 LYS CB C 88 35.049 35.049 33.907 1.142 17635 5305 1 9 . 1 1 88 88 LYS H H 88 8.353 8.353 8.520 -0.167 17635 5306 1 9 . 1 1 89 89 VAL N N 89 125.661 125.661 126.388 -0.727 17635 5307 1 9 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.809 0.154 17635 5308 1 9 . 1 1 89 89 VAL C C 89 177.160 177.160 175.869 1.291 17635 5309 1 9 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.170 0.190 17635 5310 1 9 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.629 2.141 17635 5311 1 9 . 1 1 89 89 VAL H H 89 9.414 9.414 8.397 1.017 17635 5312 1 9 . 1 1 90 90 SER N N 90 119.538 119.538 120.834 -1.296 17635 5313 1 9 . 1 1 90 90 SER HA H 90 4.710 4.710 4.859 -0.149 17635 5314 1 9 . 1 1 90 90 SER C C 90 176.533 176.533 174.432 2.101 17635 5315 1 9 . 1 1 90 90 SER CA C 90 56.936 56.936 56.893 0.043 17635 5316 1 9 . 1 1 90 90 SER CB C 90 66.470 66.470 65.692 0.778 17635 5317 1 9 . 1 1 90 90 SER H H 90 8.945 8.945 7.702 1.243 17635 5318 1 9 . 1 1 91 91 PHE N N 91 120.115 120.115 123.053 -2.938 17635 5319 1 9 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.572 0.101 17635 5320 1 9 . 1 1 91 91 PHE C C 91 173.349 173.349 175.166 -1.817 17635 5321 1 9 . 1 1 91 91 PHE CA C 91 61.155 61.155 55.587 5.568 17635 5322 1 9 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.681 1.822 17635 5323 1 9 . 1 1 91 91 PHE H H 91 8.919 8.919 8.888 0.031 17635 5324 1 9 . 1 1 92 92 ALA N N 92 124.386 124.386 122.980 1.406 17635 5325 1 9 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.270 0.086 17635 5326 1 9 . 1 1 92 92 ALA C C 92 172.984 172.984 176.847 -3.863 17635 5327 1 9 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.798 -0.700 17635 5328 1 9 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.569 0.837 17635 5329 1 9 . 1 1 92 92 ALA H H 92 8.563 8.563 7.895 0.668 17635 5330 1 9 . 1 1 93 93 THR N N 93 116.073 116.073 113.693 2.380 17635 5331 1 9 . 1 1 93 93 THR HA H 93 4.208 4.208 3.502 0.706 17635 5332 1 9 . 1 1 93 93 THR C C 93 176.032 176.032 173.533 2.499 17635 5333 1 9 . 1 1 93 93 THR CA C 93 62.255 62.255 62.732 -0.477 17635 5334 1 9 . 1 1 93 93 THR CB C 93 69.708 69.708 69.625 0.083 17635 5335 1 9 . 1 1 93 93 THR H H 93 8.312 8.312 8.362 -0.050 17635 5336 1 9 . 1 1 94 94 ARG N N 94 124.359 124.359 127.704 -3.345 17635 5337 1 9 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.348 -0.011 17635 5338 1 9 . 1 1 94 94 ARG C C 94 174.426 174.426 176.265 -1.839 17635 5339 1 9 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.409 -0.354 17635 5340 1 9 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.855 0.056 17635 5341 1 9 . 1 1 94 94 ARG H H 94 8.493 8.493 8.341 0.152 17635 5342 1 9 . 1 1 95 95 ARG N N 95 122.515 122.515 116.804 5.711 17635 5343 1 9 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.031 0.197 17635 5344 1 9 . 1 1 95 95 ARG C C 95 174.306 174.306 174.766 -0.460 17635 5345 1 9 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.969 -0.827 17635 5346 1 9 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.238 1.728 17635 5347 1 9 . 1 1 95 95 ARG H H 95 8.343 8.343 8.352 -0.009 17635 5348 1 9 . 1 1 96 96 ALA N N 96 125.127 125.127 123.365 1.762 17635 5349 1 9 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.545 -0.336 17635 5350 1 9 . 1 1 96 96 ALA C C 96 173.226 173.226 176.729 -3.503 17635 5351 1 9 . 1 1 96 96 ALA CA C 96 52.770 52.770 51.191 1.579 17635 5352 1 9 . 1 1 96 96 ALA CB C 96 19.193 19.193 21.102 -1.909 17635 5353 1 9 . 1 1 96 96 ALA H H 96 8.402 8.402 8.295 0.107 17635 5354 1 9 . 1 1 97 97 ASP N N 97 118.483 118.483 126.658 -8.175 17635 5355 1 9 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.481 0.017 17635 5356 1 9 . 1 1 97 97 ASP C C 97 174.302 174.302 176.276 -1.974 17635 5357 1 9 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.936 -0.845 17635 5358 1 9 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.027 0.880 17635 5359 1 9 . 1 1 97 97 ASP H H 97 8.206 8.206 8.667 -0.461 17635 5360 1 9 . 1 1 98 98 PHE N N 98 120.321 120.321 122.409 -2.088 17635 5361 1 9 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.423 0.067 17635 5362 1 9 . 1 1 98 98 PHE C C 98 174.878 174.878 176.558 -1.680 17635 5363 1 9 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.035 0.125 17635 5364 1 9 . 1 1 98 98 PHE CB C 98 39.303 39.303 39.579 -0.276 17635 5365 1 9 . 1 1 98 98 PHE H H 98 7.990 7.990 8.090 -0.100 17635 5366 1 9 . 1 1 99 99 ASN N N 99 120.016 120.016 117.548 2.468 17635 5367 1 9 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.402 0.207 17635 5368 1 9 . 1 1 99 99 ASN C C 99 175.348 175.348 174.043 1.305 17635 5369 1 9 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.649 -0.336 17635 5370 1 9 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.791 -0.064 17635 5371 1 9 . 1 1 99 99 ASN H H 99 8.336 8.336 8.403 -0.067 17635 5372 1 9 . 1 1 100 100 ARG N N 100 121.374 121.374 120.863 0.511 17635 5373 1 9 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.523 -0.250 17635 5374 1 9 . 1 1 100 100 ARG C C 100 173.627 173.627 176.455 -2.828 17635 5375 1 9 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.687 0.805 17635 5376 1 9 . 1 1 100 100 ARG CB C 100 30.519 30.519 31.521 -1.002 17635 5377 1 9 . 1 1 100 100 ARG H H 100 8.181 8.181 8.471 -0.290 17635 5378 1 9 . 1 1 101 101 GLY N N 101 109.586 109.586 111.069 -1.483 17635 5379 1 9 . 1 1 101 101 GLY C C 101 175.739 175.739 173.870 1.869 17635 5380 1 9 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.550 0.830 17635 5381 1 9 . 1 1 101 101 GLY H H 101 8.413 8.413 8.630 -0.217 17635 5382 1 9 . 1 1 102 102 GLY N N 102 108.692 108.692 107.556 1.136 17635 5383 1 9 . 1 1 102 102 GLY C C 102 176.286 176.286 174.871 1.415 17635 5384 1 9 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.520 0.818 17635 5385 1 9 . 1 1 102 102 GLY H H 102 8.281 8.281 7.724 0.557 17635 5386 1 9 . 1 1 103 103 GLY N N 103 108.844 108.844 109.875 -1.031 17635 5387 1 9 . 1 1 103 103 GLY C C 103 175.798 175.798 174.637 1.161 17635 5388 1 9 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.967 0.379 17635 5389 1 9 . 1 1 103 103 GLY H H 103 8.364 8.364 8.669 -0.305 17635 5390 1 9 . 1 1 104 104 ASN N N 104 118.527 118.527 117.402 1.125 17635 5391 1 9 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.620 0.098 17635 5392 1 9 . 1 1 104 104 ASN C C 104 174.547 174.547 174.839 -0.292 17635 5393 1 9 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.918 0.291 17635 5394 1 9 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.476 0.403 17635 5395 1 9 . 1 1 104 104 ASN H H 104 8.438 8.438 8.219 0.219 17635 5396 1 9 . 1 1 105 105 GLY N N 105 109.166 109.166 109.928 -0.762 17635 5397 1 9 . 1 1 105 105 GLY C C 105 176.074 176.074 174.525 1.549 17635 5398 1 9 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.292 0.310 17635 5399 1 9 . 1 1 105 105 GLY H H 105 8.477 8.477 8.491 -0.014 17635 5400 1 9 . 1 1 106 106 ARG N N 106 120.341 120.341 118.192 2.149 17635 5401 1 9 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.946 -0.595 17635 5402 1 9 . 1 1 106 106 ARG C C 106 173.491 173.491 176.460 -2.969 17635 5403 1 9 . 1 1 106 106 ARG CA C 106 56.227 56.227 56.598 -0.371 17635 5404 1 9 . 1 1 106 106 ARG CB C 106 30.629 30.629 32.444 -1.815 17635 5405 1 9 . 1 1 106 106 ARG H H 106 8.244 8.244 8.784 -0.540 17635 5406 1 9 . 1 1 107 107 GLY N N 107 109.856 109.856 107.247 2.609 17635 5407 1 9 . 1 1 107 107 GLY C C 107 175.834 175.834 174.219 1.615 17635 5408 1 9 . 1 1 107 107 GLY CA C 107 45.441 45.441 45.178 0.263 17635 5409 1 9 . 1 1 107 107 GLY H H 107 8.522 8.522 9.119 -0.597 17635 5410 1 10 . 1 1 2 2 GLN N N 2 121.692 121.692 118.270 3.422 17635 5411 1 10 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.483 -0.217 17635 5412 1 10 . 1 1 2 2 GLN C C 2 175.248 175.248 174.280 0.968 17635 5413 1 10 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.095 0.901 17635 5414 1 10 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.381 0.258 17635 5415 1 10 . 1 1 2 2 GLN H H 2 8.621 8.621 7.743 0.878 17635 5416 1 10 . 1 1 3 3 ASP N N 3 121.801 121.801 121.882 -0.081 17635 5417 1 10 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.817 -0.249 17635 5418 1 10 . 1 1 3 3 ASP C C 3 174.336 174.336 175.276 -0.940 17635 5419 1 10 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.463 -0.401 17635 5420 1 10 . 1 1 3 3 ASP CB C 3 41.071 41.071 39.969 1.102 17635 5421 1 10 . 1 1 3 3 ASP H H 3 8.436 8.436 8.429 0.007 17635 5422 1 10 . 1 1 4 4 ASN N N 4 120.292 120.292 120.456 -0.164 17635 5423 1 10 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.722 -0.085 17635 5424 1 10 . 1 1 4 4 ASN C C 4 174.415 174.415 174.775 -0.360 17635 5425 1 10 . 1 1 4 4 ASN CA C 4 53.861 53.861 54.212 -0.351 17635 5426 1 10 . 1 1 4 4 ASN CB C 4 38.534 38.534 39.570 -1.036 17635 5427 1 10 . 1 1 4 4 ASN H H 4 8.528 8.528 8.084 0.444 17635 5428 1 10 . 1 1 5 5 SER N N 5 117.091 117.091 114.966 2.125 17635 5429 1 10 . 1 1 5 5 SER HA H 5 4.163 4.163 4.600 -0.437 17635 5430 1 10 . 1 1 5 5 SER C C 5 176.370 176.370 173.540 2.830 17635 5431 1 10 . 1 1 5 5 SER CA C 5 60.846 60.846 58.856 1.990 17635 5432 1 10 . 1 1 5 5 SER CB C 5 63.136 63.136 63.053 0.083 17635 5433 1 10 . 1 1 5 5 SER H H 5 8.470 8.470 8.641 -0.171 17635 5434 1 10 . 1 1 6 6 ASP N N 6 119.436 119.436 119.904 -0.468 17635 5435 1 10 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.714 -0.019 17635 5436 1 10 . 1 1 6 6 ASP C C 6 175.048 175.048 174.814 0.234 17635 5437 1 10 . 1 1 6 6 ASP CA C 6 53.094 53.094 54.330 -1.236 17635 5438 1 10 . 1 1 6 6 ASP CB C 6 40.935 40.935 42.173 -1.238 17635 5439 1 10 . 1 1 6 6 ASP H H 6 8.218 8.218 8.108 0.110 17635 5440 1 10 . 1 1 7 7 ASN N N 7 119.696 119.696 116.176 3.520 17635 5441 1 10 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.477 0.151 17635 5442 1 10 . 1 1 7 7 ASN C C 7 176.539 176.539 174.221 2.318 17635 5443 1 10 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.373 -0.214 17635 5444 1 10 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.095 0.764 17635 5445 1 10 . 1 1 7 7 ASN H H 7 7.734 7.734 8.616 -0.882 17635 5446 1 10 . 1 1 8 8 ASN N N 8 119.436 119.436 114.097 5.339 17635 5447 1 10 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.891 -0.023 17635 5448 1 10 . 1 1 8 8 ASN C C 8 175.327 175.327 175.271 0.056 17635 5449 1 10 . 1 1 8 8 ASN CA C 8 53.204 53.204 53.430 -0.226 17635 5450 1 10 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.712 -1.217 17635 5451 1 10 . 1 1 8 8 ASN H H 8 8.350 8.350 8.462 -0.112 17635 5452 1 10 . 1 1 9 9 THR N N 9 118.650 118.650 115.788 2.862 17635 5453 1 10 . 1 1 9 9 THR HA H 9 5.557 5.557 4.570 0.987 17635 5454 1 10 . 1 1 9 9 THR C C 9 177.117 177.117 174.401 2.716 17635 5455 1 10 . 1 1 9 9 THR CA C 9 62.314 62.314 63.323 -1.009 17635 5456 1 10 . 1 1 9 9 THR CB C 9 71.225 71.225 69.057 2.168 17635 5457 1 10 . 1 1 9 9 THR H H 9 8.428 8.428 7.579 0.849 17635 5458 1 10 . 1 1 10 10 ILE N N 10 118.556 118.556 120.191 -1.635 17635 5459 1 10 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.091 0.074 17635 5460 1 10 . 1 1 10 10 ILE C C 10 176.837 176.837 174.644 2.193 17635 5461 1 10 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.909 0.389 17635 5462 1 10 . 1 1 10 10 ILE CB C 10 39.880 39.880 40.361 -0.481 17635 5463 1 10 . 1 1 10 10 ILE H H 10 8.770 8.770 8.745 0.025 17635 5464 1 10 . 1 1 11 11 PHE N N 11 123.798 123.798 121.016 2.782 17635 5465 1 10 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.766 0.654 17635 5466 1 10 . 1 1 11 11 PHE C C 11 177.066 177.066 174.552 2.514 17635 5467 1 10 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.211 0.151 17635 5468 1 10 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.457 0.411 17635 5469 1 10 . 1 1 11 11 PHE H H 11 9.548 9.548 8.021 1.527 17635 5470 1 10 . 1 1 12 12 VAL N N 12 127.993 127.993 127.037 0.956 17635 5471 1 10 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.316 0.642 17635 5472 1 10 . 1 1 12 12 VAL C C 12 176.965 176.965 174.462 2.503 17635 5473 1 10 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.532 -1.697 17635 5474 1 10 . 1 1 12 12 VAL CB C 12 34.800 34.800 31.889 2.911 17635 5475 1 10 . 1 1 12 12 VAL H H 12 8.940 8.940 9.263 -0.323 17635 5476 1 10 . 1 1 13 13 GLN N N 13 122.289 122.289 127.703 -5.414 17635 5477 1 10 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.526 0.253 17635 5478 1 10 . 1 1 13 13 GLN C C 13 175.631 175.631 175.399 0.232 17635 5479 1 10 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.282 -0.172 17635 5480 1 10 . 1 1 13 13 GLN CB C 13 34.132 34.132 31.685 2.447 17635 5481 1 10 . 1 1 13 13 GLN H H 13 8.747 8.747 7.987 0.760 17635 5482 1 10 . 1 1 14 14 GLY N N 14 109.212 109.212 113.504 -4.292 17635 5483 1 10 . 1 1 14 14 GLY C C 14 175.436 175.436 172.150 3.286 17635 5484 1 10 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.276 0.154 17635 5485 1 10 . 1 1 14 14 GLY H H 14 8.236 8.236 8.061 0.175 17635 5486 1 10 . 1 1 15 15 LEU N N 15 117.824 117.824 121.058 -3.234 17635 5487 1 10 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.632 -0.926 17635 5488 1 10 . 1 1 15 15 LEU C C 15 174.111 174.111 177.105 -2.994 17635 5489 1 10 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.120 0.598 17635 5490 1 10 . 1 1 15 15 LEU CB C 15 42.433 42.433 43.141 -0.708 17635 5491 1 10 . 1 1 15 15 LEU H H 15 8.442 8.442 7.801 0.641 17635 5492 1 10 . 1 1 16 16 GLY N N 16 105.063 105.063 107.062 -1.999 17635 5493 1 10 . 1 1 16 16 GLY C C 16 177.771 177.771 173.606 4.165 17635 5494 1 10 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.011 -0.917 17635 5495 1 10 . 1 1 16 16 GLY H H 16 8.006 8.006 7.936 0.070 17635 5496 1 10 . 1 1 17 17 GLU N N 17 113.781 113.781 120.086 -6.305 17635 5497 1 10 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.498 -0.379 17635 5498 1 10 . 1 1 17 17 GLU C C 17 173.937 173.937 175.357 -1.420 17635 5499 1 10 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.385 0.896 17635 5500 1 10 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.994 0.442 17635 5501 1 10 . 1 1 17 17 GLU H H 17 8.134 8.134 8.354 -0.220 17635 5502 1 10 . 1 1 18 18 ASN N N 18 116.660 116.660 116.849 -0.189 17635 5503 1 10 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.631 0.310 17635 5504 1 10 . 1 1 18 18 ASN C C 18 175.900 175.900 174.240 1.660 17635 5505 1 10 . 1 1 18 18 ASN CA C 18 52.478 52.478 53.242 -0.764 17635 5506 1 10 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.441 -0.956 17635 5507 1 10 . 1 1 18 18 ASN H H 18 8.407 8.407 7.924 0.483 17635 5508 1 10 . 1 1 19 19 VAL N N 19 118.323 118.323 120.792 -2.469 17635 5509 1 10 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.551 0.601 17635 5510 1 10 . 1 1 19 19 VAL C C 19 177.655 177.655 174.522 3.133 17635 5511 1 10 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.909 -2.032 17635 5512 1 10 . 1 1 19 19 VAL CB C 19 32.513 32.513 31.884 0.629 17635 5513 1 10 . 1 1 19 19 VAL H H 19 6.855 6.855 7.635 -0.780 17635 5514 1 10 . 1 1 20 20 THR N N 20 111.636 111.636 116.699 -5.063 17635 5515 1 10 . 1 1 20 20 THR HA H 20 4.719 4.719 4.537 0.182 17635 5516 1 10 . 1 1 20 20 THR C C 20 175.266 175.266 174.882 0.384 17635 5517 1 10 . 1 1 20 20 THR CA C 20 58.698 58.698 60.506 -1.808 17635 5518 1 10 . 1 1 20 20 THR CB C 20 72.948 72.948 71.253 1.695 17635 5519 1 10 . 1 1 20 20 THR H H 20 7.328 7.328 7.822 -0.494 17635 5520 1 10 . 1 1 21 21 ILE N N 21 122.147 122.147 123.067 -0.920 17635 5521 1 10 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.669 -0.151 17635 5522 1 10 . 1 1 21 21 ILE C C 21 173.198 173.198 177.107 -3.909 17635 5523 1 10 . 1 1 21 21 ILE CA C 21 65.772 65.772 65.598 0.174 17635 5524 1 10 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.787 -0.204 17635 5525 1 10 . 1 1 21 21 ILE H H 21 9.074 9.074 8.614 0.460 17635 5526 1 10 . 1 1 22 22 GLU N N 22 118.154 118.154 120.714 -2.560 17635 5527 1 10 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.066 -0.080 17635 5528 1 10 . 1 1 22 22 GLU C C 22 171.799 171.799 178.469 -6.670 17635 5529 1 10 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.558 1.055 17635 5530 1 10 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.082 0.709 17635 5531 1 10 . 1 1 22 22 GLU H H 22 8.814 8.814 8.708 0.106 17635 5532 1 10 . 1 1 23 23 SER N N 23 115.921 115.921 117.339 -1.418 17635 5533 1 10 . 1 1 23 23 SER HA H 23 4.384 4.384 4.395 -0.011 17635 5534 1 10 . 1 1 23 23 SER C C 23 172.447 172.447 176.834 -4.387 17635 5535 1 10 . 1 1 23 23 SER CA C 23 61.239 61.239 62.032 -0.793 17635 5536 1 10 . 1 1 23 23 SER CB C 23 62.838 62.838 62.962 -0.124 17635 5537 1 10 . 1 1 23 23 SER H H 23 8.236 8.236 8.009 0.227 17635 5538 1 10 . 1 1 24 24 VAL N N 24 124.867 124.867 122.432 2.435 17635 5539 1 10 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.225 -0.477 17635 5540 1 10 . 1 1 24 24 VAL C C 24 173.016 173.016 177.708 -4.692 17635 5541 1 10 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.552 0.702 17635 5542 1 10 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.630 -0.096 17635 5543 1 10 . 1 1 24 24 VAL H H 24 7.973 7.973 8.485 -0.512 17635 5544 1 10 . 1 1 25 25 ALA N N 25 123.198 123.198 121.446 1.752 17635 5545 1 10 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.077 -0.178 17635 5546 1 10 . 1 1 25 25 ALA C C 25 171.061 171.061 178.152 -7.091 17635 5547 1 10 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.953 0.742 17635 5548 1 10 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.354 -0.616 17635 5549 1 10 . 1 1 25 25 ALA H H 25 8.695 8.695 8.456 0.239 17635 5550 1 10 . 1 1 26 26 ASP N N 26 115.503 115.503 117.578 -2.075 17635 5551 1 10 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.546 -0.223 17635 5552 1 10 . 1 1 26 26 ASP C C 26 173.108 173.108 178.191 -5.083 17635 5553 1 10 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.937 0.386 17635 5554 1 10 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.393 -0.341 17635 5555 1 10 . 1 1 26 26 ASP H H 26 8.312 8.312 7.846 0.466 17635 5556 1 10 . 1 1 27 27 TYR N N 27 119.224 119.224 117.461 1.763 17635 5557 1 10 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.707 -0.507 17635 5558 1 10 . 1 1 27 27 TYR C C 27 172.908 172.908 175.938 -3.030 17635 5559 1 10 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.347 2.669 17635 5560 1 10 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.697 0.235 17635 5561 1 10 . 1 1 27 27 TYR H H 27 7.533 7.533 7.900 -0.367 17635 5562 1 10 . 1 1 28 28 PHE N N 28 112.595 112.595 120.240 -7.645 17635 5563 1 10 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.144 0.186 17635 5564 1 10 . 1 1 28 28 PHE C C 28 173.082 173.082 174.740 -1.658 17635 5565 1 10 . 1 1 28 28 PHE CA C 28 61.784 61.784 56.393 5.391 17635 5566 1 10 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.721 1.282 17635 5567 1 10 . 1 1 28 28 PHE H H 28 7.974 7.974 8.123 -0.149 17635 5568 1 10 . 1 1 29 29 LYS N N 29 118.820 118.820 117.863 0.957 17635 5569 1 10 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.808 0.109 17635 5570 1 10 . 1 1 29 29 LYS C C 29 173.682 173.682 176.402 -2.720 17635 5571 1 10 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.439 2.841 17635 5572 1 10 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.442 -1.151 17635 5573 1 10 . 1 1 29 29 LYS H H 29 8.325 8.325 7.838 0.487 17635 5574 1 10 . 1 1 30 30 GLN N N 30 116.232 116.232 119.423 -3.191 17635 5575 1 10 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.313 -0.178 17635 5576 1 10 . 1 1 30 30 GLN C C 30 173.790 173.790 177.070 -3.280 17635 5577 1 10 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.538 0.008 17635 5578 1 10 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.877 1.021 17635 5579 1 10 . 1 1 30 30 GLN H H 30 7.518 7.518 8.163 -0.645 17635 5580 1 10 . 1 1 31 31 ILE N N 31 116.489 116.489 118.576 -2.087 17635 5581 1 10 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.959 0.280 17635 5582 1 10 . 1 1 31 31 ILE C C 31 175.599 175.599 175.264 0.335 17635 5583 1 10 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.709 -3.488 17635 5584 1 10 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.447 1.887 17635 5585 1 10 . 1 1 31 31 ILE H H 31 7.809 7.809 8.392 -0.583 17635 5586 1 10 . 1 1 32 32 GLY N N 32 107.416 107.416 104.195 3.221 17635 5587 1 10 . 1 1 32 32 GLY C C 32 180.182 180.182 172.399 7.783 17635 5588 1 10 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.122 0.872 17635 5589 1 10 . 1 1 32 32 GLY H H 32 7.344 7.344 7.565 -0.221 17635 5590 1 10 . 1 1 33 33 ILE N N 33 117.784 117.784 120.968 -3.184 17635 5591 1 10 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.557 -0.468 17635 5592 1 10 . 1 1 33 33 ILE C C 33 173.301 173.301 175.178 -1.877 17635 5593 1 10 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.603 1.038 17635 5594 1 10 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.255 -0.596 17635 5595 1 10 . 1 1 33 33 ILE H H 33 8.173 8.173 8.265 -0.092 17635 5596 1 10 . 1 1 34 34 ILE N N 34 131.781 131.781 128.721 3.060 17635 5597 1 10 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.383 -0.596 17635 5598 1 10 . 1 1 34 34 ILE C C 34 174.663 174.663 176.189 -1.526 17635 5599 1 10 . 1 1 34 34 ILE CA C 34 61.370 61.370 61.283 0.086 17635 5600 1 10 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.167 -0.172 17635 5601 1 10 . 1 1 34 34 ILE H H 34 8.687 8.687 8.841 -0.154 17635 5602 1 10 . 1 1 35 35 LYS N N 35 130.372 130.372 128.655 1.717 17635 5603 1 10 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.159 -0.075 17635 5604 1 10 . 1 1 35 35 LYS C C 35 175.376 175.376 176.327 -0.951 17635 5605 1 10 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.447 0.026 17635 5606 1 10 . 1 1 35 35 LYS CB C 35 33.664 33.664 32.312 1.352 17635 5607 1 10 . 1 1 35 35 LYS H H 35 8.680 8.680 8.209 0.471 17635 5608 1 10 . 1 1 36 36 THR N N 36 118.312 118.312 118.183 0.129 17635 5609 1 10 . 1 1 36 36 THR HA H 36 4.415 4.415 4.454 -0.039 17635 5610 1 10 . 1 1 36 36 THR C C 36 176.394 176.394 174.098 2.296 17635 5611 1 10 . 1 1 36 36 THR CA C 36 61.340 61.340 62.312 -0.972 17635 5612 1 10 . 1 1 36 36 THR CB C 36 70.809 70.809 69.334 1.475 17635 5613 1 10 . 1 1 36 36 THR H H 36 8.456 8.456 8.121 0.335 17635 5614 1 10 . 1 1 37 37 ASN N N 37 124.092 124.092 121.679 2.413 17635 5615 1 10 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.864 -0.334 17635 5616 1 10 . 1 1 37 37 ASN C C 37 174.235 174.235 175.554 -1.319 17635 5617 1 10 . 1 1 37 37 ASN CA C 37 53.064 53.064 52.169 0.895 17635 5618 1 10 . 1 1 37 37 ASN CB C 37 38.927 38.927 40.286 -1.359 17635 5619 1 10 . 1 1 37 37 ASN H H 37 8.794 8.794 9.012 -0.218 17635 5620 1 10 . 1 1 38 38 LYS N N 38 127.969 127.969 124.294 3.675 17635 5621 1 10 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.167 -0.163 17635 5622 1 10 . 1 1 38 38 LYS C C 38 172.702 172.702 177.293 -4.591 17635 5623 1 10 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.299 0.159 17635 5624 1 10 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.009 0.158 17635 5625 1 10 . 1 1 38 38 LYS H H 38 8.962 8.962 8.792 0.170 17635 5626 1 10 . 1 1 39 39 LYS N N 39 117.413 117.413 118.220 -0.807 17635 5627 1 10 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.303 -0.045 17635 5628 1 10 . 1 1 39 39 LYS C C 39 172.261 172.261 177.860 -5.599 17635 5629 1 10 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.509 -0.190 17635 5630 1 10 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.825 -0.028 17635 5631 1 10 . 1 1 39 39 LYS H H 39 8.314 8.314 8.462 -0.148 17635 5632 1 10 . 1 1 40 40 THR N N 40 105.547 105.547 110.326 -4.779 17635 5633 1 10 . 1 1 40 40 THR HA H 40 4.465 4.465 4.531 -0.066 17635 5634 1 10 . 1 1 40 40 THR C C 40 174.021 174.021 175.088 -1.067 17635 5635 1 10 . 1 1 40 40 THR CA C 40 61.260 61.260 62.294 -1.034 17635 5636 1 10 . 1 1 40 40 THR CB C 40 70.997 70.997 70.947 0.050 17635 5637 1 10 . 1 1 40 40 THR H H 40 7.422 7.422 8.902 -1.480 17635 5638 1 10 . 1 1 41 41 GLY N N 41 111.631 111.631 109.563 2.068 17635 5639 1 10 . 1 1 41 41 GLY C C 41 176.727 176.727 173.340 3.387 17635 5640 1 10 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.181 0.549 17635 5641 1 10 . 1 1 41 41 GLY H H 41 8.644 8.644 8.610 0.034 17635 5642 1 10 . 1 1 42 42 GLN N N 42 118.894 118.894 119.525 -0.631 17635 5643 1 10 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.863 -0.194 17635 5644 1 10 . 1 1 42 42 GLN C C 42 177.178 177.178 173.512 3.666 17635 5645 1 10 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.682 0.899 17635 5646 1 10 . 1 1 42 42 GLN CB C 42 29.230 29.230 30.112 -0.882 17635 5647 1 10 . 1 1 42 42 GLN H H 42 7.662 7.662 7.756 -0.094 17635 5648 1 10 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.385 0.210 17635 5649 1 10 . 1 1 43 43 PRO C C 43 172.629 172.629 176.254 -3.625 17635 5650 1 10 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.892 -1.070 17635 5651 1 10 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.172 0.524 17635 5652 1 10 . 1 1 44 44 MET N N 44 124.162 124.162 120.289 3.873 17635 5653 1 10 . 1 1 44 44 MET HA H 44 4.432 4.432 4.685 -0.253 17635 5654 1 10 . 1 1 44 44 MET C C 44 176.474 176.474 174.303 2.171 17635 5655 1 10 . 1 1 44 44 MET CA C 44 55.419 55.419 54.697 0.722 17635 5656 1 10 . 1 1 44 44 MET CB C 44 30.555 30.555 36.067 -5.512 17635 5657 1 10 . 1 1 44 44 MET H H 44 8.874 8.874 8.599 0.275 17635 5658 1 10 . 1 1 45 45 ILE N N 45 126.237 126.237 122.212 4.025 17635 5659 1 10 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.500 0.302 17635 5660 1 10 . 1 1 45 45 ILE C C 45 176.415 176.415 174.307 2.108 17635 5661 1 10 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.095 -0.879 17635 5662 1 10 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.507 -0.281 17635 5663 1 10 . 1 1 45 45 ILE H H 45 7.730 7.730 8.380 -0.650 17635 5664 1 10 . 1 1 46 46 ASN N N 46 124.735 124.735 124.581 0.154 17635 5665 1 10 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.878 0.063 17635 5666 1 10 . 1 1 46 46 ASN C C 46 176.836 176.836 173.759 3.077 17635 5667 1 10 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.650 -1.089 17635 5668 1 10 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.614 -0.144 17635 5669 1 10 . 1 1 46 46 ASN H H 46 8.384 8.384 8.839 -0.455 17635 5670 1 10 . 1 1 47 47 LEU N N 47 122.487 122.487 122.439 0.048 17635 5671 1 10 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.793 -0.078 17635 5672 1 10 . 1 1 47 47 LEU C C 47 174.190 174.190 176.124 -1.934 17635 5673 1 10 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.123 -0.791 17635 5674 1 10 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.491 -2.214 17635 5675 1 10 . 1 1 47 47 LEU H H 47 8.594 8.594 8.348 0.246 17635 5676 1 10 . 1 1 48 48 TYR N N 48 121.842 121.842 123.182 -1.340 17635 5677 1 10 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.681 0.086 17635 5678 1 10 . 1 1 48 48 TYR C C 48 173.649 173.649 175.646 -1.997 17635 5679 1 10 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.482 1.412 17635 5680 1 10 . 1 1 48 48 TYR CB C 48 39.199 39.199 39.720 -0.521 17635 5681 1 10 . 1 1 48 48 TYR H H 48 7.666 7.666 8.459 -0.793 17635 5682 1 10 . 1 1 49 49 THR N N 49 116.554 116.554 112.020 4.534 17635 5683 1 10 . 1 1 49 49 THR HA H 49 4.806 4.806 4.480 0.326 17635 5684 1 10 . 1 1 49 49 THR C C 49 176.654 176.654 173.122 3.532 17635 5685 1 10 . 1 1 49 49 THR CA C 49 60.693 60.693 59.849 0.844 17635 5686 1 10 . 1 1 49 49 THR CB C 49 71.437 71.437 72.089 -0.652 17635 5687 1 10 . 1 1 49 49 THR H H 49 8.965 8.965 7.990 0.975 17635 5688 1 10 . 1 1 50 50 ASP N N 50 123.826 123.826 122.858 0.968 17635 5689 1 10 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.818 -0.194 17635 5690 1 10 . 1 1 50 50 ASP C C 50 173.380 173.380 177.110 -3.730 17635 5691 1 10 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.177 -0.089 17635 5692 1 10 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.815 1.052 17635 5693 1 10 . 1 1 50 50 ASP H H 50 8.939 8.939 8.511 0.428 17635 5694 1 10 . 1 1 51 51 ARG N N 51 127.794 127.794 122.520 5.274 17635 5695 1 10 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.034 0.011 17635 5696 1 10 . 1 1 51 51 ARG C C 51 173.101 173.101 176.054 -2.953 17635 5697 1 10 . 1 1 51 51 ARG CA C 51 58.562 58.562 58.458 0.104 17635 5698 1 10 . 1 1 51 51 ARG CB C 51 30.167 30.167 30.584 -0.417 17635 5699 1 10 . 1 1 51 51 ARG H H 51 8.958 8.958 8.550 0.407 17635 5700 1 10 . 1 1 52 52 GLU N N 52 117.542 117.542 112.792 4.750 17635 5701 1 10 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.372 -0.094 17635 5702 1 10 . 1 1 52 52 GLU C C 52 172.201 172.201 176.041 -3.840 17635 5703 1 10 . 1 1 52 52 GLU CA C 52 58.524 58.524 56.438 2.087 17635 5704 1 10 . 1 1 52 52 GLU CB C 52 30.278 30.278 28.398 1.880 17635 5705 1 10 . 1 1 52 52 GLU H H 52 8.561 8.561 8.154 0.407 17635 5706 1 10 . 1 1 53 53 THR N N 53 107.065 107.065 114.610 -7.545 17635 5707 1 10 . 1 1 53 53 THR HA H 53 4.436 4.436 4.283 0.153 17635 5708 1 10 . 1 1 53 53 THR C C 53 173.851 173.851 175.555 -1.704 17635 5709 1 10 . 1 1 53 53 THR CA C 53 61.944 61.944 63.462 -1.518 17635 5710 1 10 . 1 1 53 53 THR CB C 53 71.197 71.197 68.965 2.232 17635 5711 1 10 . 1 1 53 53 THR H H 53 8.087 8.087 8.015 0.072 17635 5712 1 10 . 1 1 54 54 GLY N N 54 111.295 111.295 107.698 3.597 17635 5713 1 10 . 1 1 54 54 GLY C C 54 176.747 176.747 173.893 2.854 17635 5714 1 10 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.705 0.998 17635 5715 1 10 . 1 1 54 54 GLY H H 54 8.423 8.423 8.162 0.261 17635 5716 1 10 . 1 1 55 55 LYS N N 55 119.673 119.673 124.137 -4.464 17635 5717 1 10 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.242 0.111 17635 5718 1 10 . 1 1 55 55 LYS C C 55 173.854 173.854 176.160 -2.306 17635 5719 1 10 . 1 1 55 55 LYS CA C 55 55.842 55.842 56.241 -0.399 17635 5720 1 10 . 1 1 55 55 LYS CB C 55 33.821 33.821 32.262 1.559 17635 5721 1 10 . 1 1 55 55 LYS H H 55 7.767 7.767 8.232 -0.465 17635 5722 1 10 . 1 1 56 56 LEU N N 56 122.426 122.426 121.898 0.528 17635 5723 1 10 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.547 -0.191 17635 5724 1 10 . 1 1 56 56 LEU C C 56 172.534 172.534 175.606 -3.072 17635 5725 1 10 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.021 2.234 17635 5726 1 10 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.062 -0.408 17635 5727 1 10 . 1 1 56 56 LEU H H 56 8.768 8.768 8.435 0.333 17635 5728 1 10 . 1 1 57 57 LYS N N 57 118.264 118.264 117.848 0.416 17635 5729 1 10 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.023 0.265 17635 5730 1 10 . 1 1 57 57 LYS C C 57 173.648 173.648 177.751 -4.103 17635 5731 1 10 . 1 1 57 57 LYS CA C 57 56.264 56.264 57.096 -0.832 17635 5732 1 10 . 1 1 57 57 LYS CB C 57 34.062 34.062 30.494 3.568 17635 5733 1 10 . 1 1 57 57 LYS H H 57 8.012 8.012 7.847 0.165 17635 5734 1 10 . 1 1 58 58 GLY N N 58 108.514 108.514 111.274 -2.760 17635 5735 1 10 . 1 1 58 58 GLY C C 58 177.876 177.876 173.007 4.869 17635 5736 1 10 . 1 1 58 58 GLY CA C 58 46.364 46.364 44.883 1.481 17635 5737 1 10 . 1 1 58 58 GLY H H 58 8.334 8.334 8.787 -0.453 17635 5738 1 10 . 1 1 59 59 GLU N N 59 116.119 116.119 120.144 -4.025 17635 5739 1 10 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.152 0.369 17635 5740 1 10 . 1 1 59 59 GLU C C 59 173.860 173.860 174.012 -0.152 17635 5741 1 10 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.500 -1.475 17635 5742 1 10 . 1 1 59 59 GLU CB C 59 34.304 34.304 32.465 1.839 17635 5743 1 10 . 1 1 59 59 GLU H H 59 7.202 7.202 7.881 -0.679 17635 5744 1 10 . 1 1 60 60 ALA N N 60 123.607 123.607 126.878 -3.271 17635 5745 1 10 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.917 0.690 17635 5746 1 10 . 1 1 60 60 ALA C C 60 173.923 173.923 175.162 -1.239 17635 5747 1 10 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.114 -0.171 17635 5748 1 10 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.141 0.918 17635 5749 1 10 . 1 1 60 60 ALA H H 60 8.930 8.930 8.905 0.025 17635 5750 1 10 . 1 1 61 61 THR N N 61 108.384 108.384 114.474 -6.090 17635 5751 1 10 . 1 1 61 61 THR HA H 61 5.743 5.743 4.757 0.986 17635 5752 1 10 . 1 1 61 61 THR C C 61 176.172 176.172 173.850 2.322 17635 5753 1 10 . 1 1 61 61 THR CA C 61 59.625 59.625 60.018 -0.393 17635 5754 1 10 . 1 1 61 61 THR CB C 61 71.224 71.224 69.077 2.147 17635 5755 1 10 . 1 1 61 61 THR H H 61 8.452 8.452 8.638 -0.186 17635 5756 1 10 . 1 1 62 62 VAL N N 62 120.200 120.200 127.618 -7.418 17635 5757 1 10 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.019 0.225 17635 5758 1 10 . 1 1 62 62 VAL C C 62 175.994 175.994 174.971 1.023 17635 5759 1 10 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.224 0.202 17635 5760 1 10 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.811 1.874 17635 5761 1 10 . 1 1 62 62 VAL H H 62 8.071 8.071 7.863 0.208 17635 5762 1 10 . 1 1 63 63 SER N N 63 121.689 121.689 121.326 0.363 17635 5763 1 10 . 1 1 63 63 SER HA H 63 5.261 5.261 4.597 0.664 17635 5764 1 10 . 1 1 63 63 SER C C 63 177.943 177.943 173.398 4.545 17635 5765 1 10 . 1 1 63 63 SER CA C 63 57.662 57.662 57.504 0.158 17635 5766 1 10 . 1 1 63 63 SER CB C 63 64.427 64.427 64.580 -0.153 17635 5767 1 10 . 1 1 63 63 SER H H 63 7.695 7.695 8.095 -0.400 17635 5768 1 10 . 1 1 64 64 PHE N N 64 122.640 122.640 119.633 3.007 17635 5769 1 10 . 1 1 64 64 PHE HA H 64 4.854 4.854 5.004 -0.150 17635 5770 1 10 . 1 1 64 64 PHE C C 64 174.605 174.605 174.663 -0.058 17635 5771 1 10 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.108 1.096 17635 5772 1 10 . 1 1 64 64 PHE CB C 64 41.976 41.976 43.313 -1.337 17635 5773 1 10 . 1 1 64 64 PHE H H 64 9.025 9.025 8.711 0.314 17635 5774 1 10 . 1 1 65 65 ASP N N 65 119.943 119.943 120.568 -0.625 17635 5775 1 10 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.634 -0.199 17635 5776 1 10 . 1 1 65 65 ASP C C 65 174.396 174.396 176.229 -1.833 17635 5777 1 10 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.504 1.938 17635 5778 1 10 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.909 0.125 17635 5779 1 10 . 1 1 65 65 ASP H H 65 8.512 8.512 9.320 -0.808 17635 5780 1 10 . 1 1 66 66 ASP N N 66 116.125 116.125 117.649 -1.524 17635 5781 1 10 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.074 0.325 17635 5782 1 10 . 1 1 66 66 ASP C C 66 175.936 175.936 174.899 1.037 17635 5783 1 10 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.330 -0.537 17635 5784 1 10 . 1 1 66 66 ASP CB C 66 42.919 42.919 43.413 -0.494 17635 5785 1 10 . 1 1 66 66 ASP H H 66 8.323 8.323 7.952 0.371 17635 5786 1 10 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.392 0.058 17635 5787 1 10 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.341 0.583 17635 5788 1 10 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.365 -0.535 17635 5789 1 10 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.183 0.236 17635 5790 1 10 . 1 1 68 68 PRO C C 68 171.345 171.345 178.736 -7.391 17635 5791 1 10 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.132 0.103 17635 5792 1 10 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.847 0.150 17635 5793 1 10 . 1 1 69 69 SER N N 69 114.544 114.544 114.343 0.201 17635 5794 1 10 . 1 1 69 69 SER HA H 69 4.036 4.036 3.845 0.191 17635 5795 1 10 . 1 1 69 69 SER C C 69 176.535 176.535 176.103 0.432 17635 5796 1 10 . 1 1 69 69 SER CA C 69 61.837 61.837 61.576 0.261 17635 5797 1 10 . 1 1 69 69 SER CB C 69 62.773 62.773 62.237 0.536 17635 5798 1 10 . 1 1 69 69 SER H H 69 8.004 8.004 8.140 -0.136 17635 5799 1 10 . 1 1 70 70 ALA N N 70 122.649 122.649 124.399 -1.750 17635 5800 1 10 . 1 1 70 70 ALA HA H 70 3.593 3.593 4.371 -0.778 17635 5801 1 10 . 1 1 70 70 ALA C C 70 172.686 172.686 179.745 -7.059 17635 5802 1 10 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.721 -0.685 17635 5803 1 10 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.354 -0.489 17635 5804 1 10 . 1 1 70 70 ALA H H 70 7.383 7.383 7.811 -0.428 17635 5805 1 10 . 1 1 71 71 LYS N N 71 116.308 116.308 119.549 -3.241 17635 5806 1 10 . 1 1 71 71 LYS HA H 71 3.775 3.775 4.177 -0.402 17635 5807 1 10 . 1 1 71 71 LYS C C 71 172.333 172.333 178.797 -6.464 17635 5808 1 10 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.635 0.367 17635 5809 1 10 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.380 0.062 17635 5810 1 10 . 1 1 71 71 LYS H H 71 7.159 7.159 7.660 -0.501 17635 5811 1 10 . 1 1 72 72 ALA N N 72 119.806 119.806 120.727 -0.921 17635 5812 1 10 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.064 0.102 17635 5813 1 10 . 1 1 72 72 ALA C C 72 170.530 170.530 179.855 -9.325 17635 5814 1 10 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.947 -0.231 17635 5815 1 10 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.065 -0.245 17635 5816 1 10 . 1 1 72 72 ALA H H 72 7.924 7.924 8.263 -0.339 17635 5817 1 10 . 1 1 73 73 ALA N N 73 120.524 120.524 121.505 -0.981 17635 5818 1 10 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.222 0.057 17635 5819 1 10 . 1 1 73 73 ALA C C 73 171.039 171.039 179.677 -8.638 17635 5820 1 10 . 1 1 73 73 ALA CA C 73 55.379 55.379 55.018 0.361 17635 5821 1 10 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.856 0.275 17635 5822 1 10 . 1 1 73 73 ALA H H 73 8.104 8.104 7.839 0.265 17635 5823 1 10 . 1 1 74 74 ILE N N 74 119.875 119.875 118.087 1.788 17635 5824 1 10 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.811 -0.397 17635 5825 1 10 . 1 1 74 74 ILE C C 74 172.435 172.435 178.000 -5.565 17635 5826 1 10 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.200 0.644 17635 5827 1 10 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.724 1.019 17635 5828 1 10 . 1 1 74 74 ILE H H 74 7.574 7.574 8.044 -0.470 17635 5829 1 10 . 1 1 75 75 ASP N N 75 117.867 117.867 118.422 -0.555 17635 5830 1 10 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.459 -0.148 17635 5831 1 10 . 1 1 75 75 ASP C C 75 172.054 172.054 176.815 -4.761 17635 5832 1 10 . 1 1 75 75 ASP CA C 75 57.161 57.161 57.164 -0.003 17635 5833 1 10 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.296 -0.765 17635 5834 1 10 . 1 1 75 75 ASP H H 75 7.937 7.937 8.097 -0.160 17635 5835 1 10 . 1 1 76 76 TRP N N 76 117.313 117.313 120.209 -2.896 17635 5836 1 10 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.492 -0.136 17635 5837 1 10 . 1 1 76 76 TRP C C 76 173.272 173.272 176.452 -3.180 17635 5838 1 10 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.510 0.953 17635 5839 1 10 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.759 1.018 17635 5840 1 10 . 1 1 76 76 TRP H H 76 8.475 8.475 7.750 0.725 17635 5841 1 10 . 1 1 77 77 PHE N N 77 112.019 112.019 117.000 -4.981 17635 5842 1 10 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.059 0.589 17635 5843 1 10 . 1 1 77 77 PHE C C 77 173.747 173.747 175.764 -2.017 17635 5844 1 10 . 1 1 77 77 PHE CA C 77 59.921 59.921 59.738 0.183 17635 5845 1 10 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.274 2.456 17635 5846 1 10 . 1 1 77 77 PHE H H 77 8.488 8.488 7.129 1.359 17635 5847 1 10 . 1 1 78 78 ASP N N 78 118.408 118.408 120.661 -2.253 17635 5848 1 10 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.450 0.014 17635 5849 1 10 . 1 1 78 78 ASP C C 78 172.542 172.542 176.418 -3.876 17635 5850 1 10 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.365 3.325 17635 5851 1 10 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.150 1.736 17635 5852 1 10 . 1 1 78 78 ASP H H 78 7.978 7.978 8.509 -0.531 17635 5853 1 10 . 1 1 79 79 GLY N N 79 115.548 115.548 105.214 10.334 17635 5854 1 10 . 1 1 79 79 GLY C C 79 175.680 175.680 173.508 2.172 17635 5855 1 10 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.936 1.136 17635 5856 1 10 . 1 1 79 79 GLY H H 79 8.615 8.615 8.565 0.050 17635 5857 1 10 . 1 1 80 80 LYS N N 80 120.271 120.271 119.442 0.829 17635 5858 1 10 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.530 -0.068 17635 5859 1 10 . 1 1 80 80 LYS C C 80 175.853 175.853 174.690 1.163 17635 5860 1 10 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.746 -0.596 17635 5861 1 10 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.087 -1.661 17635 5862 1 10 . 1 1 80 80 LYS H H 80 8.013 8.013 7.981 0.032 17635 5863 1 10 . 1 1 81 81 GLU N N 81 115.765 115.765 118.639 -2.874 17635 5864 1 10 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.207 -0.509 17635 5865 1 10 . 1 1 81 81 GLU C C 81 173.263 173.263 175.320 -2.057 17635 5866 1 10 . 1 1 81 81 GLU CA C 81 55.924 55.924 54.942 0.982 17635 5867 1 10 . 1 1 81 81 GLU CB C 81 32.042 32.042 32.608 -0.566 17635 5868 1 10 . 1 1 81 81 GLU H H 81 8.201 8.201 8.419 -0.218 17635 5869 1 10 . 1 1 82 82 PHE N N 82 127.080 127.080 125.092 1.988 17635 5870 1 10 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.572 -0.076 17635 5871 1 10 . 1 1 82 82 PHE C C 82 175.349 175.349 175.788 -0.439 17635 5872 1 10 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.989 -0.273 17635 5873 1 10 . 1 1 82 82 PHE CB C 82 41.994 41.994 40.346 1.648 17635 5874 1 10 . 1 1 82 82 PHE H H 82 9.162 9.162 8.972 0.190 17635 5875 1 10 . 1 1 83 83 SER N N 83 125.136 125.136 120.339 4.797 17635 5876 1 10 . 1 1 83 83 SER HA H 83 3.803 3.803 4.109 -0.306 17635 5877 1 10 . 1 1 83 83 SER C C 83 175.543 175.543 174.677 0.866 17635 5878 1 10 . 1 1 83 83 SER CA C 83 58.371 58.371 58.866 -0.495 17635 5879 1 10 . 1 1 83 83 SER CB C 83 62.519 62.519 62.781 -0.262 17635 5880 1 10 . 1 1 83 83 SER H H 83 9.193 9.193 9.205 -0.012 17635 5881 1 10 . 1 1 84 84 GLY N N 84 103.581 103.581 104.562 -0.981 17635 5882 1 10 . 1 1 84 84 GLY C C 84 177.188 177.188 173.376 3.812 17635 5883 1 10 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.757 0.295 17635 5884 1 10 . 1 1 84 84 GLY H H 84 8.446 8.446 8.219 0.227 17635 5885 1 10 . 1 1 85 85 ASN N N 85 119.051 119.051 118.849 0.202 17635 5886 1 10 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.185 0.149 17635 5887 1 10 . 1 1 85 85 ASN C C 85 178.020 178.020 172.569 5.451 17635 5888 1 10 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.575 -0.104 17635 5889 1 10 . 1 1 85 85 ASN CB C 85 41.117 41.117 39.594 1.523 17635 5890 1 10 . 1 1 85 85 ASN H H 85 7.762 7.762 7.927 -0.165 17635 5891 1 10 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.418 -0.751 17635 5892 1 10 . 1 1 86 86 PRO C C 86 173.474 173.474 176.017 -2.543 17635 5893 1 10 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.304 0.406 17635 5894 1 10 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.020 -1.151 17635 5895 1 10 . 1 1 87 87 ILE N N 87 117.270 117.270 115.804 1.466 17635 5896 1 10 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.389 -0.243 17635 5897 1 10 . 1 1 87 87 ILE C C 87 174.495 174.495 174.202 0.293 17635 5898 1 10 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.633 0.858 17635 5899 1 10 . 1 1 87 87 ILE CB C 87 41.671 41.671 43.002 -1.331 17635 5900 1 10 . 1 1 87 87 ILE H H 87 8.469 8.469 9.123 -0.654 17635 5901 1 10 . 1 1 88 88 LYS N N 88 122.271 122.271 121.536 0.735 17635 5902 1 10 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.706 0.486 17635 5903 1 10 . 1 1 88 88 LYS C C 88 174.393 174.393 175.243 -0.850 17635 5904 1 10 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.581 -1.443 17635 5905 1 10 . 1 1 88 88 LYS CB C 88 35.049 35.049 35.017 0.032 17635 5906 1 10 . 1 1 88 88 LYS H H 88 8.353 8.353 8.148 0.205 17635 5907 1 10 . 1 1 89 89 VAL N N 89 125.661 125.661 125.642 0.019 17635 5908 1 10 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.625 0.338 17635 5909 1 10 . 1 1 89 89 VAL C C 89 177.160 177.160 175.872 1.288 17635 5910 1 10 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.870 -0.509 17635 5911 1 10 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.118 2.652 17635 5912 1 10 . 1 1 89 89 VAL H H 89 9.414 9.414 8.499 0.915 17635 5913 1 10 . 1 1 90 90 SER N N 90 119.538 119.538 120.187 -0.649 17635 5914 1 10 . 1 1 90 90 SER HA H 90 4.710 4.710 4.582 0.128 17635 5915 1 10 . 1 1 90 90 SER C C 90 176.533 176.533 173.819 2.714 17635 5916 1 10 . 1 1 90 90 SER CA C 90 56.936 56.936 56.163 0.773 17635 5917 1 10 . 1 1 90 90 SER CB C 90 66.470 66.470 65.259 1.211 17635 5918 1 10 . 1 1 90 90 SER H H 90 8.945 8.945 8.009 0.936 17635 5919 1 10 . 1 1 91 91 PHE N N 91 120.115 120.115 120.093 0.022 17635 5920 1 10 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.570 0.103 17635 5921 1 10 . 1 1 91 91 PHE C C 91 173.349 173.349 175.000 -1.651 17635 5922 1 10 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.597 4.558 17635 5923 1 10 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.394 2.109 17635 5924 1 10 . 1 1 91 91 PHE H H 91 8.919 8.919 8.576 0.343 17635 5925 1 10 . 1 1 92 92 ALA N N 92 124.386 124.386 122.122 2.264 17635 5926 1 10 . 1 1 92 92 ALA HA H 92 4.356 4.356 3.976 0.380 17635 5927 1 10 . 1 1 92 92 ALA C C 92 172.984 172.984 176.995 -4.011 17635 5928 1 10 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.811 -0.713 17635 5929 1 10 . 1 1 92 92 ALA CB C 92 19.406 19.406 17.813 1.593 17635 5930 1 10 . 1 1 92 92 ALA H H 92 8.563 8.563 7.943 0.620 17635 5931 1 10 . 1 1 93 93 THR N N 93 116.073 116.073 113.801 2.272 17635 5932 1 10 . 1 1 93 93 THR HA H 93 4.208 4.208 4.195 0.013 17635 5933 1 10 . 1 1 93 93 THR C C 93 176.032 176.032 173.441 2.591 17635 5934 1 10 . 1 1 93 93 THR CA C 93 62.255 62.255 64.144 -1.889 17635 5935 1 10 . 1 1 93 93 THR CB C 93 69.708 69.708 69.421 0.287 17635 5936 1 10 . 1 1 93 93 THR H H 93 8.312 8.312 8.650 -0.338 17635 5937 1 10 . 1 1 94 94 ARG N N 94 124.359 124.359 120.681 3.678 17635 5938 1 10 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.537 -0.200 17635 5939 1 10 . 1 1 94 94 ARG C C 94 174.426 174.426 174.715 -0.289 17635 5940 1 10 . 1 1 94 94 ARG CA C 94 56.055 56.055 55.410 0.645 17635 5941 1 10 . 1 1 94 94 ARG CB C 94 30.911 30.911 31.237 -0.326 17635 5942 1 10 . 1 1 94 94 ARG H H 94 8.493 8.493 8.551 -0.058 17635 5943 1 10 . 1 1 95 95 ARG N N 95 122.515 122.515 120.791 1.724 17635 5944 1 10 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.120 0.108 17635 5945 1 10 . 1 1 95 95 ARG C C 95 174.306 174.306 175.624 -1.318 17635 5946 1 10 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.327 -0.185 17635 5947 1 10 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.435 1.531 17635 5948 1 10 . 1 1 95 95 ARG H H 95 8.343 8.343 8.651 -0.308 17635 5949 1 10 . 1 1 96 96 ALA N N 96 125.127 125.127 126.495 -1.368 17635 5950 1 10 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.239 -0.030 17635 5951 1 10 . 1 1 96 96 ALA C C 96 173.226 173.226 177.611 -4.385 17635 5952 1 10 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.169 0.601 17635 5953 1 10 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.493 -0.300 17635 5954 1 10 . 1 1 96 96 ALA H H 96 8.402 8.402 8.219 0.183 17635 5955 1 10 . 1 1 97 97 ASP N N 97 118.483 118.483 119.573 -1.090 17635 5956 1 10 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.920 -0.422 17635 5957 1 10 . 1 1 97 97 ASP C C 97 174.302 174.302 175.313 -1.011 17635 5958 1 10 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.830 -0.739 17635 5959 1 10 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.369 -0.462 17635 5960 1 10 . 1 1 97 97 ASP H H 97 8.206 8.206 8.531 -0.325 17635 5961 1 10 . 1 1 98 98 PHE N N 98 120.321 120.321 120.098 0.223 17635 5962 1 10 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.623 -0.133 17635 5963 1 10 . 1 1 98 98 PHE C C 98 174.878 174.878 175.758 -0.880 17635 5964 1 10 . 1 1 98 98 PHE CA C 98 58.160 58.160 59.113 -0.953 17635 5965 1 10 . 1 1 98 98 PHE CB C 98 39.303 39.303 39.901 -0.598 17635 5966 1 10 . 1 1 98 98 PHE H H 98 7.990 7.990 8.182 -0.192 17635 5967 1 10 . 1 1 99 99 ASN N N 99 120.016 120.016 115.968 4.048 17635 5968 1 10 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.712 -0.103 17635 5969 1 10 . 1 1 99 99 ASN C C 99 175.348 175.348 175.058 0.290 17635 5970 1 10 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.935 -0.622 17635 5971 1 10 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.858 -0.131 17635 5972 1 10 . 1 1 99 99 ASN H H 99 8.336 8.336 8.439 -0.103 17635 5973 1 10 . 1 1 100 100 ARG N N 100 121.374 121.374 121.978 -0.604 17635 5974 1 10 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.445 -0.172 17635 5975 1 10 . 1 1 100 100 ARG C C 100 173.627 173.627 174.881 -1.254 17635 5976 1 10 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.645 -0.153 17635 5977 1 10 . 1 1 100 100 ARG CB C 100 30.519 30.519 31.240 -0.721 17635 5978 1 10 . 1 1 100 100 ARG H H 100 8.181 8.181 8.475 -0.294 17635 5979 1 10 . 1 1 101 101 GLY N N 101 109.586 109.586 108.929 0.657 17635 5980 1 10 . 1 1 101 101 GLY C C 101 175.739 175.739 173.198 2.541 17635 5981 1 10 . 1 1 101 101 GLY CA C 101 45.380 45.380 45.469 -0.089 17635 5982 1 10 . 1 1 101 101 GLY H H 101 8.413 8.413 8.051 0.362 17635 5983 1 10 . 1 1 102 102 GLY N N 102 108.692 108.692 110.100 -1.408 17635 5984 1 10 . 1 1 102 102 GLY C C 102 176.286 176.286 173.523 2.763 17635 5985 1 10 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.513 -0.175 17635 5986 1 10 . 1 1 102 102 GLY H H 102 8.281 8.281 8.156 0.125 17635 5987 1 10 . 1 1 103 103 GLY N N 103 108.844 108.844 109.263 -0.419 17635 5988 1 10 . 1 1 103 103 GLY C C 103 175.798 175.798 173.190 2.608 17635 5989 1 10 . 1 1 103 103 GLY CA C 103 45.346 45.346 45.716 -0.370 17635 5990 1 10 . 1 1 103 103 GLY H H 103 8.364 8.364 7.994 0.370 17635 5991 1 10 . 1 1 104 104 ASN N N 104 118.527 118.527 119.906 -1.379 17635 5992 1 10 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.846 -0.128 17635 5993 1 10 . 1 1 104 104 ASN C C 104 174.547 174.547 175.566 -1.019 17635 5994 1 10 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.526 0.683 17635 5995 1 10 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.676 0.203 17635 5996 1 10 . 1 1 104 104 ASN H H 104 8.438 8.438 8.748 -0.310 17635 5997 1 10 . 1 1 105 105 GLY N N 105 109.166 109.166 108.359 0.807 17635 5998 1 10 . 1 1 105 105 GLY C C 105 176.074 176.074 173.816 2.258 17635 5999 1 10 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.480 0.122 17635 6000 1 10 . 1 1 105 105 GLY H H 105 8.477 8.477 8.160 0.317 17635 6001 1 10 . 1 1 106 106 ARG N N 106 120.341 120.341 120.129 0.212 17635 6002 1 10 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.481 -0.130 17635 6003 1 10 . 1 1 106 106 ARG C C 106 173.491 173.491 176.973 -3.482 17635 6004 1 10 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.167 1.060 17635 6005 1 10 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.679 -0.050 17635 6006 1 10 . 1 1 106 106 ARG H H 106 8.244 8.244 7.739 0.505 17635 6007 1 10 . 1 1 107 107 GLY N N 107 109.856 109.856 115.893 -6.037 17635 6008 1 10 . 1 1 107 107 GLY C C 107 175.834 175.834 174.722 1.112 17635 6009 1 10 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.840 0.601 17635 6010 1 10 . 1 1 107 107 GLY H H 107 8.522 8.522 9.004 -0.482 17635 6011 1 11 . 1 1 2 2 GLN N N 2 121.692 121.692 119.871 1.821 17635 6012 1 11 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.269 -0.003 17635 6013 1 11 . 1 1 2 2 GLN C C 2 175.248 175.248 174.849 0.399 17635 6014 1 11 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.190 -0.194 17635 6015 1 11 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.417 0.222 17635 6016 1 11 . 1 1 2 2 GLN H H 2 8.621 8.621 8.340 0.281 17635 6017 1 11 . 1 1 3 3 ASP N N 3 121.801 121.801 125.239 -3.438 17635 6018 1 11 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.646 -0.078 17635 6019 1 11 . 1 1 3 3 ASP C C 3 174.336 174.336 175.449 -1.113 17635 6020 1 11 . 1 1 3 3 ASP CA C 3 54.062 54.062 53.745 0.318 17635 6021 1 11 . 1 1 3 3 ASP CB C 3 41.071 41.071 39.515 1.556 17635 6022 1 11 . 1 1 3 3 ASP H H 3 8.436 8.436 8.607 -0.171 17635 6023 1 11 . 1 1 4 4 ASN N N 4 120.292 120.292 121.904 -1.612 17635 6024 1 11 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.892 -0.255 17635 6025 1 11 . 1 1 4 4 ASN C C 4 174.415 174.415 174.967 -0.552 17635 6026 1 11 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.606 1.255 17635 6027 1 11 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.683 -0.149 17635 6028 1 11 . 1 1 4 4 ASN H H 4 8.528 8.528 8.126 0.402 17635 6029 1 11 . 1 1 5 5 SER N N 5 117.091 117.091 116.526 0.565 17635 6030 1 11 . 1 1 5 5 SER HA H 5 4.163 4.163 4.654 -0.491 17635 6031 1 11 . 1 1 5 5 SER C C 5 176.370 176.370 173.591 2.779 17635 6032 1 11 . 1 1 5 5 SER CA C 5 60.846 60.846 58.449 2.397 17635 6033 1 11 . 1 1 5 5 SER CB C 5 63.136 63.136 63.309 -0.173 17635 6034 1 11 . 1 1 5 5 SER H H 5 8.470 8.470 8.611 -0.141 17635 6035 1 11 . 1 1 6 6 ASP N N 6 119.436 119.436 118.452 0.984 17635 6036 1 11 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.648 0.047 17635 6037 1 11 . 1 1 6 6 ASP C C 6 175.048 175.048 175.057 -0.009 17635 6038 1 11 . 1 1 6 6 ASP CA C 6 53.094 53.094 52.302 0.792 17635 6039 1 11 . 1 1 6 6 ASP CB C 6 40.935 40.935 39.550 1.385 17635 6040 1 11 . 1 1 6 6 ASP H H 6 8.218 8.218 7.950 0.268 17635 6041 1 11 . 1 1 7 7 ASN N N 7 119.696 119.696 118.766 0.930 17635 6042 1 11 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.582 0.046 17635 6043 1 11 . 1 1 7 7 ASN C C 7 176.539 176.539 176.301 0.238 17635 6044 1 11 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.698 -0.540 17635 6045 1 11 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.953 -0.094 17635 6046 1 11 . 1 1 7 7 ASN H H 7 7.734 7.734 7.958 -0.224 17635 6047 1 11 . 1 1 8 8 ASN N N 8 119.436 119.436 117.214 2.222 17635 6048 1 11 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.487 0.381 17635 6049 1 11 . 1 1 8 8 ASN C C 8 175.327 175.327 175.178 0.149 17635 6050 1 11 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.867 -1.663 17635 6051 1 11 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.483 0.012 17635 6052 1 11 . 1 1 8 8 ASN H H 8 8.350 8.350 8.463 -0.113 17635 6053 1 11 . 1 1 9 9 THR N N 9 118.650 118.650 114.429 4.221 17635 6054 1 11 . 1 1 9 9 THR HA H 9 5.557 5.557 4.541 1.016 17635 6055 1 11 . 1 1 9 9 THR C C 9 177.117 177.117 174.374 2.743 17635 6056 1 11 . 1 1 9 9 THR CA C 9 62.314 62.314 64.615 -2.301 17635 6057 1 11 . 1 1 9 9 THR CB C 9 71.225 71.225 68.916 2.309 17635 6058 1 11 . 1 1 9 9 THR H H 9 8.428 8.428 7.448 0.980 17635 6059 1 11 . 1 1 10 10 ILE N N 10 118.556 118.556 122.124 -3.568 17635 6060 1 11 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.171 -0.006 17635 6061 1 11 . 1 1 10 10 ILE C C 10 176.837 176.837 174.487 2.350 17635 6062 1 11 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.706 0.591 17635 6063 1 11 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.762 -1.882 17635 6064 1 11 . 1 1 10 10 ILE H H 10 8.770 8.770 8.946 -0.176 17635 6065 1 11 . 1 1 11 11 PHE N N 11 123.798 123.798 119.502 4.296 17635 6066 1 11 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.140 0.280 17635 6067 1 11 . 1 1 11 11 PHE C C 11 177.066 177.066 173.375 3.691 17635 6068 1 11 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.695 -0.333 17635 6069 1 11 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.051 0.817 17635 6070 1 11 . 1 1 11 11 PHE H H 11 9.548 9.548 8.283 1.265 17635 6071 1 11 . 1 1 12 12 VAL N N 12 127.993 127.993 126.288 1.705 17635 6072 1 11 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.671 0.287 17635 6073 1 11 . 1 1 12 12 VAL C C 12 176.965 176.965 174.942 2.023 17635 6074 1 11 . 1 1 12 12 VAL CA C 12 59.835 59.835 60.915 -1.080 17635 6075 1 11 . 1 1 12 12 VAL CB C 12 34.800 34.800 33.530 1.270 17635 6076 1 11 . 1 1 12 12 VAL H H 12 8.940 8.940 9.093 -0.153 17635 6077 1 11 . 1 1 13 13 GLN N N 13 122.289 122.289 126.558 -4.269 17635 6078 1 11 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.514 0.265 17635 6079 1 11 . 1 1 13 13 GLN C C 13 175.631 175.631 175.592 0.039 17635 6080 1 11 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.139 -0.029 17635 6081 1 11 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.123 4.009 17635 6082 1 11 . 1 1 13 13 GLN H H 13 8.747 8.747 8.212 0.535 17635 6083 1 11 . 1 1 14 14 GLY N N 14 109.212 109.212 111.971 -2.759 17635 6084 1 11 . 1 1 14 14 GLY C C 14 175.436 175.436 173.773 1.663 17635 6085 1 11 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.152 0.278 17635 6086 1 11 . 1 1 14 14 GLY H H 14 8.236 8.236 8.444 -0.208 17635 6087 1 11 . 1 1 15 15 LEU N N 15 117.824 117.824 122.608 -4.784 17635 6088 1 11 . 1 1 15 15 LEU HA H 15 3.706 3.706 3.490 0.216 17635 6089 1 11 . 1 1 15 15 LEU C C 15 174.111 174.111 176.304 -2.193 17635 6090 1 11 . 1 1 15 15 LEU CA C 15 55.718 55.718 57.859 -2.141 17635 6091 1 11 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.594 0.839 17635 6092 1 11 . 1 1 15 15 LEU H H 15 8.442 8.442 8.429 0.013 17635 6093 1 11 . 1 1 16 16 GLY N N 16 105.063 105.063 103.872 1.191 17635 6094 1 11 . 1 1 16 16 GLY C C 16 177.771 177.771 173.764 4.007 17635 6095 1 11 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.228 -0.134 17635 6096 1 11 . 1 1 16 16 GLY H H 16 8.006 8.006 7.611 0.395 17635 6097 1 11 . 1 1 17 17 GLU N N 17 113.781 113.781 119.250 -5.469 17635 6098 1 11 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.963 0.156 17635 6099 1 11 . 1 1 17 17 GLU C C 17 173.937 173.937 176.562 -2.625 17635 6100 1 11 . 1 1 17 17 GLU CA C 17 57.281 57.281 58.670 -1.389 17635 6101 1 11 . 1 1 17 17 GLU CB C 17 30.436 30.436 28.395 2.041 17635 6102 1 11 . 1 1 17 17 GLU H H 17 8.134 8.134 8.842 -0.708 17635 6103 1 11 . 1 1 18 18 ASN N N 18 116.660 116.660 113.222 3.438 17635 6104 1 11 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.589 0.352 17635 6105 1 11 . 1 1 18 18 ASN C C 18 175.900 175.900 173.978 1.922 17635 6106 1 11 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.288 0.190 17635 6107 1 11 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.260 -0.775 17635 6108 1 11 . 1 1 18 18 ASN H H 18 8.407 8.407 7.813 0.594 17635 6109 1 11 . 1 1 19 19 VAL N N 19 118.323 118.323 121.886 -3.563 17635 6110 1 11 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.984 0.168 17635 6111 1 11 . 1 1 19 19 VAL C C 19 177.655 177.655 174.970 2.685 17635 6112 1 11 . 1 1 19 19 VAL CA C 19 61.877 61.877 62.240 -0.363 17635 6113 1 11 . 1 1 19 19 VAL CB C 19 32.513 32.513 29.141 3.372 17635 6114 1 11 . 1 1 19 19 VAL H H 19 6.855 6.855 7.924 -1.069 17635 6115 1 11 . 1 1 20 20 THR N N 20 111.636 111.636 115.083 -3.447 17635 6116 1 11 . 1 1 20 20 THR HA H 20 4.719 4.719 4.570 0.149 17635 6117 1 11 . 1 1 20 20 THR C C 20 175.266 175.266 175.042 0.224 17635 6118 1 11 . 1 1 20 20 THR CA C 20 58.698 58.698 59.645 -0.947 17635 6119 1 11 . 1 1 20 20 THR CB C 20 72.948 72.948 72.208 0.740 17635 6120 1 11 . 1 1 20 20 THR H H 20 7.328 7.328 8.014 -0.686 17635 6121 1 11 . 1 1 21 21 ILE N N 21 122.147 122.147 123.459 -1.312 17635 6122 1 11 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.750 -0.232 17635 6123 1 11 . 1 1 21 21 ILE C C 21 173.198 173.198 177.462 -4.264 17635 6124 1 11 . 1 1 21 21 ILE CA C 21 65.772 65.772 63.406 2.366 17635 6125 1 11 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.227 0.356 17635 6126 1 11 . 1 1 21 21 ILE H H 21 9.074 9.074 8.652 0.422 17635 6127 1 11 . 1 1 22 22 GLU N N 22 118.154 118.154 119.923 -1.769 17635 6128 1 11 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.010 -0.024 17635 6129 1 11 . 1 1 22 22 GLU C C 22 171.799 171.799 178.687 -6.888 17635 6130 1 11 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.502 1.111 17635 6131 1 11 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.330 0.461 17635 6132 1 11 . 1 1 22 22 GLU H H 22 8.814 8.814 8.477 0.337 17635 6133 1 11 . 1 1 23 23 SER N N 23 115.921 115.921 114.389 1.532 17635 6134 1 11 . 1 1 23 23 SER HA H 23 4.384 4.384 4.291 0.093 17635 6135 1 11 . 1 1 23 23 SER C C 23 172.447 172.447 176.268 -3.821 17635 6136 1 11 . 1 1 23 23 SER CA C 23 61.239 61.239 61.501 -0.262 17635 6137 1 11 . 1 1 23 23 SER CB C 23 62.838 62.838 62.764 0.074 17635 6138 1 11 . 1 1 23 23 SER H H 23 8.236 8.236 8.051 0.185 17635 6139 1 11 . 1 1 24 24 VAL N N 24 124.867 124.867 120.845 4.022 17635 6140 1 11 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.042 -0.294 17635 6141 1 11 . 1 1 24 24 VAL C C 24 173.016 173.016 177.555 -4.539 17635 6142 1 11 . 1 1 24 24 VAL CA C 24 67.254 67.254 64.755 2.499 17635 6143 1 11 . 1 1 24 24 VAL CB C 24 31.533 31.533 30.988 0.545 17635 6144 1 11 . 1 1 24 24 VAL H H 24 7.973 7.973 7.920 0.053 17635 6145 1 11 . 1 1 25 25 ALA N N 25 123.198 123.198 121.647 1.551 17635 6146 1 11 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.026 -0.127 17635 6147 1 11 . 1 1 25 25 ALA C C 25 171.061 171.061 178.756 -7.695 17635 6148 1 11 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.698 0.997 17635 6149 1 11 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.431 -0.693 17635 6150 1 11 . 1 1 25 25 ALA H H 25 8.695 8.695 8.517 0.178 17635 6151 1 11 . 1 1 26 26 ASP N N 26 115.503 115.503 118.213 -2.710 17635 6152 1 11 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.536 -0.213 17635 6153 1 11 . 1 1 26 26 ASP C C 26 173.108 173.108 178.494 -5.386 17635 6154 1 11 . 1 1 26 26 ASP CA C 26 57.323 57.323 57.325 -0.002 17635 6155 1 11 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.308 -0.256 17635 6156 1 11 . 1 1 26 26 ASP H H 26 8.312 8.312 8.074 0.238 17635 6157 1 11 . 1 1 27 27 TYR N N 27 119.224 119.224 118.773 0.451 17635 6158 1 11 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.577 -0.377 17635 6159 1 11 . 1 1 27 27 TYR C C 27 172.908 172.908 176.517 -3.609 17635 6160 1 11 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.851 2.165 17635 6161 1 11 . 1 1 27 27 TYR CB C 27 39.932 39.932 38.908 1.024 17635 6162 1 11 . 1 1 27 27 TYR H H 27 7.533 7.533 7.912 -0.379 17635 6163 1 11 . 1 1 28 28 PHE N N 28 112.595 112.595 119.090 -6.495 17635 6164 1 11 . 1 1 28 28 PHE HA H 28 4.330 4.330 3.926 0.404 17635 6165 1 11 . 1 1 28 28 PHE C C 28 173.082 173.082 174.573 -1.491 17635 6166 1 11 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.444 6.340 17635 6167 1 11 . 1 1 28 28 PHE CB C 28 40.003 40.003 37.343 2.660 17635 6168 1 11 . 1 1 28 28 PHE H H 28 7.974 7.974 7.914 0.060 17635 6169 1 11 . 1 1 29 29 LYS N N 29 118.820 118.820 118.048 0.772 17635 6170 1 11 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.821 0.096 17635 6171 1 11 . 1 1 29 29 LYS C C 29 173.682 173.682 177.136 -3.454 17635 6172 1 11 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.262 3.018 17635 6173 1 11 . 1 1 29 29 LYS CB C 29 31.291 31.291 33.007 -1.716 17635 6174 1 11 . 1 1 29 29 LYS H H 29 8.325 8.325 7.594 0.731 17635 6175 1 11 . 1 1 30 30 GLN N N 30 116.232 116.232 117.951 -1.719 17635 6176 1 11 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.258 -0.123 17635 6177 1 11 . 1 1 30 30 GLN C C 30 173.790 173.790 177.626 -3.836 17635 6178 1 11 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.684 -0.138 17635 6179 1 11 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.583 1.315 17635 6180 1 11 . 1 1 30 30 GLN H H 30 7.518 7.518 7.761 -0.243 17635 6181 1 11 . 1 1 31 31 ILE N N 31 116.489 116.489 119.562 -3.073 17635 6182 1 11 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.985 0.254 17635 6183 1 11 . 1 1 31 31 ILE C C 31 175.599 175.599 175.350 0.249 17635 6184 1 11 . 1 1 31 31 ILE CA C 31 58.221 58.221 62.369 -4.148 17635 6185 1 11 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.117 2.216 17635 6186 1 11 . 1 1 31 31 ILE H H 31 7.809 7.809 8.278 -0.469 17635 6187 1 11 . 1 1 32 32 GLY N N 32 107.416 107.416 103.659 3.757 17635 6188 1 11 . 1 1 32 32 GLY C C 32 180.182 180.182 172.409 7.773 17635 6189 1 11 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.748 0.245 17635 6190 1 11 . 1 1 32 32 GLY H H 32 7.344 7.344 7.549 -0.205 17635 6191 1 11 . 1 1 33 33 ILE N N 33 117.784 117.784 120.220 -2.436 17635 6192 1 11 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.415 -0.326 17635 6193 1 11 . 1 1 33 33 ILE C C 33 173.301 173.301 175.333 -2.032 17635 6194 1 11 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.721 0.920 17635 6195 1 11 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.693 -1.034 17635 6196 1 11 . 1 1 33 33 ILE H H 33 8.173 8.173 8.495 -0.322 17635 6197 1 11 . 1 1 34 34 ILE N N 34 131.781 131.781 125.946 5.835 17635 6198 1 11 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.244 -0.457 17635 6199 1 11 . 1 1 34 34 ILE C C 34 174.663 174.663 176.019 -1.356 17635 6200 1 11 . 1 1 34 34 ILE CA C 34 61.370 61.370 59.600 1.770 17635 6201 1 11 . 1 1 34 34 ILE CB C 34 37.995 37.995 39.175 -1.180 17635 6202 1 11 . 1 1 34 34 ILE H H 34 8.687 8.687 8.441 0.246 17635 6203 1 11 . 1 1 35 35 LYS N N 35 130.372 130.372 128.153 2.219 17635 6204 1 11 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.372 -0.288 17635 6205 1 11 . 1 1 35 35 LYS C C 35 175.376 175.376 176.791 -1.415 17635 6206 1 11 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.090 0.383 17635 6207 1 11 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.240 2.424 17635 6208 1 11 . 1 1 35 35 LYS H H 35 8.680 8.680 8.690 -0.010 17635 6209 1 11 . 1 1 36 36 THR N N 36 118.312 118.312 118.941 -0.629 17635 6210 1 11 . 1 1 36 36 THR HA H 36 4.415 4.415 4.307 0.108 17635 6211 1 11 . 1 1 36 36 THR C C 36 176.394 176.394 174.652 1.742 17635 6212 1 11 . 1 1 36 36 THR CA C 36 61.340 61.340 60.748 0.592 17635 6213 1 11 . 1 1 36 36 THR CB C 36 70.809 70.809 70.331 0.478 17635 6214 1 11 . 1 1 36 36 THR H H 36 8.456 8.456 8.235 0.221 17635 6215 1 11 . 1 1 37 37 ASN N N 37 124.092 124.092 125.234 -1.142 17635 6216 1 11 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.555 -0.025 17635 6217 1 11 . 1 1 37 37 ASN C C 37 174.235 174.235 176.448 -2.213 17635 6218 1 11 . 1 1 37 37 ASN CA C 37 53.064 53.064 53.627 -0.562 17635 6219 1 11 . 1 1 37 37 ASN CB C 37 38.927 38.927 38.837 0.090 17635 6220 1 11 . 1 1 37 37 ASN H H 37 8.794 8.794 8.957 -0.163 17635 6221 1 11 . 1 1 38 38 LYS N N 38 127.969 127.969 125.048 2.921 17635 6222 1 11 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.031 -0.027 17635 6223 1 11 . 1 1 38 38 LYS C C 38 172.702 172.702 176.875 -4.173 17635 6224 1 11 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.840 -0.382 17635 6225 1 11 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.626 0.541 17635 6226 1 11 . 1 1 38 38 LYS H H 38 8.962 8.962 8.287 0.675 17635 6227 1 11 . 1 1 39 39 LYS N N 39 117.413 117.413 117.661 -0.248 17635 6228 1 11 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.393 -0.135 17635 6229 1 11 . 1 1 39 39 LYS C C 39 172.261 172.261 177.499 -5.238 17635 6230 1 11 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.972 0.347 17635 6231 1 11 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.903 -0.106 17635 6232 1 11 . 1 1 39 39 LYS H H 39 8.314 8.314 7.846 0.468 17635 6233 1 11 . 1 1 40 40 THR N N 40 105.547 105.547 108.780 -3.233 17635 6234 1 11 . 1 1 40 40 THR HA H 40 4.465 4.465 4.469 -0.004 17635 6235 1 11 . 1 1 40 40 THR C C 40 174.021 174.021 176.260 -2.239 17635 6236 1 11 . 1 1 40 40 THR CA C 40 61.260 61.260 62.103 -0.843 17635 6237 1 11 . 1 1 40 40 THR CB C 40 70.997 70.997 70.466 0.531 17635 6238 1 11 . 1 1 40 40 THR H H 40 7.422 7.422 7.775 -0.353 17635 6239 1 11 . 1 1 41 41 GLY N N 41 111.631 111.631 112.761 -1.130 17635 6240 1 11 . 1 1 41 41 GLY C C 41 176.727 176.727 173.604 3.123 17635 6241 1 11 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.591 0.139 17635 6242 1 11 . 1 1 41 41 GLY H H 41 8.644 8.644 8.922 -0.278 17635 6243 1 11 . 1 1 42 42 GLN N N 42 118.894 118.894 118.515 0.379 17635 6244 1 11 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.810 -0.141 17635 6245 1 11 . 1 1 42 42 GLN C C 42 177.178 177.178 173.408 3.770 17635 6246 1 11 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.249 1.331 17635 6247 1 11 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.392 -0.162 17635 6248 1 11 . 1 1 42 42 GLN H H 42 7.662 7.662 7.603 0.059 17635 6249 1 11 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.275 0.320 17635 6250 1 11 . 1 1 43 43 PRO C C 43 172.629 172.629 176.312 -3.683 17635 6251 1 11 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.916 -1.094 17635 6252 1 11 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.115 0.581 17635 6253 1 11 . 1 1 44 44 MET N N 44 124.162 124.162 122.472 1.690 17635 6254 1 11 . 1 1 44 44 MET HA H 44 4.432 4.432 4.626 -0.194 17635 6255 1 11 . 1 1 44 44 MET C C 44 176.474 176.474 175.198 1.276 17635 6256 1 11 . 1 1 44 44 MET CA C 44 55.419 55.419 55.145 0.273 17635 6257 1 11 . 1 1 44 44 MET CB C 44 30.555 30.555 34.554 -3.999 17635 6258 1 11 . 1 1 44 44 MET H H 44 8.874 8.874 8.587 0.287 17635 6259 1 11 . 1 1 45 45 ILE N N 45 126.237 126.237 123.300 2.937 17635 6260 1 11 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.494 0.308 17635 6261 1 11 . 1 1 45 45 ILE C C 45 176.415 176.415 174.440 1.975 17635 6262 1 11 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.112 -0.896 17635 6263 1 11 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.169 0.058 17635 6264 1 11 . 1 1 45 45 ILE H H 45 7.730 7.730 8.403 -0.673 17635 6265 1 11 . 1 1 46 46 ASN N N 46 124.735 124.735 123.820 0.915 17635 6266 1 11 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.002 -0.061 17635 6267 1 11 . 1 1 46 46 ASN C C 46 176.836 176.836 173.742 3.094 17635 6268 1 11 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.286 -0.725 17635 6269 1 11 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.192 0.278 17635 6270 1 11 . 1 1 46 46 ASN H H 46 8.384 8.384 8.885 -0.501 17635 6271 1 11 . 1 1 47 47 LEU N N 47 122.487 122.487 120.279 2.208 17635 6272 1 11 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.659 0.056 17635 6273 1 11 . 1 1 47 47 LEU C C 47 174.190 174.190 175.796 -1.606 17635 6274 1 11 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.903 -0.571 17635 6275 1 11 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.944 -2.667 17635 6276 1 11 . 1 1 47 47 LEU H H 47 8.594 8.594 8.206 0.388 17635 6277 1 11 . 1 1 48 48 TYR N N 48 121.842 121.842 121.133 0.709 17635 6278 1 11 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.875 -0.108 17635 6279 1 11 . 1 1 48 48 TYR C C 48 173.649 173.649 174.690 -1.041 17635 6280 1 11 . 1 1 48 48 TYR CA C 48 57.894 57.894 57.233 0.661 17635 6281 1 11 . 1 1 48 48 TYR CB C 48 39.199 39.199 41.739 -2.540 17635 6282 1 11 . 1 1 48 48 TYR H H 48 7.666 7.666 8.491 -0.825 17635 6283 1 11 . 1 1 49 49 THR N N 49 116.554 116.554 111.944 4.610 17635 6284 1 11 . 1 1 49 49 THR HA H 49 4.806 4.806 4.642 0.164 17635 6285 1 11 . 1 1 49 49 THR C C 49 176.654 176.654 173.625 3.029 17635 6286 1 11 . 1 1 49 49 THR CA C 49 60.693 60.693 59.103 1.590 17635 6287 1 11 . 1 1 49 49 THR CB C 49 71.437 71.437 71.599 -0.162 17635 6288 1 11 . 1 1 49 49 THR H H 49 8.965 8.965 8.240 0.725 17635 6289 1 11 . 1 1 50 50 ASP N N 50 123.826 123.826 120.736 3.090 17635 6290 1 11 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.483 0.141 17635 6291 1 11 . 1 1 50 50 ASP C C 50 173.380 173.380 176.970 -3.590 17635 6292 1 11 . 1 1 50 50 ASP CA C 50 54.088 54.088 55.375 -1.287 17635 6293 1 11 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.406 0.461 17635 6294 1 11 . 1 1 50 50 ASP H H 50 8.939 8.939 8.287 0.652 17635 6295 1 11 . 1 1 51 51 ARG N N 51 127.794 127.794 122.791 5.003 17635 6296 1 11 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.031 0.014 17635 6297 1 11 . 1 1 51 51 ARG C C 51 173.101 173.101 176.831 -3.730 17635 6298 1 11 . 1 1 51 51 ARG CA C 51 58.562 58.562 58.624 -0.062 17635 6299 1 11 . 1 1 51 51 ARG CB C 51 30.167 30.167 30.457 -0.290 17635 6300 1 11 . 1 1 51 51 ARG H H 51 8.958 8.958 8.794 0.164 17635 6301 1 11 . 1 1 52 52 GLU N N 52 117.542 117.542 112.865 4.677 17635 6302 1 11 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.323 -0.045 17635 6303 1 11 . 1 1 52 52 GLU C C 52 172.201 172.201 176.556 -4.355 17635 6304 1 11 . 1 1 52 52 GLU CA C 52 58.524 58.524 56.420 2.104 17635 6305 1 11 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.113 0.165 17635 6306 1 11 . 1 1 52 52 GLU H H 52 8.561 8.561 8.464 0.097 17635 6307 1 11 . 1 1 53 53 THR N N 53 107.065 107.065 115.186 -8.121 17635 6308 1 11 . 1 1 53 53 THR HA H 53 4.436 4.436 4.126 0.310 17635 6309 1 11 . 1 1 53 53 THR C C 53 173.851 173.851 175.967 -2.116 17635 6310 1 11 . 1 1 53 53 THR CA C 53 61.944 61.944 64.349 -2.405 17635 6311 1 11 . 1 1 53 53 THR CB C 53 71.197 71.197 68.930 2.267 17635 6312 1 11 . 1 1 53 53 THR H H 53 8.087 8.087 8.299 -0.212 17635 6313 1 11 . 1 1 54 54 GLY N N 54 111.295 111.295 107.346 3.949 17635 6314 1 11 . 1 1 54 54 GLY C C 54 176.747 176.747 174.580 2.167 17635 6315 1 11 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.661 1.042 17635 6316 1 11 . 1 1 54 54 GLY H H 54 8.423 8.423 7.869 0.554 17635 6317 1 11 . 1 1 55 55 LYS N N 55 119.673 119.673 121.073 -1.400 17635 6318 1 11 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.251 0.102 17635 6319 1 11 . 1 1 55 55 LYS C C 55 173.854 173.854 176.158 -2.304 17635 6320 1 11 . 1 1 55 55 LYS CA C 55 55.842 55.842 57.159 -1.317 17635 6321 1 11 . 1 1 55 55 LYS CB C 55 33.821 33.821 32.950 0.871 17635 6322 1 11 . 1 1 55 55 LYS H H 55 7.767 7.767 8.040 -0.273 17635 6323 1 11 . 1 1 56 56 LEU N N 56 122.426 122.426 119.607 2.819 17635 6324 1 11 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.588 -0.232 17635 6325 1 11 . 1 1 56 56 LEU C C 56 172.534 172.534 176.749 -4.215 17635 6326 1 11 . 1 1 56 56 LEU CA C 56 56.255 56.255 53.511 2.744 17635 6327 1 11 . 1 1 56 56 LEU CB C 56 41.654 41.654 44.334 -2.680 17635 6328 1 11 . 1 1 56 56 LEU H H 56 8.768 8.768 8.289 0.479 17635 6329 1 11 . 1 1 57 57 LYS N N 57 118.264 118.264 121.562 -3.298 17635 6330 1 11 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.119 0.169 17635 6331 1 11 . 1 1 57 57 LYS C C 57 173.648 173.648 177.615 -3.967 17635 6332 1 11 . 1 1 57 57 LYS CA C 57 56.264 56.264 57.522 -1.258 17635 6333 1 11 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.885 1.177 17635 6334 1 11 . 1 1 57 57 LYS H H 57 8.012 8.012 8.367 -0.355 17635 6335 1 11 . 1 1 58 58 GLY N N 58 108.514 108.514 107.491 1.023 17635 6336 1 11 . 1 1 58 58 GLY C C 58 177.876 177.876 172.563 5.313 17635 6337 1 11 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.299 1.065 17635 6338 1 11 . 1 1 58 58 GLY H H 58 8.334 8.334 8.311 0.023 17635 6339 1 11 . 1 1 59 59 GLU N N 59 116.119 116.119 116.706 -0.587 17635 6340 1 11 . 1 1 59 59 GLU HA H 59 5.521 5.521 4.846 0.675 17635 6341 1 11 . 1 1 59 59 GLU C C 59 173.860 173.860 173.659 0.201 17635 6342 1 11 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.674 -1.649 17635 6343 1 11 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.581 0.723 17635 6344 1 11 . 1 1 59 59 GLU H H 59 7.202 7.202 7.625 -0.423 17635 6345 1 11 . 1 1 60 60 ALA N N 60 123.607 123.607 121.951 1.656 17635 6346 1 11 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.908 0.699 17635 6347 1 11 . 1 1 60 60 ALA C C 60 173.923 173.923 175.169 -1.246 17635 6348 1 11 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.944 -1.001 17635 6349 1 11 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.150 0.909 17635 6350 1 11 . 1 1 60 60 ALA H H 60 8.930 8.930 9.032 -0.102 17635 6351 1 11 . 1 1 61 61 THR N N 61 108.384 108.384 113.802 -5.418 17635 6352 1 11 . 1 1 61 61 THR HA H 61 5.743 5.743 4.950 0.793 17635 6353 1 11 . 1 1 61 61 THR C C 61 176.172 176.172 174.012 2.160 17635 6354 1 11 . 1 1 61 61 THR CA C 61 59.625 59.625 60.579 -0.954 17635 6355 1 11 . 1 1 61 61 THR CB C 61 71.224 71.224 70.461 0.763 17635 6356 1 11 . 1 1 61 61 THR H H 61 8.452 8.452 8.856 -0.404 17635 6357 1 11 . 1 1 62 62 VAL N N 62 120.200 120.200 125.437 -5.237 17635 6358 1 11 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.337 -0.093 17635 6359 1 11 . 1 1 62 62 VAL C C 62 175.994 175.994 175.135 0.859 17635 6360 1 11 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.378 0.048 17635 6361 1 11 . 1 1 62 62 VAL CB C 62 34.685 34.685 34.542 0.143 17635 6362 1 11 . 1 1 62 62 VAL H H 62 8.071 8.071 8.567 -0.496 17635 6363 1 11 . 1 1 63 63 SER N N 63 121.689 121.689 123.458 -1.769 17635 6364 1 11 . 1 1 63 63 SER HA H 63 5.261 5.261 4.746 0.515 17635 6365 1 11 . 1 1 63 63 SER C C 63 177.943 177.943 172.881 5.062 17635 6366 1 11 . 1 1 63 63 SER CA C 63 57.662 57.662 58.574 -0.912 17635 6367 1 11 . 1 1 63 63 SER CB C 63 64.427 64.427 64.433 -0.006 17635 6368 1 11 . 1 1 63 63 SER H H 63 7.695 7.695 8.248 -0.553 17635 6369 1 11 . 1 1 64 64 PHE N N 64 122.640 122.640 120.252 2.388 17635 6370 1 11 . 1 1 64 64 PHE HA H 64 4.854 4.854 5.043 -0.189 17635 6371 1 11 . 1 1 64 64 PHE C C 64 174.605 174.605 176.008 -1.403 17635 6372 1 11 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.167 1.037 17635 6373 1 11 . 1 1 64 64 PHE CB C 64 41.976 41.976 43.123 -1.147 17635 6374 1 11 . 1 1 64 64 PHE H H 64 9.025 9.025 8.567 0.458 17635 6375 1 11 . 1 1 65 65 ASP N N 65 119.943 119.943 122.480 -2.537 17635 6376 1 11 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.540 -0.105 17635 6377 1 11 . 1 1 65 65 ASP C C 65 174.396 174.396 176.328 -1.932 17635 6378 1 11 . 1 1 65 65 ASP CA C 65 57.442 57.442 57.138 0.304 17635 6379 1 11 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.498 0.536 17635 6380 1 11 . 1 1 65 65 ASP H H 65 8.512 8.512 8.780 -0.268 17635 6381 1 11 . 1 1 66 66 ASP N N 66 116.125 116.125 118.261 -2.136 17635 6382 1 11 . 1 1 66 66 ASP HA H 66 5.399 5.399 4.979 0.420 17635 6383 1 11 . 1 1 66 66 ASP C C 66 175.936 175.936 175.201 0.735 17635 6384 1 11 . 1 1 66 66 ASP CA C 66 50.793 50.793 52.482 -1.689 17635 6385 1 11 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.005 0.914 17635 6386 1 11 . 1 1 66 66 ASP H H 66 8.323 8.323 8.161 0.162 17635 6387 1 11 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.287 0.163 17635 6388 1 11 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.674 0.250 17635 6389 1 11 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.238 -0.408 17635 6390 1 11 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.234 0.185 17635 6391 1 11 . 1 1 68 68 PRO C C 68 171.345 171.345 179.017 -7.672 17635 6392 1 11 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.868 0.367 17635 6393 1 11 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.943 0.054 17635 6394 1 11 . 1 1 69 69 SER N N 69 114.544 114.544 114.240 0.304 17635 6395 1 11 . 1 1 69 69 SER HA H 69 4.036 4.036 3.863 0.173 17635 6396 1 11 . 1 1 69 69 SER C C 69 176.535 176.535 175.726 0.809 17635 6397 1 11 . 1 1 69 69 SER CA C 69 61.837 61.837 61.250 0.587 17635 6398 1 11 . 1 1 69 69 SER CB C 69 62.773 62.773 62.392 0.380 17635 6399 1 11 . 1 1 69 69 SER H H 69 8.004 8.004 8.144 -0.140 17635 6400 1 11 . 1 1 70 70 ALA N N 70 122.649 122.649 123.725 -1.076 17635 6401 1 11 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.286 0.307 17635 6402 1 11 . 1 1 70 70 ALA C C 70 172.686 172.686 179.143 -6.457 17635 6403 1 11 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.117 -0.081 17635 6404 1 11 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.148 -0.284 17635 6405 1 11 . 1 1 70 70 ALA H H 70 7.383 7.383 7.395 -0.012 17635 6406 1 11 . 1 1 71 71 LYS N N 71 116.308 116.308 119.593 -3.285 17635 6407 1 11 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.918 -0.143 17635 6408 1 11 . 1 1 71 71 LYS C C 71 172.333 172.333 178.314 -5.981 17635 6409 1 11 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.690 0.312 17635 6410 1 11 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.720 0.722 17635 6411 1 11 . 1 1 71 71 LYS H H 71 7.159 7.159 7.366 -0.207 17635 6412 1 11 . 1 1 72 72 ALA N N 72 119.806 119.806 120.770 -0.964 17635 6413 1 11 . 1 1 72 72 ALA HA H 72 4.166 4.166 3.929 0.237 17635 6414 1 11 . 1 1 72 72 ALA C C 72 170.530 170.530 179.522 -8.992 17635 6415 1 11 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.728 -0.013 17635 6416 1 11 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.775 0.045 17635 6417 1 11 . 1 1 72 72 ALA H H 72 7.924 7.924 7.908 0.016 17635 6418 1 11 . 1 1 73 73 ALA N N 73 120.524 120.524 120.631 -0.107 17635 6419 1 11 . 1 1 73 73 ALA HA H 73 4.279 4.279 3.330 0.949 17635 6420 1 11 . 1 1 73 73 ALA C C 73 171.039 171.039 179.074 -8.035 17635 6421 1 11 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.392 0.987 17635 6422 1 11 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.509 0.622 17635 6423 1 11 . 1 1 73 73 ALA H H 73 8.104 8.104 7.448 0.656 17635 6424 1 11 . 1 1 74 74 ILE N N 74 119.875 119.875 118.815 1.060 17635 6425 1 11 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.429 -0.015 17635 6426 1 11 . 1 1 74 74 ILE C C 74 172.435 172.435 178.290 -5.855 17635 6427 1 11 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.451 0.394 17635 6428 1 11 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.281 1.462 17635 6429 1 11 . 1 1 74 74 ILE H H 74 7.574 7.574 8.142 -0.568 17635 6430 1 11 . 1 1 75 75 ASP N N 75 117.867 117.867 117.018 0.849 17635 6431 1 11 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.331 -0.020 17635 6432 1 11 . 1 1 75 75 ASP C C 75 172.054 172.054 176.407 -4.353 17635 6433 1 11 . 1 1 75 75 ASP CA C 75 57.161 57.161 57.337 -0.176 17635 6434 1 11 . 1 1 75 75 ASP CB C 75 40.531 40.531 40.574 -0.043 17635 6435 1 11 . 1 1 75 75 ASP H H 75 7.937 7.937 8.276 -0.339 17635 6436 1 11 . 1 1 76 76 TRP N N 76 117.313 117.313 119.622 -2.309 17635 6437 1 11 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.595 -0.239 17635 6438 1 11 . 1 1 76 76 TRP C C 76 173.272 173.272 177.321 -4.049 17635 6439 1 11 . 1 1 76 76 TRP CA C 76 59.462 59.462 57.139 2.324 17635 6440 1 11 . 1 1 76 76 TRP CB C 76 30.777 30.777 30.158 0.619 17635 6441 1 11 . 1 1 76 76 TRP H H 76 8.475 8.475 7.500 0.975 17635 6442 1 11 . 1 1 77 77 PHE N N 77 112.019 112.019 117.530 -5.511 17635 6443 1 11 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.221 0.427 17635 6444 1 11 . 1 1 77 77 PHE C C 77 173.747 173.747 177.220 -3.473 17635 6445 1 11 . 1 1 77 77 PHE CA C 77 59.921 59.921 58.373 1.548 17635 6446 1 11 . 1 1 77 77 PHE CB C 77 40.730 40.730 37.690 3.040 17635 6447 1 11 . 1 1 77 77 PHE H H 77 8.488 8.488 7.598 0.890 17635 6448 1 11 . 1 1 78 78 ASP N N 78 118.408 118.408 120.541 -2.133 17635 6449 1 11 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.641 -0.177 17635 6450 1 11 . 1 1 78 78 ASP C C 78 172.542 172.542 176.688 -4.146 17635 6451 1 11 . 1 1 78 78 ASP CA C 78 58.690 58.690 54.214 4.476 17635 6452 1 11 . 1 1 78 78 ASP CB C 78 41.886 41.886 38.825 3.062 17635 6453 1 11 . 1 1 78 78 ASP H H 78 7.978 7.978 7.832 0.146 17635 6454 1 11 . 1 1 79 79 GLY N N 79 115.548 115.548 109.815 5.733 17635 6455 1 11 . 1 1 79 79 GLY C C 79 175.680 175.680 174.330 1.350 17635 6456 1 11 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.977 1.095 17635 6457 1 11 . 1 1 79 79 GLY H H 79 8.615 8.615 8.508 0.107 17635 6458 1 11 . 1 1 80 80 LYS N N 80 120.271 120.271 119.880 0.391 17635 6459 1 11 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.856 -0.394 17635 6460 1 11 . 1 1 80 80 LYS C C 80 175.853 175.853 175.122 0.731 17635 6461 1 11 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.003 1.147 17635 6462 1 11 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.849 -2.423 17635 6463 1 11 . 1 1 80 80 LYS H H 80 8.013 8.013 7.801 0.212 17635 6464 1 11 . 1 1 81 81 GLU N N 81 115.765 115.765 118.916 -3.151 17635 6465 1 11 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.152 -0.454 17635 6466 1 11 . 1 1 81 81 GLU C C 81 173.263 173.263 175.892 -2.629 17635 6467 1 11 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.226 0.698 17635 6468 1 11 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.539 0.503 17635 6469 1 11 . 1 1 81 81 GLU H H 81 8.201 8.201 8.544 -0.343 17635 6470 1 11 . 1 1 82 82 PHE N N 82 127.080 127.080 125.123 1.957 17635 6471 1 11 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.474 0.022 17635 6472 1 11 . 1 1 82 82 PHE C C 82 175.349 175.349 175.651 -0.302 17635 6473 1 11 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.673 1.043 17635 6474 1 11 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.056 2.938 17635 6475 1 11 . 1 1 82 82 PHE H H 82 9.162 9.162 9.069 0.093 17635 6476 1 11 . 1 1 83 83 SER N N 83 125.136 125.136 119.940 5.196 17635 6477 1 11 . 1 1 83 83 SER HA H 83 3.803 3.803 4.169 -0.366 17635 6478 1 11 . 1 1 83 83 SER C C 83 175.543 175.543 174.495 1.048 17635 6479 1 11 . 1 1 83 83 SER CA C 83 58.371 58.371 59.495 -1.124 17635 6480 1 11 . 1 1 83 83 SER CB C 83 62.519 62.519 62.917 -0.398 17635 6481 1 11 . 1 1 83 83 SER H H 83 9.193 9.193 9.226 -0.033 17635 6482 1 11 . 1 1 84 84 GLY N N 84 103.581 103.581 105.256 -1.675 17635 6483 1 11 . 1 1 84 84 GLY C C 84 177.188 177.188 174.019 3.169 17635 6484 1 11 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.742 0.309 17635 6485 1 11 . 1 1 84 84 GLY H H 84 8.446 8.446 8.091 0.355 17635 6486 1 11 . 1 1 85 85 ASN N N 85 119.051 119.051 121.796 -2.745 17635 6487 1 11 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.141 0.193 17635 6488 1 11 . 1 1 85 85 ASN C C 85 178.020 178.020 172.851 5.169 17635 6489 1 11 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.470 -0.999 17635 6490 1 11 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.353 2.764 17635 6491 1 11 . 1 1 85 85 ASN H H 85 7.762 7.762 8.144 -0.382 17635 6492 1 11 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.256 -0.589 17635 6493 1 11 . 1 1 86 86 PRO C C 86 173.474 173.474 176.400 -2.926 17635 6494 1 11 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.406 0.304 17635 6495 1 11 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.038 -1.167 17635 6496 1 11 . 1 1 87 87 ILE N N 87 117.270 117.270 115.377 1.893 17635 6497 1 11 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.531 -0.385 17635 6498 1 11 . 1 1 87 87 ILE C C 87 174.495 174.495 174.536 -0.041 17635 6499 1 11 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.623 0.868 17635 6500 1 11 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.851 -1.180 17635 6501 1 11 . 1 1 87 87 ILE H H 87 8.469 8.469 9.117 -0.648 17635 6502 1 11 . 1 1 88 88 LYS N N 88 122.271 122.271 119.900 2.371 17635 6503 1 11 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.717 0.475 17635 6504 1 11 . 1 1 88 88 LYS C C 88 174.393 174.393 174.795 -0.402 17635 6505 1 11 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.861 -0.723 17635 6506 1 11 . 1 1 88 88 LYS CB C 88 35.049 35.049 35.715 -0.666 17635 6507 1 11 . 1 1 88 88 LYS H H 88 8.353 8.353 8.177 0.176 17635 6508 1 11 . 1 1 89 89 VAL N N 89 125.661 125.661 125.780 -0.119 17635 6509 1 11 . 1 1 89 89 VAL HA H 89 4.963 4.963 5.148 -0.185 17635 6510 1 11 . 1 1 89 89 VAL C C 89 177.160 177.160 175.725 1.435 17635 6511 1 11 . 1 1 89 89 VAL CA C 89 61.361 61.361 60.690 0.671 17635 6512 1 11 . 1 1 89 89 VAL CB C 89 34.770 34.770 33.710 1.060 17635 6513 1 11 . 1 1 89 89 VAL H H 89 9.414 9.414 8.548 0.866 17635 6514 1 11 . 1 1 90 90 SER N N 90 119.538 119.538 121.116 -1.578 17635 6515 1 11 . 1 1 90 90 SER HA H 90 4.710 4.710 4.693 0.017 17635 6516 1 11 . 1 1 90 90 SER C C 90 176.533 176.533 173.929 2.604 17635 6517 1 11 . 1 1 90 90 SER CA C 90 56.936 56.936 56.688 0.248 17635 6518 1 11 . 1 1 90 90 SER CB C 90 66.470 66.470 65.649 0.821 17635 6519 1 11 . 1 1 90 90 SER H H 90 8.945 8.945 8.377 0.568 17635 6520 1 11 . 1 1 91 91 PHE N N 91 120.115 120.115 120.905 -0.790 17635 6521 1 11 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.671 0.002 17635 6522 1 11 . 1 1 91 91 PHE C C 91 173.349 173.349 175.066 -1.717 17635 6523 1 11 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.787 4.368 17635 6524 1 11 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.148 2.356 17635 6525 1 11 . 1 1 91 91 PHE H H 91 8.919 8.919 8.581 0.338 17635 6526 1 11 . 1 1 92 92 ALA N N 92 124.386 124.386 122.773 1.613 17635 6527 1 11 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.145 0.211 17635 6528 1 11 . 1 1 92 92 ALA C C 92 172.984 172.984 176.508 -3.524 17635 6529 1 11 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.703 -0.605 17635 6530 1 11 . 1 1 92 92 ALA CB C 92 19.406 19.406 19.146 0.260 17635 6531 1 11 . 1 1 92 92 ALA H H 92 8.563 8.563 7.746 0.817 17635 6532 1 11 . 1 1 93 93 THR N N 93 116.073 116.073 112.324 3.749 17635 6533 1 11 . 1 1 93 93 THR HA H 93 4.208 4.208 3.693 0.515 17635 6534 1 11 . 1 1 93 93 THR C C 93 176.032 176.032 175.163 0.869 17635 6535 1 11 . 1 1 93 93 THR CA C 93 62.255 62.255 62.190 0.065 17635 6536 1 11 . 1 1 93 93 THR CB C 93 69.708 69.708 69.370 0.338 17635 6537 1 11 . 1 1 93 93 THR H H 93 8.312 8.312 8.129 0.183 17635 6538 1 11 . 1 1 94 94 ARG N N 94 124.359 124.359 123.823 0.536 17635 6539 1 11 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.368 -0.031 17635 6540 1 11 . 1 1 94 94 ARG C C 94 174.426 174.426 175.373 -0.947 17635 6541 1 11 . 1 1 94 94 ARG CA C 94 56.055 56.055 55.511 0.544 17635 6542 1 11 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.061 0.851 17635 6543 1 11 . 1 1 94 94 ARG H H 94 8.493 8.493 8.404 0.089 17635 6544 1 11 . 1 1 95 95 ARG N N 95 122.515 122.515 115.157 7.358 17635 6545 1 11 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.039 0.189 17635 6546 1 11 . 1 1 95 95 ARG C C 95 174.306 174.306 174.976 -0.670 17635 6547 1 11 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.280 -0.138 17635 6548 1 11 . 1 1 95 95 ARG CB C 95 30.966 30.966 27.256 3.710 17635 6549 1 11 . 1 1 95 95 ARG H H 95 8.343 8.343 8.030 0.313 17635 6550 1 11 . 1 1 96 96 ALA N N 96 125.127 125.127 124.119 1.008 17635 6551 1 11 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.132 0.077 17635 6552 1 11 . 1 1 96 96 ALA C C 96 173.226 173.226 177.987 -4.761 17635 6553 1 11 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.557 0.213 17635 6554 1 11 . 1 1 96 96 ALA CB C 96 19.193 19.193 17.407 1.786 17635 6555 1 11 . 1 1 96 96 ALA H H 96 8.402 8.402 8.162 0.240 17635 6556 1 11 . 1 1 97 97 ASP N N 97 118.483 118.483 121.216 -2.733 17635 6557 1 11 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.259 0.239 17635 6558 1 11 . 1 1 97 97 ASP C C 97 174.302 174.302 174.650 -0.348 17635 6559 1 11 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.893 -0.802 17635 6560 1 11 . 1 1 97 97 ASP CB C 97 40.907 40.907 38.815 2.092 17635 6561 1 11 . 1 1 97 97 ASP H H 97 8.206 8.206 8.533 -0.327 17635 6562 1 11 . 1 1 98 98 PHE N N 98 120.321 120.321 121.501 -1.180 17635 6563 1 11 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.498 -0.008 17635 6564 1 11 . 1 1 98 98 PHE C C 98 174.878 174.878 173.474 1.404 17635 6565 1 11 . 1 1 98 98 PHE CA C 98 58.160 58.160 57.747 0.413 17635 6566 1 11 . 1 1 98 98 PHE CB C 98 39.303 39.303 40.069 -0.766 17635 6567 1 11 . 1 1 98 98 PHE H H 98 7.990 7.990 7.880 0.110 17635 6568 1 11 . 1 1 99 99 ASN N N 99 120.016 120.016 123.979 -3.963 17635 6569 1 11 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.782 -0.173 17635 6570 1 11 . 1 1 99 99 ASN C C 99 175.348 175.348 174.248 1.100 17635 6571 1 11 . 1 1 99 99 ASN CA C 99 53.313 53.313 52.477 0.836 17635 6572 1 11 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.292 -0.565 17635 6573 1 11 . 1 1 99 99 ASN H H 99 8.336 8.336 8.222 0.114 17635 6574 1 11 . 1 1 100 100 ARG N N 100 121.374 121.374 124.212 -2.838 17635 6575 1 11 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.340 -0.067 17635 6576 1 11 . 1 1 100 100 ARG C C 100 173.627 173.627 176.671 -3.044 17635 6577 1 11 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.219 1.272 17635 6578 1 11 . 1 1 100 100 ARG CB C 100 30.519 30.519 29.872 0.647 17635 6579 1 11 . 1 1 100 100 ARG H H 100 8.181 8.181 8.433 -0.252 17635 6580 1 11 . 1 1 101 101 GLY N N 101 109.586 109.586 113.637 -4.051 17635 6581 1 11 . 1 1 101 101 GLY C C 101 175.739 175.739 175.124 0.615 17635 6582 1 11 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.905 0.475 17635 6583 1 11 . 1 1 101 101 GLY H H 101 8.413 8.413 8.697 -0.284 17635 6584 1 11 . 1 1 102 102 GLY N N 102 108.692 108.692 108.846 -0.154 17635 6585 1 11 . 1 1 102 102 GLY C C 102 176.286 176.286 175.393 0.893 17635 6586 1 11 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.851 -0.513 17635 6587 1 11 . 1 1 102 102 GLY H H 102 8.281 8.281 8.429 -0.148 17635 6588 1 11 . 1 1 103 103 GLY N N 103 108.844 108.844 107.583 1.261 17635 6589 1 11 . 1 1 103 103 GLY C C 103 175.798 175.798 174.915 0.883 17635 6590 1 11 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.649 0.697 17635 6591 1 11 . 1 1 103 103 GLY H H 103 8.364 8.364 8.094 0.270 17635 6592 1 11 . 1 1 104 104 ASN N N 104 118.527 118.527 119.627 -1.100 17635 6593 1 11 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.756 -0.038 17635 6594 1 11 . 1 1 104 104 ASN C C 104 174.547 174.547 176.380 -1.833 17635 6595 1 11 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.725 -0.516 17635 6596 1 11 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.014 -0.135 17635 6597 1 11 . 1 1 104 104 ASN H H 104 8.438 8.438 8.485 -0.047 17635 6598 1 11 . 1 1 105 105 GLY N N 105 109.166 109.166 108.166 1.000 17635 6599 1 11 . 1 1 105 105 GLY C C 105 176.074 176.074 173.781 2.293 17635 6600 1 11 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.582 1.020 17635 6601 1 11 . 1 1 105 105 GLY H H 105 8.477 8.477 7.983 0.494 17635 6602 1 11 . 1 1 106 106 ARG N N 106 120.341 120.341 124.633 -4.292 17635 6603 1 11 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.474 -0.123 17635 6604 1 11 . 1 1 106 106 ARG C C 106 173.491 173.491 177.487 -3.996 17635 6605 1 11 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.291 0.936 17635 6606 1 11 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.165 0.464 17635 6607 1 11 . 1 1 106 106 ARG H H 106 8.244 8.244 8.418 -0.174 17635 6608 1 11 . 1 1 107 107 GLY N N 107 109.856 109.856 114.219 -4.363 17635 6609 1 11 . 1 1 107 107 GLY C C 107 175.834 175.834 174.586 1.248 17635 6610 1 11 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.784 0.657 17635 6611 1 11 . 1 1 107 107 GLY H H 107 8.522 8.522 8.815 -0.293 17635 6612 1 12 . 1 1 2 2 GLN N N 2 121.692 121.692 119.096 2.596 17635 6613 1 12 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.558 -0.292 17635 6614 1 12 . 1 1 2 2 GLN C C 2 175.248 175.248 175.523 -0.275 17635 6615 1 12 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.289 0.707 17635 6616 1 12 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.741 -0.102 17635 6617 1 12 . 1 1 2 2 GLN H H 2 8.621 8.621 7.821 0.800 17635 6618 1 12 . 1 1 3 3 ASP N N 3 121.801 121.801 122.719 -0.918 17635 6619 1 12 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.458 0.110 17635 6620 1 12 . 1 1 3 3 ASP C C 3 174.336 174.336 177.111 -2.775 17635 6621 1 12 . 1 1 3 3 ASP CA C 3 54.062 54.062 55.213 -1.151 17635 6622 1 12 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.332 -0.261 17635 6623 1 12 . 1 1 3 3 ASP H H 3 8.436 8.436 8.653 -0.217 17635 6624 1 12 . 1 1 4 4 ASN N N 4 120.292 120.292 114.233 6.059 17635 6625 1 12 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.146 0.491 17635 6626 1 12 . 1 1 4 4 ASN C C 4 174.415 174.415 175.924 -1.509 17635 6627 1 12 . 1 1 4 4 ASN CA C 4 53.861 53.861 55.021 -1.160 17635 6628 1 12 . 1 1 4 4 ASN CB C 4 38.534 38.534 37.421 1.113 17635 6629 1 12 . 1 1 4 4 ASN H H 4 8.528 8.528 8.523 0.005 17635 6630 1 12 . 1 1 5 5 SER N N 5 117.091 117.091 115.797 1.294 17635 6631 1 12 . 1 1 5 5 SER HA H 5 4.163 4.163 4.211 -0.048 17635 6632 1 12 . 1 1 5 5 SER C C 5 176.370 176.370 175.021 1.349 17635 6633 1 12 . 1 1 5 5 SER CA C 5 60.846 60.846 60.871 -0.025 17635 6634 1 12 . 1 1 5 5 SER CB C 5 63.136 63.136 63.348 -0.212 17635 6635 1 12 . 1 1 5 5 SER H H 5 8.470 8.470 8.324 0.146 17635 6636 1 12 . 1 1 6 6 ASP N N 6 119.436 119.436 115.128 4.308 17635 6637 1 12 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.527 0.168 17635 6638 1 12 . 1 1 6 6 ASP C C 6 175.048 175.048 174.804 0.244 17635 6639 1 12 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.972 -0.878 17635 6640 1 12 . 1 1 6 6 ASP CB C 6 40.935 40.935 41.681 -0.746 17635 6641 1 12 . 1 1 6 6 ASP H H 6 8.218 8.218 7.883 0.335 17635 6642 1 12 . 1 1 7 7 ASN N N 7 119.696 119.696 116.797 2.899 17635 6643 1 12 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.440 0.188 17635 6644 1 12 . 1 1 7 7 ASN C C 7 176.539 176.539 174.449 2.090 17635 6645 1 12 . 1 1 7 7 ASN CA C 7 53.158 53.158 54.024 -0.866 17635 6646 1 12 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.205 0.654 17635 6647 1 12 . 1 1 7 7 ASN H H 7 7.734 7.734 8.243 -0.509 17635 6648 1 12 . 1 1 8 8 ASN N N 8 119.436 119.436 119.123 0.313 17635 6649 1 12 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.790 0.078 17635 6650 1 12 . 1 1 8 8 ASN C C 8 175.327 175.327 175.854 -0.527 17635 6651 1 12 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.512 -1.308 17635 6652 1 12 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.529 -1.034 17635 6653 1 12 . 1 1 8 8 ASN H H 8 8.350 8.350 8.329 0.021 17635 6654 1 12 . 1 1 9 9 THR N N 9 118.650 118.650 116.229 2.421 17635 6655 1 12 . 1 1 9 9 THR HA H 9 5.557 5.557 4.662 0.895 17635 6656 1 12 . 1 1 9 9 THR C C 9 177.117 177.117 174.080 3.037 17635 6657 1 12 . 1 1 9 9 THR CA C 9 62.314 62.314 63.264 -0.950 17635 6658 1 12 . 1 1 9 9 THR CB C 9 71.225 71.225 69.426 1.799 17635 6659 1 12 . 1 1 9 9 THR H H 9 8.428 8.428 7.687 0.741 17635 6660 1 12 . 1 1 10 10 ILE N N 10 118.556 118.556 118.904 -0.348 17635 6661 1 12 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.041 0.124 17635 6662 1 12 . 1 1 10 10 ILE C C 10 176.837 176.837 174.125 2.712 17635 6663 1 12 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.390 0.908 17635 6664 1 12 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.330 -1.450 17635 6665 1 12 . 1 1 10 10 ILE H H 10 8.770 8.770 8.419 0.351 17635 6666 1 12 . 1 1 11 11 PHE N N 11 123.798 123.798 121.395 2.403 17635 6667 1 12 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.923 0.497 17635 6668 1 12 . 1 1 11 11 PHE C C 11 177.066 177.066 174.315 2.751 17635 6669 1 12 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.259 0.103 17635 6670 1 12 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.046 0.822 17635 6671 1 12 . 1 1 11 11 PHE H H 11 9.548 9.548 8.006 1.542 17635 6672 1 12 . 1 1 12 12 VAL N N 12 127.993 127.993 128.172 -0.179 17635 6673 1 12 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.378 0.580 17635 6674 1 12 . 1 1 12 12 VAL C C 12 176.965 176.965 174.428 2.537 17635 6675 1 12 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.371 -1.536 17635 6676 1 12 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.573 2.227 17635 6677 1 12 . 1 1 12 12 VAL H H 12 8.940 8.940 9.140 -0.201 17635 6678 1 12 . 1 1 13 13 GLN N N 13 122.289 122.289 127.234 -4.945 17635 6679 1 12 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.699 0.080 17635 6680 1 12 . 1 1 13 13 GLN C C 13 175.631 175.631 175.998 -0.367 17635 6681 1 12 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.551 0.559 17635 6682 1 12 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.178 3.954 17635 6683 1 12 . 1 1 13 13 GLN H H 13 8.747 8.747 7.905 0.842 17635 6684 1 12 . 1 1 14 14 GLY N N 14 109.212 109.212 112.598 -3.386 17635 6685 1 12 . 1 1 14 14 GLY C C 14 175.436 175.436 173.126 2.310 17635 6686 1 12 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.133 0.297 17635 6687 1 12 . 1 1 14 14 GLY H H 14 8.236 8.236 8.830 -0.594 17635 6688 1 12 . 1 1 15 15 LEU N N 15 117.824 117.824 121.097 -3.273 17635 6689 1 12 . 1 1 15 15 LEU HA H 15 3.706 3.706 3.978 -0.272 17635 6690 1 12 . 1 1 15 15 LEU C C 15 174.111 174.111 177.890 -3.779 17635 6691 1 12 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.647 0.071 17635 6692 1 12 . 1 1 15 15 LEU CB C 15 42.433 42.433 42.243 0.190 17635 6693 1 12 . 1 1 15 15 LEU H H 15 8.442 8.442 7.307 1.135 17635 6694 1 12 . 1 1 16 16 GLY N N 16 105.063 105.063 105.229 -0.166 17635 6695 1 12 . 1 1 16 16 GLY C C 16 177.771 177.771 174.391 3.380 17635 6696 1 12 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.088 -0.994 17635 6697 1 12 . 1 1 16 16 GLY H H 16 8.006 8.006 7.518 0.488 17635 6698 1 12 . 1 1 17 17 GLU N N 17 113.781 113.781 119.146 -5.365 17635 6699 1 12 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.761 0.358 17635 6700 1 12 . 1 1 17 17 GLU C C 17 173.937 173.937 175.214 -1.277 17635 6701 1 12 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.935 0.346 17635 6702 1 12 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.309 1.127 17635 6703 1 12 . 1 1 17 17 GLU H H 17 8.134 8.134 8.576 -0.442 17635 6704 1 12 . 1 1 18 18 ASN N N 18 116.660 116.660 115.884 0.776 17635 6705 1 12 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.601 0.340 17635 6706 1 12 . 1 1 18 18 ASN C C 18 175.900 175.900 173.842 2.058 17635 6707 1 12 . 1 1 18 18 ASN CA C 18 52.478 52.478 53.307 -0.829 17635 6708 1 12 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.040 -0.555 17635 6709 1 12 . 1 1 18 18 ASN H H 18 8.407 8.407 7.787 0.620 17635 6710 1 12 . 1 1 19 19 VAL N N 19 118.323 118.323 122.640 -4.317 17635 6711 1 12 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.817 0.335 17635 6712 1 12 . 1 1 19 19 VAL C C 19 177.655 177.655 174.921 2.734 17635 6713 1 12 . 1 1 19 19 VAL CA C 19 61.877 61.877 64.229 -2.352 17635 6714 1 12 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.053 2.459 17635 6715 1 12 . 1 1 19 19 VAL H H 19 6.855 6.855 7.906 -1.051 17635 6716 1 12 . 1 1 20 20 THR N N 20 111.636 111.636 115.620 -3.984 17635 6717 1 12 . 1 1 20 20 THR HA H 20 4.719 4.719 4.595 0.124 17635 6718 1 12 . 1 1 20 20 THR C C 20 175.266 175.266 174.367 0.899 17635 6719 1 12 . 1 1 20 20 THR CA C 20 58.698 58.698 60.002 -1.304 17635 6720 1 12 . 1 1 20 20 THR CB C 20 72.948 72.948 71.773 1.175 17635 6721 1 12 . 1 1 20 20 THR H H 20 7.328 7.328 7.757 -0.429 17635 6722 1 12 . 1 1 21 21 ILE N N 21 122.147 122.147 123.268 -1.121 17635 6723 1 12 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.812 -0.294 17635 6724 1 12 . 1 1 21 21 ILE C C 21 173.198 173.198 177.374 -4.176 17635 6725 1 12 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.948 0.824 17635 6726 1 12 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.956 -0.373 17635 6727 1 12 . 1 1 21 21 ILE H H 21 9.074 9.074 8.737 0.337 17635 6728 1 12 . 1 1 22 22 GLU N N 22 118.154 118.154 120.603 -2.449 17635 6729 1 12 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.064 -0.078 17635 6730 1 12 . 1 1 22 22 GLU C C 22 171.799 171.799 178.346 -6.547 17635 6731 1 12 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.911 0.702 17635 6732 1 12 . 1 1 22 22 GLU CB C 22 28.791 28.791 27.974 0.817 17635 6733 1 12 . 1 1 22 22 GLU H H 22 8.814 8.814 8.620 0.194 17635 6734 1 12 . 1 1 23 23 SER N N 23 115.921 115.921 116.113 -0.192 17635 6735 1 12 . 1 1 23 23 SER HA H 23 4.384 4.384 4.295 0.089 17635 6736 1 12 . 1 1 23 23 SER C C 23 172.447 172.447 176.754 -4.307 17635 6737 1 12 . 1 1 23 23 SER CA C 23 61.239 61.239 61.493 -0.254 17635 6738 1 12 . 1 1 23 23 SER CB C 23 62.838 62.838 62.746 0.092 17635 6739 1 12 . 1 1 23 23 SER H H 23 8.236 8.236 8.250 -0.014 17635 6740 1 12 . 1 1 24 24 VAL N N 24 124.867 124.867 122.730 2.137 17635 6741 1 12 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.215 -0.467 17635 6742 1 12 . 1 1 24 24 VAL C C 24 173.016 173.016 178.224 -5.208 17635 6743 1 12 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.656 0.598 17635 6744 1 12 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.901 -0.368 17635 6745 1 12 . 1 1 24 24 VAL H H 24 7.973 7.973 7.865 0.108 17635 6746 1 12 . 1 1 25 25 ALA N N 25 123.198 123.198 121.796 1.402 17635 6747 1 12 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.172 -0.273 17635 6748 1 12 . 1 1 25 25 ALA C C 25 171.061 171.061 178.416 -7.355 17635 6749 1 12 . 1 1 25 25 ALA CA C 25 55.695 55.695 55.266 0.429 17635 6750 1 12 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.282 -0.544 17635 6751 1 12 . 1 1 25 25 ALA H H 25 8.695 8.695 8.560 0.135 17635 6752 1 12 . 1 1 26 26 ASP N N 26 115.503 115.503 117.745 -2.242 17635 6753 1 12 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.584 -0.261 17635 6754 1 12 . 1 1 26 26 ASP C C 26 173.108 173.108 178.289 -5.181 17635 6755 1 12 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.616 0.707 17635 6756 1 12 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.587 -0.536 17635 6757 1 12 . 1 1 26 26 ASP H H 26 8.312 8.312 8.353 -0.041 17635 6758 1 12 . 1 1 27 27 TYR N N 27 119.224 119.224 118.497 0.727 17635 6759 1 12 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.629 -0.429 17635 6760 1 12 . 1 1 27 27 TYR C C 27 172.908 172.908 176.073 -3.165 17635 6761 1 12 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.609 2.406 17635 6762 1 12 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.424 0.508 17635 6763 1 12 . 1 1 27 27 TYR H H 27 7.533 7.533 7.965 -0.432 17635 6764 1 12 . 1 1 28 28 PHE N N 28 112.595 112.595 120.279 -7.684 17635 6765 1 12 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.335 -0.005 17635 6766 1 12 . 1 1 28 28 PHE C C 28 173.082 173.082 174.870 -1.788 17635 6767 1 12 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.409 6.375 17635 6768 1 12 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.694 1.309 17635 6769 1 12 . 1 1 28 28 PHE H H 28 7.974 7.974 8.359 -0.385 17635 6770 1 12 . 1 1 29 29 LYS N N 29 118.820 118.820 117.515 1.305 17635 6771 1 12 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.875 0.042 17635 6772 1 12 . 1 1 29 29 LYS C C 29 173.682 173.682 176.580 -2.898 17635 6773 1 12 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.929 2.351 17635 6774 1 12 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.271 -0.980 17635 6775 1 12 . 1 1 29 29 LYS H H 29 8.325 8.325 7.961 0.364 17635 6776 1 12 . 1 1 30 30 GLN N N 30 116.232 116.232 117.996 -1.764 17635 6777 1 12 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.312 -0.177 17635 6778 1 12 . 1 1 30 30 GLN C C 30 173.790 173.790 176.676 -2.886 17635 6779 1 12 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.661 -0.115 17635 6780 1 12 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.792 1.106 17635 6781 1 12 . 1 1 30 30 GLN H H 30 7.518 7.518 8.306 -0.788 17635 6782 1 12 . 1 1 31 31 ILE N N 31 116.489 116.489 118.695 -2.206 17635 6783 1 12 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.177 0.062 17635 6784 1 12 . 1 1 31 31 ILE C C 31 175.599 175.599 174.991 0.608 17635 6785 1 12 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.310 -3.089 17635 6786 1 12 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.520 1.814 17635 6787 1 12 . 1 1 31 31 ILE H H 31 7.809 7.809 8.332 -0.523 17635 6788 1 12 . 1 1 32 32 GLY N N 32 107.416 107.416 105.242 2.174 17635 6789 1 12 . 1 1 32 32 GLY C C 32 180.182 180.182 171.885 8.297 17635 6790 1 12 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.370 0.624 17635 6791 1 12 . 1 1 32 32 GLY H H 32 7.344 7.344 7.369 -0.025 17635 6792 1 12 . 1 1 33 33 ILE N N 33 117.784 117.784 120.530 -2.746 17635 6793 1 12 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.369 -0.280 17635 6794 1 12 . 1 1 33 33 ILE C C 33 173.301 173.301 175.424 -2.123 17635 6795 1 12 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.577 1.064 17635 6796 1 12 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.222 -0.563 17635 6797 1 12 . 1 1 33 33 ILE H H 33 8.173 8.173 8.070 0.103 17635 6798 1 12 . 1 1 34 34 ILE N N 34 131.781 131.781 125.482 6.299 17635 6799 1 12 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.660 -0.873 17635 6800 1 12 . 1 1 34 34 ILE C C 34 174.663 174.663 176.646 -1.983 17635 6801 1 12 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.082 1.288 17635 6802 1 12 . 1 1 34 34 ILE CB C 34 37.995 37.995 39.114 -1.119 17635 6803 1 12 . 1 1 34 34 ILE H H 34 8.687 8.687 8.539 0.148 17635 6804 1 12 . 1 1 35 35 LYS N N 35 130.372 130.372 129.773 0.599 17635 6805 1 12 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.055 0.029 17635 6806 1 12 . 1 1 35 35 LYS C C 35 175.376 175.376 175.726 -0.350 17635 6807 1 12 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.931 0.542 17635 6808 1 12 . 1 1 35 35 LYS CB C 35 33.664 33.664 30.631 3.033 17635 6809 1 12 . 1 1 35 35 LYS H H 35 8.680 8.680 8.788 -0.108 17635 6810 1 12 . 1 1 36 36 THR N N 36 118.312 118.312 118.618 -0.306 17635 6811 1 12 . 1 1 36 36 THR HA H 36 4.415 4.415 4.343 0.072 17635 6812 1 12 . 1 1 36 36 THR C C 36 176.394 176.394 174.586 1.808 17635 6813 1 12 . 1 1 36 36 THR CA C 36 61.340 61.340 62.281 -0.941 17635 6814 1 12 . 1 1 36 36 THR CB C 36 70.809 70.809 69.430 1.379 17635 6815 1 12 . 1 1 36 36 THR H H 36 8.456 8.456 7.937 0.519 17635 6816 1 12 . 1 1 37 37 ASN N N 37 124.092 124.092 121.511 2.581 17635 6817 1 12 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.841 -0.311 17635 6818 1 12 . 1 1 37 37 ASN C C 37 174.235 174.235 175.615 -1.380 17635 6819 1 12 . 1 1 37 37 ASN CA C 37 53.064 53.064 52.068 0.996 17635 6820 1 12 . 1 1 37 37 ASN CB C 37 38.927 38.927 40.322 -1.395 17635 6821 1 12 . 1 1 37 37 ASN H H 37 8.794 8.794 8.988 -0.194 17635 6822 1 12 . 1 1 38 38 LYS N N 38 127.969 127.969 122.232 5.737 17635 6823 1 12 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.212 -0.208 17635 6824 1 12 . 1 1 38 38 LYS C C 38 172.702 172.702 177.020 -4.318 17635 6825 1 12 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.928 -0.470 17635 6826 1 12 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.992 0.175 17635 6827 1 12 . 1 1 38 38 LYS H H 38 8.962 8.962 8.698 0.264 17635 6828 1 12 . 1 1 39 39 LYS N N 39 117.413 117.413 118.586 -1.173 17635 6829 1 12 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.208 0.050 17635 6830 1 12 . 1 1 39 39 LYS C C 39 172.261 172.261 177.508 -5.247 17635 6831 1 12 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.844 -0.525 17635 6832 1 12 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.531 0.266 17635 6833 1 12 . 1 1 39 39 LYS H H 39 8.314 8.314 8.215 0.099 17635 6834 1 12 . 1 1 40 40 THR N N 40 105.547 105.547 107.883 -2.336 17635 6835 1 12 . 1 1 40 40 THR HA H 40 4.465 4.465 4.471 -0.006 17635 6836 1 12 . 1 1 40 40 THR C C 40 174.021 174.021 175.809 -1.788 17635 6837 1 12 . 1 1 40 40 THR CA C 40 61.260 61.260 61.504 -0.244 17635 6838 1 12 . 1 1 40 40 THR CB C 40 70.997 70.997 69.265 1.732 17635 6839 1 12 . 1 1 40 40 THR H H 40 7.422 7.422 7.535 -0.113 17635 6840 1 12 . 1 1 41 41 GLY N N 41 111.631 111.631 111.674 -0.043 17635 6841 1 12 . 1 1 41 41 GLY C C 41 176.727 176.727 173.674 3.053 17635 6842 1 12 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.471 0.259 17635 6843 1 12 . 1 1 41 41 GLY H H 41 8.644 8.644 8.438 0.206 17635 6844 1 12 . 1 1 42 42 GLN N N 42 118.894 118.894 118.622 0.272 17635 6845 1 12 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.899 -0.230 17635 6846 1 12 . 1 1 42 42 GLN C C 42 177.178 177.178 173.496 3.682 17635 6847 1 12 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.490 1.091 17635 6848 1 12 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.384 -0.153 17635 6849 1 12 . 1 1 42 42 GLN H H 42 7.662 7.662 7.756 -0.094 17635 6850 1 12 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.307 0.288 17635 6851 1 12 . 1 1 43 43 PRO C C 43 172.629 172.629 176.327 -3.698 17635 6852 1 12 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.912 -1.090 17635 6853 1 12 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.156 0.541 17635 6854 1 12 . 1 1 44 44 MET N N 44 124.162 124.162 120.480 3.682 17635 6855 1 12 . 1 1 44 44 MET HA H 44 4.432 4.432 4.725 -0.293 17635 6856 1 12 . 1 1 44 44 MET C C 44 176.474 176.474 174.735 1.739 17635 6857 1 12 . 1 1 44 44 MET CA C 44 55.419 55.419 54.956 0.463 17635 6858 1 12 . 1 1 44 44 MET CB C 44 30.555 30.555 35.684 -5.129 17635 6859 1 12 . 1 1 44 44 MET H H 44 8.874 8.874 8.569 0.305 17635 6860 1 12 . 1 1 45 45 ILE N N 45 126.237 126.237 121.758 4.479 17635 6861 1 12 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.748 0.054 17635 6862 1 12 . 1 1 45 45 ILE C C 45 176.415 176.415 174.409 2.006 17635 6863 1 12 . 1 1 45 45 ILE CA C 45 59.216 59.216 59.586 -0.370 17635 6864 1 12 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.735 -0.509 17635 6865 1 12 . 1 1 45 45 ILE H H 45 7.730 7.730 8.375 -0.645 17635 6866 1 12 . 1 1 46 46 ASN N N 46 124.735 124.735 122.341 2.394 17635 6867 1 12 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.125 -0.184 17635 6868 1 12 . 1 1 46 46 ASN C C 46 176.836 176.836 173.694 3.142 17635 6869 1 12 . 1 1 46 46 ASN CA C 46 51.561 51.561 51.720 -0.159 17635 6870 1 12 . 1 1 46 46 ASN CB C 46 40.470 40.470 41.292 -0.822 17635 6871 1 12 . 1 1 46 46 ASN H H 46 8.384 8.384 8.899 -0.515 17635 6872 1 12 . 1 1 47 47 LEU N N 47 122.487 122.487 120.986 1.501 17635 6873 1 12 . 1 1 47 47 LEU HA H 47 4.715 4.715 5.183 -0.468 17635 6874 1 12 . 1 1 47 47 LEU C C 47 174.190 174.190 176.169 -1.979 17635 6875 1 12 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.961 -0.628 17635 6876 1 12 . 1 1 47 47 LEU CB C 47 42.277 42.277 45.763 -3.486 17635 6877 1 12 . 1 1 47 47 LEU H H 47 8.594 8.594 8.287 0.307 17635 6878 1 12 . 1 1 48 48 TYR N N 48 121.842 121.842 120.963 0.879 17635 6879 1 12 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.846 -0.079 17635 6880 1 12 . 1 1 48 48 TYR C C 48 173.649 173.649 174.515 -0.866 17635 6881 1 12 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.974 0.920 17635 6882 1 12 . 1 1 48 48 TYR CB C 48 39.199 39.199 39.276 -0.077 17635 6883 1 12 . 1 1 48 48 TYR H H 48 7.666 7.666 8.811 -1.145 17635 6884 1 12 . 1 1 49 49 THR N N 49 116.554 116.554 114.597 1.957 17635 6885 1 12 . 1 1 49 49 THR HA H 49 4.806 4.806 4.656 0.150 17635 6886 1 12 . 1 1 49 49 THR C C 49 176.654 176.654 173.391 3.263 17635 6887 1 12 . 1 1 49 49 THR CA C 49 60.693 60.693 59.277 1.416 17635 6888 1 12 . 1 1 49 49 THR CB C 49 71.437 71.437 71.296 0.141 17635 6889 1 12 . 1 1 49 49 THR H H 49 8.965 8.965 8.277 0.688 17635 6890 1 12 . 1 1 50 50 ASP N N 50 123.826 123.826 124.138 -0.312 17635 6891 1 12 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.642 -0.018 17635 6892 1 12 . 1 1 50 50 ASP C C 50 173.380 173.380 176.648 -3.268 17635 6893 1 12 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.236 -0.148 17635 6894 1 12 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.471 1.396 17635 6895 1 12 . 1 1 50 50 ASP H H 50 8.939 8.939 8.231 0.708 17635 6896 1 12 . 1 1 51 51 ARG N N 51 127.794 127.794 125.740 2.054 17635 6897 1 12 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.350 -0.305 17635 6898 1 12 . 1 1 51 51 ARG C C 51 173.101 173.101 176.934 -3.833 17635 6899 1 12 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.273 2.289 17635 6900 1 12 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.398 0.769 17635 6901 1 12 . 1 1 51 51 ARG H H 51 8.958 8.958 8.491 0.467 17635 6902 1 12 . 1 1 52 52 GLU N N 52 117.542 117.542 119.622 -2.080 17635 6903 1 12 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.322 -0.045 17635 6904 1 12 . 1 1 52 52 GLU C C 52 172.201 172.201 177.664 -5.463 17635 6905 1 12 . 1 1 52 52 GLU CA C 52 58.524 58.524 58.465 0.059 17635 6906 1 12 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.836 0.442 17635 6907 1 12 . 1 1 52 52 GLU H H 52 8.561 8.561 8.601 -0.040 17635 6908 1 12 . 1 1 53 53 THR N N 53 107.065 107.065 110.340 -3.275 17635 6909 1 12 . 1 1 53 53 THR HA H 53 4.436 4.436 4.568 -0.132 17635 6910 1 12 . 1 1 53 53 THR C C 53 173.851 173.851 175.283 -1.432 17635 6911 1 12 . 1 1 53 53 THR CA C 53 61.944 61.944 62.062 -0.118 17635 6912 1 12 . 1 1 53 53 THR CB C 53 71.197 71.197 70.227 0.970 17635 6913 1 12 . 1 1 53 53 THR H H 53 8.087 8.087 7.835 0.252 17635 6914 1 12 . 1 1 54 54 GLY N N 54 111.295 111.295 110.321 0.974 17635 6915 1 12 . 1 1 54 54 GLY C C 54 176.747 176.747 174.090 2.657 17635 6916 1 12 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.820 0.883 17635 6917 1 12 . 1 1 54 54 GLY H H 54 8.423 8.423 7.796 0.626 17635 6918 1 12 . 1 1 55 55 LYS N N 55 119.673 119.673 119.541 0.132 17635 6919 1 12 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.719 -0.366 17635 6920 1 12 . 1 1 55 55 LYS C C 55 173.854 173.854 175.332 -1.478 17635 6921 1 12 . 1 1 55 55 LYS CA C 55 55.842 55.842 54.552 1.290 17635 6922 1 12 . 1 1 55 55 LYS CB C 55 33.821 33.821 34.602 -0.781 17635 6923 1 12 . 1 1 55 55 LYS H H 55 7.767 7.767 7.749 0.018 17635 6924 1 12 . 1 1 56 56 LEU N N 56 122.426 122.426 117.690 4.736 17635 6925 1 12 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.687 -0.331 17635 6926 1 12 . 1 1 56 56 LEU C C 56 172.534 172.534 176.017 -3.483 17635 6927 1 12 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.245 2.010 17635 6928 1 12 . 1 1 56 56 LEU CB C 56 41.654 41.654 44.663 -3.009 17635 6929 1 12 . 1 1 56 56 LEU H H 56 8.768 8.768 8.116 0.652 17635 6930 1 12 . 1 1 57 57 LYS N N 57 118.264 118.264 125.257 -6.993 17635 6931 1 12 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.338 -0.050 17635 6932 1 12 . 1 1 57 57 LYS C C 57 173.648 173.648 177.769 -4.121 17635 6933 1 12 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.797 -0.533 17635 6934 1 12 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.808 1.254 17635 6935 1 12 . 1 1 57 57 LYS H H 57 8.012 8.012 9.066 -1.054 17635 6936 1 12 . 1 1 58 58 GLY N N 58 108.514 108.514 106.864 1.650 17635 6937 1 12 . 1 1 58 58 GLY C C 58 177.876 177.876 172.684 5.192 17635 6938 1 12 . 1 1 58 58 GLY CA C 58 46.364 46.364 44.882 1.482 17635 6939 1 12 . 1 1 58 58 GLY H H 58 8.334 8.334 7.911 0.423 17635 6940 1 12 . 1 1 59 59 GLU N N 59 116.119 116.119 120.068 -3.949 17635 6941 1 12 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.109 0.412 17635 6942 1 12 . 1 1 59 59 GLU C C 59 173.860 173.860 173.865 -0.005 17635 6943 1 12 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.918 -1.893 17635 6944 1 12 . 1 1 59 59 GLU CB C 59 34.304 34.304 32.908 1.396 17635 6945 1 12 . 1 1 59 59 GLU H H 59 7.202 7.202 7.589 -0.387 17635 6946 1 12 . 1 1 60 60 ALA N N 60 123.607 123.607 125.789 -2.182 17635 6947 1 12 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.315 0.292 17635 6948 1 12 . 1 1 60 60 ALA C C 60 173.923 173.923 175.457 -1.534 17635 6949 1 12 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.053 -0.111 17635 6950 1 12 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.051 1.008 17635 6951 1 12 . 1 1 60 60 ALA H H 60 8.930 8.930 8.770 0.160 17635 6952 1 12 . 1 1 61 61 THR N N 61 108.384 108.384 115.522 -7.138 17635 6953 1 12 . 1 1 61 61 THR HA H 61 5.743 5.743 5.149 0.594 17635 6954 1 12 . 1 1 61 61 THR C C 61 176.172 176.172 173.918 2.254 17635 6955 1 12 . 1 1 61 61 THR CA C 61 59.625 59.625 60.294 -0.669 17635 6956 1 12 . 1 1 61 61 THR CB C 61 71.224 71.224 69.744 1.480 17635 6957 1 12 . 1 1 61 61 THR H H 61 8.452 8.452 8.945 -0.493 17635 6958 1 12 . 1 1 62 62 VAL N N 62 120.200 120.200 127.970 -7.770 17635 6959 1 12 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.015 0.229 17635 6960 1 12 . 1 1 62 62 VAL C C 62 175.994 175.994 174.620 1.374 17635 6961 1 12 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.704 -0.278 17635 6962 1 12 . 1 1 62 62 VAL CB C 62 34.685 34.685 33.267 1.418 17635 6963 1 12 . 1 1 62 62 VAL H H 62 8.071 8.071 8.720 -0.649 17635 6964 1 12 . 1 1 63 63 SER N N 63 121.689 121.689 125.097 -3.408 17635 6965 1 12 . 1 1 63 63 SER HA H 63 5.261 5.261 4.475 0.786 17635 6966 1 12 . 1 1 63 63 SER C C 63 177.943 177.943 173.507 4.436 17635 6967 1 12 . 1 1 63 63 SER CA C 63 57.662 57.662 57.094 0.568 17635 6968 1 12 . 1 1 63 63 SER CB C 63 64.427 64.427 63.510 0.917 17635 6969 1 12 . 1 1 63 63 SER H H 63 7.695 7.695 8.200 -0.505 17635 6970 1 12 . 1 1 64 64 PHE N N 64 122.640 122.640 123.671 -1.031 17635 6971 1 12 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.912 -0.058 17635 6972 1 12 . 1 1 64 64 PHE C C 64 174.605 174.605 176.288 -1.683 17635 6973 1 12 . 1 1 64 64 PHE CA C 64 58.204 58.204 56.365 1.839 17635 6974 1 12 . 1 1 64 64 PHE CB C 64 41.976 41.976 41.438 0.538 17635 6975 1 12 . 1 1 64 64 PHE H H 64 9.025 9.025 7.921 1.104 17635 6976 1 12 . 1 1 65 65 ASP N N 65 119.943 119.943 120.453 -0.510 17635 6977 1 12 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.556 -0.121 17635 6978 1 12 . 1 1 65 65 ASP C C 65 174.396 174.396 176.051 -1.655 17635 6979 1 12 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.429 2.013 17635 6980 1 12 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.908 0.126 17635 6981 1 12 . 1 1 65 65 ASP H H 65 8.512 8.512 8.714 -0.202 17635 6982 1 12 . 1 1 66 66 ASP N N 66 116.125 116.125 118.926 -2.801 17635 6983 1 12 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.069 0.330 17635 6984 1 12 . 1 1 66 66 ASP C C 66 175.936 175.936 175.092 0.844 17635 6985 1 12 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.066 -0.273 17635 6986 1 12 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.650 0.269 17635 6987 1 12 . 1 1 66 66 ASP H H 66 8.323 8.323 7.748 0.575 17635 6988 1 12 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.341 0.109 17635 6989 1 12 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.385 0.540 17635 6990 1 12 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.222 -0.392 17635 6991 1 12 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.222 0.197 17635 6992 1 12 . 1 1 68 68 PRO C C 68 171.345 171.345 178.903 -7.558 17635 6993 1 12 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.026 0.209 17635 6994 1 12 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.979 0.018 17635 6995 1 12 . 1 1 69 69 SER N N 69 114.544 114.544 114.827 -0.283 17635 6996 1 12 . 1 1 69 69 SER HA H 69 4.036 4.036 3.944 0.092 17635 6997 1 12 . 1 1 69 69 SER C C 69 176.535 176.535 176.312 0.223 17635 6998 1 12 . 1 1 69 69 SER CA C 69 61.837 61.837 61.711 0.126 17635 6999 1 12 . 1 1 69 69 SER CB C 69 62.773 62.773 62.377 0.396 17635 7000 1 12 . 1 1 69 69 SER H H 69 8.004 8.004 8.200 -0.196 17635 7001 1 12 . 1 1 70 70 ALA N N 70 122.649 122.649 123.956 -1.307 17635 7002 1 12 . 1 1 70 70 ALA HA H 70 3.593 3.593 4.293 -0.700 17635 7003 1 12 . 1 1 70 70 ALA C C 70 172.686 172.686 179.540 -6.854 17635 7004 1 12 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.632 -0.596 17635 7005 1 12 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.429 -0.565 17635 7006 1 12 . 1 1 70 70 ALA H H 70 7.383 7.383 7.873 -0.490 17635 7007 1 12 . 1 1 71 71 LYS N N 71 116.308 116.308 119.818 -3.510 17635 7008 1 12 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.925 -0.150 17635 7009 1 12 . 1 1 71 71 LYS C C 71 172.333 172.333 178.520 -6.187 17635 7010 1 12 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.452 0.550 17635 7011 1 12 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.929 0.513 17635 7012 1 12 . 1 1 71 71 LYS H H 71 7.159 7.159 7.655 -0.496 17635 7013 1 12 . 1 1 72 72 ALA N N 72 119.806 119.806 121.415 -1.609 17635 7014 1 12 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.244 -0.078 17635 7015 1 12 . 1 1 72 72 ALA C C 72 170.530 170.530 179.683 -9.153 17635 7016 1 12 . 1 1 72 72 ALA CA C 72 54.715 54.715 55.050 -0.335 17635 7017 1 12 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.106 -0.286 17635 7018 1 12 . 1 1 72 72 ALA H H 72 7.924 7.924 8.020 -0.096 17635 7019 1 12 . 1 1 73 73 ALA N N 73 120.524 120.524 120.878 -0.354 17635 7020 1 12 . 1 1 73 73 ALA HA H 73 4.279 4.279 3.923 0.356 17635 7021 1 12 . 1 1 73 73 ALA C C 73 171.039 171.039 179.479 -8.440 17635 7022 1 12 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.724 0.656 17635 7023 1 12 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.207 0.924 17635 7024 1 12 . 1 1 73 73 ALA H H 73 8.104 8.104 7.559 0.545 17635 7025 1 12 . 1 1 74 74 ILE N N 74 119.875 119.875 117.619 2.256 17635 7026 1 12 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.674 -0.260 17635 7027 1 12 . 1 1 74 74 ILE C C 74 172.435 172.435 177.511 -5.076 17635 7028 1 12 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.015 0.829 17635 7029 1 12 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.557 1.186 17635 7030 1 12 . 1 1 74 74 ILE H H 74 7.574 7.574 7.807 -0.233 17635 7031 1 12 . 1 1 75 75 ASP N N 75 117.867 117.867 119.015 -1.148 17635 7032 1 12 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.482 -0.171 17635 7033 1 12 . 1 1 75 75 ASP C C 75 172.054 172.054 177.063 -5.009 17635 7034 1 12 . 1 1 75 75 ASP CA C 75 57.161 57.161 57.003 0.158 17635 7035 1 12 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.279 -0.748 17635 7036 1 12 . 1 1 75 75 ASP H H 75 7.937 7.937 8.283 -0.346 17635 7037 1 12 . 1 1 76 76 TRP N N 76 117.313 117.313 120.340 -3.027 17635 7038 1 12 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.734 -0.378 17635 7039 1 12 . 1 1 76 76 TRP C C 76 173.272 173.272 176.696 -3.424 17635 7040 1 12 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.097 1.365 17635 7041 1 12 . 1 1 76 76 TRP CB C 76 30.777 30.777 30.062 0.715 17635 7042 1 12 . 1 1 76 76 TRP H H 76 8.475 8.475 7.632 0.843 17635 7043 1 12 . 1 1 77 77 PHE N N 77 112.019 112.019 117.444 -5.425 17635 7044 1 12 . 1 1 77 77 PHE HA H 77 4.648 4.648 3.830 0.818 17635 7045 1 12 . 1 1 77 77 PHE C C 77 173.747 173.747 176.700 -2.953 17635 7046 1 12 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.353 -0.432 17635 7047 1 12 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.172 2.558 17635 7048 1 12 . 1 1 77 77 PHE H H 77 8.488 8.488 8.147 0.341 17635 7049 1 12 . 1 1 78 78 ASP N N 78 118.408 118.408 120.754 -2.346 17635 7050 1 12 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.448 0.016 17635 7051 1 12 . 1 1 78 78 ASP C C 78 172.542 172.542 176.362 -3.820 17635 7052 1 12 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.258 3.432 17635 7053 1 12 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.436 1.450 17635 7054 1 12 . 1 1 78 78 ASP H H 78 7.978 7.978 8.216 -0.238 17635 7055 1 12 . 1 1 79 79 GLY N N 79 115.548 115.548 105.144 10.404 17635 7056 1 12 . 1 1 79 79 GLY C C 79 175.680 175.680 173.404 2.276 17635 7057 1 12 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.894 1.178 17635 7058 1 12 . 1 1 79 79 GLY H H 79 8.615 8.615 8.457 0.158 17635 7059 1 12 . 1 1 80 80 LYS N N 80 120.271 120.271 117.940 2.331 17635 7060 1 12 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.436 0.026 17635 7061 1 12 . 1 1 80 80 LYS C C 80 175.853 175.853 175.110 0.743 17635 7062 1 12 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.619 0.531 17635 7063 1 12 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.000 -1.574 17635 7064 1 12 . 1 1 80 80 LYS H H 80 8.013 8.013 7.662 0.351 17635 7065 1 12 . 1 1 81 81 GLU N N 81 115.765 115.765 118.744 -2.979 17635 7066 1 12 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.398 -0.700 17635 7067 1 12 . 1 1 81 81 GLU C C 81 173.263 173.263 175.531 -2.268 17635 7068 1 12 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.254 0.670 17635 7069 1 12 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.607 0.435 17635 7070 1 12 . 1 1 81 81 GLU H H 81 8.201 8.201 8.362 -0.161 17635 7071 1 12 . 1 1 82 82 PHE N N 82 127.080 127.080 125.891 1.189 17635 7072 1 12 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.647 -0.151 17635 7073 1 12 . 1 1 82 82 PHE C C 82 175.349 175.349 175.313 0.036 17635 7074 1 12 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.070 0.646 17635 7075 1 12 . 1 1 82 82 PHE CB C 82 41.994 41.994 40.894 1.100 17635 7076 1 12 . 1 1 82 82 PHE H H 82 9.162 9.162 9.199 -0.037 17635 7077 1 12 . 1 1 83 83 SER N N 83 125.136 125.136 121.503 3.633 17635 7078 1 12 . 1 1 83 83 SER HA H 83 3.803 3.803 4.198 -0.395 17635 7079 1 12 . 1 1 83 83 SER C C 83 175.543 175.543 174.604 0.939 17635 7080 1 12 . 1 1 83 83 SER CA C 83 58.371 58.371 58.948 -0.577 17635 7081 1 12 . 1 1 83 83 SER CB C 83 62.519 62.519 62.885 -0.366 17635 7082 1 12 . 1 1 83 83 SER H H 83 9.193 9.193 9.234 -0.041 17635 7083 1 12 . 1 1 84 84 GLY N N 84 103.581 103.581 104.550 -0.969 17635 7084 1 12 . 1 1 84 84 GLY C C 84 177.188 177.188 173.256 3.932 17635 7085 1 12 . 1 1 84 84 GLY CA C 84 45.052 45.052 45.018 0.034 17635 7086 1 12 . 1 1 84 84 GLY H H 84 8.446 8.446 8.298 0.148 17635 7087 1 12 . 1 1 85 85 ASN N N 85 119.051 119.051 117.446 1.605 17635 7088 1 12 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.218 0.116 17635 7089 1 12 . 1 1 85 85 ASN C C 85 178.020 178.020 172.406 5.614 17635 7090 1 12 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.634 -0.163 17635 7091 1 12 . 1 1 85 85 ASN CB C 85 41.117 41.117 39.922 1.195 17635 7092 1 12 . 1 1 85 85 ASN H H 85 7.762 7.762 7.795 -0.033 17635 7093 1 12 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.323 -0.656 17635 7094 1 12 . 1 1 86 86 PRO C C 86 173.474 173.474 176.395 -2.921 17635 7095 1 12 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.397 0.313 17635 7096 1 12 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.054 -0.184 17635 7097 1 12 . 1 1 87 87 ILE N N 87 117.270 117.270 117.778 -0.508 17635 7098 1 12 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.452 -0.306 17635 7099 1 12 . 1 1 87 87 ILE C C 87 174.495 174.495 174.566 -0.071 17635 7100 1 12 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.608 0.883 17635 7101 1 12 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.886 -1.215 17635 7102 1 12 . 1 1 87 87 ILE H H 87 8.469 8.469 8.185 0.284 17635 7103 1 12 . 1 1 88 88 LYS N N 88 122.271 122.271 121.231 1.040 17635 7104 1 12 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.725 0.467 17635 7105 1 12 . 1 1 88 88 LYS C C 88 174.393 174.393 175.332 -0.939 17635 7106 1 12 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.325 -0.187 17635 7107 1 12 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.572 0.477 17635 7108 1 12 . 1 1 88 88 LYS H H 88 8.353 8.353 8.203 0.150 17635 7109 1 12 . 1 1 89 89 VAL N N 89 125.661 125.661 125.795 -0.134 17635 7110 1 12 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.692 0.271 17635 7111 1 12 . 1 1 89 89 VAL C C 89 177.160 177.160 176.093 1.067 17635 7112 1 12 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.276 -0.915 17635 7113 1 12 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.418 2.352 17635 7114 1 12 . 1 1 89 89 VAL H H 89 9.414 9.414 8.511 0.903 17635 7115 1 12 . 1 1 90 90 SER N N 90 119.538 119.538 120.466 -0.928 17635 7116 1 12 . 1 1 90 90 SER HA H 90 4.710 4.710 4.679 0.031 17635 7117 1 12 . 1 1 90 90 SER C C 90 176.533 176.533 173.587 2.946 17635 7118 1 12 . 1 1 90 90 SER CA C 90 56.936 56.936 56.821 0.115 17635 7119 1 12 . 1 1 90 90 SER CB C 90 66.470 66.470 65.973 0.497 17635 7120 1 12 . 1 1 90 90 SER H H 90 8.945 8.945 8.150 0.795 17635 7121 1 12 . 1 1 91 91 PHE N N 91 120.115 120.115 123.114 -2.999 17635 7122 1 12 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.656 0.017 17635 7123 1 12 . 1 1 91 91 PHE C C 91 173.349 173.349 175.162 -1.813 17635 7124 1 12 . 1 1 91 91 PHE CA C 91 61.155 61.155 55.227 5.928 17635 7125 1 12 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.558 1.945 17635 7126 1 12 . 1 1 91 91 PHE H H 91 8.919 8.919 8.841 0.078 17635 7127 1 12 . 1 1 92 92 ALA N N 92 124.386 124.386 123.481 0.905 17635 7128 1 12 . 1 1 92 92 ALA HA H 92 4.356 4.356 3.886 0.470 17635 7129 1 12 . 1 1 92 92 ALA C C 92 172.984 172.984 176.084 -3.100 17635 7130 1 12 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.547 -0.449 17635 7131 1 12 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.220 1.186 17635 7132 1 12 . 1 1 92 92 ALA H H 92 8.563 8.563 7.781 0.782 17635 7133 1 12 . 1 1 93 93 THR N N 93 116.073 116.073 114.452 1.621 17635 7134 1 12 . 1 1 93 93 THR HA H 93 4.208 4.208 3.886 0.322 17635 7135 1 12 . 1 1 93 93 THR C C 93 176.032 176.032 174.425 1.607 17635 7136 1 12 . 1 1 93 93 THR CA C 93 62.255 62.255 63.854 -1.599 17635 7137 1 12 . 1 1 93 93 THR CB C 93 69.708 69.708 69.011 0.697 17635 7138 1 12 . 1 1 93 93 THR H H 93 8.312 8.312 8.259 0.053 17635 7139 1 12 . 1 1 94 94 ARG N N 94 124.359 124.359 120.410 3.949 17635 7140 1 12 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.380 -0.043 17635 7141 1 12 . 1 1 94 94 ARG C C 94 174.426 174.426 175.757 -1.331 17635 7142 1 12 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.884 -0.829 17635 7143 1 12 . 1 1 94 94 ARG CB C 94 30.911 30.911 31.042 -0.131 17635 7144 1 12 . 1 1 94 94 ARG H H 94 8.493 8.493 8.623 -0.130 17635 7145 1 12 . 1 1 95 95 ARG N N 95 122.515 122.515 119.125 3.390 17635 7146 1 12 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.200 0.028 17635 7147 1 12 . 1 1 95 95 ARG C C 95 174.306 174.306 174.775 -0.469 17635 7148 1 12 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.061 0.081 17635 7149 1 12 . 1 1 95 95 ARG CB C 95 30.966 30.966 27.086 3.880 17635 7150 1 12 . 1 1 95 95 ARG H H 95 8.343 8.343 8.429 -0.086 17635 7151 1 12 . 1 1 96 96 ALA N N 96 125.127 125.127 123.217 1.910 17635 7152 1 12 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.165 0.044 17635 7153 1 12 . 1 1 96 96 ALA C C 96 173.226 173.226 177.347 -4.121 17635 7154 1 12 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.702 0.068 17635 7155 1 12 . 1 1 96 96 ALA CB C 96 19.193 19.193 18.657 0.536 17635 7156 1 12 . 1 1 96 96 ALA H H 96 8.402 8.402 8.358 0.044 17635 7157 1 12 . 1 1 97 97 ASP N N 97 118.483 118.483 122.735 -4.252 17635 7158 1 12 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.679 -0.181 17635 7159 1 12 . 1 1 97 97 ASP C C 97 174.302 174.302 174.862 -0.560 17635 7160 1 12 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.066 0.025 17635 7161 1 12 . 1 1 97 97 ASP CB C 97 40.907 40.907 42.656 -1.749 17635 7162 1 12 . 1 1 97 97 ASP H H 97 8.206 8.206 8.482 -0.276 17635 7163 1 12 . 1 1 98 98 PHE N N 98 120.321 120.321 121.161 -0.840 17635 7164 1 12 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.793 -0.303 17635 7165 1 12 . 1 1 98 98 PHE C C 98 174.878 174.878 174.706 0.172 17635 7166 1 12 . 1 1 98 98 PHE CA C 98 58.160 58.160 57.043 1.117 17635 7167 1 12 . 1 1 98 98 PHE CB C 98 39.303 39.303 40.360 -1.057 17635 7168 1 12 . 1 1 98 98 PHE H H 98 7.990 7.990 8.372 -0.382 17635 7169 1 12 . 1 1 99 99 ASN N N 99 120.016 120.016 121.542 -1.526 17635 7170 1 12 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.582 0.027 17635 7171 1 12 . 1 1 99 99 ASN C C 99 175.348 175.348 175.118 0.230 17635 7172 1 12 . 1 1 99 99 ASN CA C 99 53.313 53.313 52.915 0.398 17635 7173 1 12 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.061 0.666 17635 7174 1 12 . 1 1 99 99 ASN H H 99 8.336 8.336 8.372 -0.036 17635 7175 1 12 . 1 1 100 100 ARG N N 100 121.374 121.374 120.101 1.273 17635 7176 1 12 . 1 1 100 100 ARG HA H 100 4.273 4.273 3.992 0.281 17635 7177 1 12 . 1 1 100 100 ARG C C 100 173.627 173.627 174.885 -1.258 17635 7178 1 12 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.725 -0.233 17635 7179 1 12 . 1 1 100 100 ARG CB C 100 30.519 30.519 29.473 1.046 17635 7180 1 12 . 1 1 100 100 ARG H H 100 8.181 8.181 7.997 0.184 17635 7181 1 12 . 1 1 101 101 GLY N N 101 109.586 109.586 110.677 -1.091 17635 7182 1 12 . 1 1 101 101 GLY C C 101 175.739 175.739 173.949 1.790 17635 7183 1 12 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.765 0.615 17635 7184 1 12 . 1 1 101 101 GLY H H 101 8.413 8.413 8.100 0.313 17635 7185 1 12 . 1 1 102 102 GLY N N 102 108.692 108.692 107.618 1.074 17635 7186 1 12 . 1 1 102 102 GLY C C 102 176.286 176.286 174.755 1.531 17635 7187 1 12 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.123 0.215 17635 7188 1 12 . 1 1 102 102 GLY H H 102 8.281 8.281 8.322 -0.041 17635 7189 1 12 . 1 1 103 103 GLY N N 103 108.844 108.844 108.486 0.358 17635 7190 1 12 . 1 1 103 103 GLY C C 103 175.798 175.798 172.857 2.941 17635 7191 1 12 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.988 0.358 17635 7192 1 12 . 1 1 103 103 GLY H H 103 8.364 8.364 8.058 0.306 17635 7193 1 12 . 1 1 104 104 ASN N N 104 118.527 118.527 116.115 2.412 17635 7194 1 12 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.769 -0.051 17635 7195 1 12 . 1 1 104 104 ASN C C 104 174.547 174.547 175.628 -1.081 17635 7196 1 12 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.292 -0.083 17635 7197 1 12 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.582 -0.703 17635 7198 1 12 . 1 1 104 104 ASN H H 104 8.438 8.438 8.689 -0.251 17635 7199 1 12 . 1 1 105 105 GLY N N 105 109.166 109.166 111.127 -1.961 17635 7200 1 12 . 1 1 105 105 GLY C C 105 176.074 176.074 174.694 1.380 17635 7201 1 12 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.326 0.276 17635 7202 1 12 . 1 1 105 105 GLY H H 105 8.477 8.477 8.266 0.211 17635 7203 1 12 . 1 1 106 106 ARG N N 106 120.341 120.341 122.193 -1.852 17635 7204 1 12 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.231 0.120 17635 7205 1 12 . 1 1 106 106 ARG C C 106 173.491 173.491 177.431 -3.940 17635 7206 1 12 . 1 1 106 106 ARG CA C 106 56.227 56.227 56.668 -0.441 17635 7207 1 12 . 1 1 106 106 ARG CB C 106 30.629 30.629 31.045 -0.416 17635 7208 1 12 . 1 1 106 106 ARG H H 106 8.244 8.244 8.241 0.003 17635 7209 1 12 . 1 1 107 107 GLY N N 107 109.856 109.856 110.414 -0.558 17635 7210 1 12 . 1 1 107 107 GLY C C 107 175.834 175.834 173.505 2.329 17635 7211 1 12 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.858 0.583 17635 7212 1 12 . 1 1 107 107 GLY H H 107 8.522 8.522 8.799 -0.277 17635 7213 1 13 . 1 1 2 2 GLN N N 2 121.692 121.692 119.333 2.359 17635 7214 1 13 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.556 -0.290 17635 7215 1 13 . 1 1 2 2 GLN C C 2 175.248 175.248 174.491 0.757 17635 7216 1 13 . 1 1 2 2 GLN CA C 2 55.996 55.996 54.749 1.247 17635 7217 1 13 . 1 1 2 2 GLN CB C 2 29.639 29.639 30.794 -1.155 17635 7218 1 13 . 1 1 2 2 GLN H H 2 8.621 8.621 7.954 0.667 17635 7219 1 13 . 1 1 3 3 ASP N N 3 121.801 121.801 119.842 1.959 17635 7220 1 13 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.929 -0.361 17635 7221 1 13 . 1 1 3 3 ASP C C 3 174.336 174.336 174.356 -0.020 17635 7222 1 13 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.378 -0.316 17635 7223 1 13 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.462 -0.391 17635 7224 1 13 . 1 1 3 3 ASP H H 3 8.436 8.436 8.228 0.208 17635 7225 1 13 . 1 1 4 4 ASN N N 4 120.292 120.292 123.151 -2.859 17635 7226 1 13 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.584 0.053 17635 7227 1 13 . 1 1 4 4 ASN C C 4 174.415 174.415 174.794 -0.379 17635 7228 1 13 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.922 -0.061 17635 7229 1 13 . 1 1 4 4 ASN CB C 4 38.534 38.534 39.243 -0.709 17635 7230 1 13 . 1 1 4 4 ASN H H 4 8.528 8.528 9.390 -0.862 17635 7231 1 13 . 1 1 5 5 SER N N 5 117.091 117.091 114.001 3.090 17635 7232 1 13 . 1 1 5 5 SER HA H 5 4.163 4.163 4.697 -0.534 17635 7233 1 13 . 1 1 5 5 SER C C 5 176.370 176.370 173.530 2.840 17635 7234 1 13 . 1 1 5 5 SER CA C 5 60.846 60.846 58.700 2.146 17635 7235 1 13 . 1 1 5 5 SER CB C 5 63.136 63.136 63.411 -0.275 17635 7236 1 13 . 1 1 5 5 SER H H 5 8.470 8.470 8.366 0.104 17635 7237 1 13 . 1 1 6 6 ASP N N 6 119.436 119.436 119.159 0.277 17635 7238 1 13 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.681 0.014 17635 7239 1 13 . 1 1 6 6 ASP C C 6 175.048 175.048 174.140 0.908 17635 7240 1 13 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.489 -0.394 17635 7241 1 13 . 1 1 6 6 ASP CB C 6 40.935 40.935 39.867 1.068 17635 7242 1 13 . 1 1 6 6 ASP H H 6 8.218 8.218 8.073 0.145 17635 7243 1 13 . 1 1 7 7 ASN N N 7 119.696 119.696 115.180 4.516 17635 7244 1 13 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.812 -0.184 17635 7245 1 13 . 1 1 7 7 ASN C C 7 176.539 176.539 173.755 2.784 17635 7246 1 13 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.046 0.112 17635 7247 1 13 . 1 1 7 7 ASN CB C 7 38.859 38.859 40.430 -1.571 17635 7248 1 13 . 1 1 7 7 ASN H H 7 7.734 7.734 7.508 0.226 17635 7249 1 13 . 1 1 8 8 ASN N N 8 119.436 119.436 116.049 3.387 17635 7250 1 13 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.895 -0.027 17635 7251 1 13 . 1 1 8 8 ASN C C 8 175.327 175.327 175.339 -0.012 17635 7252 1 13 . 1 1 8 8 ASN CA C 8 53.204 53.204 53.348 -0.144 17635 7253 1 13 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.023 -0.528 17635 7254 1 13 . 1 1 8 8 ASN H H 8 8.350 8.350 8.554 -0.204 17635 7255 1 13 . 1 1 9 9 THR N N 9 118.650 118.650 116.369 2.281 17635 7256 1 13 . 1 1 9 9 THR HA H 9 5.557 5.557 4.597 0.960 17635 7257 1 13 . 1 1 9 9 THR C C 9 177.117 177.117 174.374 2.743 17635 7258 1 13 . 1 1 9 9 THR CA C 9 62.314 62.314 63.761 -1.448 17635 7259 1 13 . 1 1 9 9 THR CB C 9 71.225 71.225 68.408 2.817 17635 7260 1 13 . 1 1 9 9 THR H H 9 8.428 8.428 7.552 0.876 17635 7261 1 13 . 1 1 10 10 ILE N N 10 118.556 118.556 122.613 -4.057 17635 7262 1 13 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.410 -0.245 17635 7263 1 13 . 1 1 10 10 ILE C C 10 176.837 176.837 174.276 2.561 17635 7264 1 13 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.706 0.592 17635 7265 1 13 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.422 -1.542 17635 7266 1 13 . 1 1 10 10 ILE H H 10 8.770 8.770 9.068 -0.298 17635 7267 1 13 . 1 1 11 11 PHE N N 11 123.798 123.798 120.430 3.368 17635 7268 1 13 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.063 0.357 17635 7269 1 13 . 1 1 11 11 PHE C C 11 177.066 177.066 173.602 3.464 17635 7270 1 13 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.543 -0.181 17635 7271 1 13 . 1 1 11 11 PHE CB C 11 41.868 41.868 40.933 0.935 17635 7272 1 13 . 1 1 11 11 PHE H H 11 9.548 9.548 8.876 0.672 17635 7273 1 13 . 1 1 12 12 VAL N N 12 127.993 127.993 126.418 1.575 17635 7274 1 13 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.442 0.516 17635 7275 1 13 . 1 1 12 12 VAL C C 12 176.965 176.965 175.020 1.945 17635 7276 1 13 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.051 -1.216 17635 7277 1 13 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.659 2.141 17635 7278 1 13 . 1 1 12 12 VAL H H 12 8.940 8.940 8.678 0.262 17635 7279 1 13 . 1 1 13 13 GLN N N 13 122.289 122.289 126.450 -4.161 17635 7280 1 13 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.571 0.208 17635 7281 1 13 . 1 1 13 13 GLN C C 13 175.631 175.631 175.536 0.095 17635 7282 1 13 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.963 0.147 17635 7283 1 13 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.599 3.533 17635 7284 1 13 . 1 1 13 13 GLN H H 13 8.747 8.747 7.822 0.925 17635 7285 1 13 . 1 1 14 14 GLY N N 14 109.212 109.212 112.885 -3.673 17635 7286 1 13 . 1 1 14 14 GLY C C 14 175.436 175.436 172.462 2.974 17635 7287 1 13 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.452 -0.022 17635 7288 1 13 . 1 1 14 14 GLY H H 14 8.236 8.236 8.431 -0.195 17635 7289 1 13 . 1 1 15 15 LEU N N 15 117.824 117.824 122.840 -5.016 17635 7290 1 13 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.556 -0.850 17635 7291 1 13 . 1 1 15 15 LEU C C 15 174.111 174.111 175.791 -1.680 17635 7292 1 13 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.277 0.441 17635 7293 1 13 . 1 1 15 15 LEU CB C 15 42.433 42.433 43.939 -1.506 17635 7294 1 13 . 1 1 15 15 LEU H H 15 8.442 8.442 8.470 -0.028 17635 7295 1 13 . 1 1 16 16 GLY N N 16 105.063 105.063 106.208 -1.145 17635 7296 1 13 . 1 1 16 16 GLY C C 16 177.771 177.771 174.211 3.560 17635 7297 1 13 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.312 -0.218 17635 7298 1 13 . 1 1 16 16 GLY H H 16 8.006 8.006 7.740 0.266 17635 7299 1 13 . 1 1 17 17 GLU N N 17 113.781 113.781 117.473 -3.692 17635 7300 1 13 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.656 0.463 17635 7301 1 13 . 1 1 17 17 GLU C C 17 173.937 173.937 175.820 -1.883 17635 7302 1 13 . 1 1 17 17 GLU CA C 17 57.281 57.281 57.394 -0.113 17635 7303 1 13 . 1 1 17 17 GLU CB C 17 30.436 30.436 28.883 1.553 17635 7304 1 13 . 1 1 17 17 GLU H H 17 8.134 8.134 8.396 -0.262 17635 7305 1 13 . 1 1 18 18 ASN N N 18 116.660 116.660 112.689 3.971 17635 7306 1 13 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.560 0.381 17635 7307 1 13 . 1 1 18 18 ASN C C 18 175.900 175.900 173.605 2.295 17635 7308 1 13 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.644 -0.166 17635 7309 1 13 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.035 -0.550 17635 7310 1 13 . 1 1 18 18 ASN H H 18 8.407 8.407 7.846 0.561 17635 7311 1 13 . 1 1 19 19 VAL N N 19 118.323 118.323 121.510 -3.187 17635 7312 1 13 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.717 0.435 17635 7313 1 13 . 1 1 19 19 VAL C C 19 177.655 177.655 175.048 2.607 17635 7314 1 13 . 1 1 19 19 VAL CA C 19 61.877 61.877 62.831 -0.954 17635 7315 1 13 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.093 2.420 17635 7316 1 13 . 1 1 19 19 VAL H H 19 6.855 6.855 7.483 -0.628 17635 7317 1 13 . 1 1 20 20 THR N N 20 111.636 111.636 121.333 -9.697 17635 7318 1 13 . 1 1 20 20 THR HA H 20 4.719 4.719 4.654 0.065 17635 7319 1 13 . 1 1 20 20 THR C C 20 175.266 175.266 175.387 -0.121 17635 7320 1 13 . 1 1 20 20 THR CA C 20 58.698 58.698 60.077 -1.379 17635 7321 1 13 . 1 1 20 20 THR CB C 20 72.948 72.948 72.202 0.746 17635 7322 1 13 . 1 1 20 20 THR H H 20 7.328 7.328 7.988 -0.660 17635 7323 1 13 . 1 1 21 21 ILE N N 21 122.147 122.147 123.764 -1.617 17635 7324 1 13 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.758 -0.240 17635 7325 1 13 . 1 1 21 21 ILE C C 21 173.198 173.198 177.763 -4.565 17635 7326 1 13 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.550 1.222 17635 7327 1 13 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.010 0.573 17635 7328 1 13 . 1 1 21 21 ILE H H 21 9.074 9.074 8.812 0.262 17635 7329 1 13 . 1 1 22 22 GLU N N 22 118.154 118.154 120.014 -1.860 17635 7330 1 13 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.095 -0.109 17635 7331 1 13 . 1 1 22 22 GLU C C 22 171.799 171.799 178.338 -6.539 17635 7332 1 13 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.674 0.939 17635 7333 1 13 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.497 0.294 17635 7334 1 13 . 1 1 22 22 GLU H H 22 8.814 8.814 8.707 0.107 17635 7335 1 13 . 1 1 23 23 SER N N 23 115.921 115.921 115.445 0.476 17635 7336 1 13 . 1 1 23 23 SER HA H 23 4.384 4.384 4.296 0.088 17635 7337 1 13 . 1 1 23 23 SER C C 23 172.447 172.447 176.570 -4.123 17635 7338 1 13 . 1 1 23 23 SER CA C 23 61.239 61.239 61.273 -0.034 17635 7339 1 13 . 1 1 23 23 SER CB C 23 62.838 62.838 62.711 0.127 17635 7340 1 13 . 1 1 23 23 SER H H 23 8.236 8.236 8.280 -0.044 17635 7341 1 13 . 1 1 24 24 VAL N N 24 124.867 124.867 122.421 2.446 17635 7342 1 13 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.215 -0.467 17635 7343 1 13 . 1 1 24 24 VAL C C 24 173.016 173.016 177.852 -4.836 17635 7344 1 13 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.641 0.613 17635 7345 1 13 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.818 -0.285 17635 7346 1 13 . 1 1 24 24 VAL H H 24 7.973 7.973 8.427 -0.454 17635 7347 1 13 . 1 1 25 25 ALA N N 25 123.198 123.198 120.829 2.369 17635 7348 1 13 . 1 1 25 25 ALA HA H 25 3.899 3.899 3.977 -0.078 17635 7349 1 13 . 1 1 25 25 ALA C C 25 171.061 171.061 178.436 -7.375 17635 7350 1 13 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.789 0.906 17635 7351 1 13 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.238 -0.500 17635 7352 1 13 . 1 1 25 25 ALA H H 25 8.695 8.695 8.417 0.278 17635 7353 1 13 . 1 1 26 26 ASP N N 26 115.503 115.503 117.924 -2.421 17635 7354 1 13 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.520 -0.197 17635 7355 1 13 . 1 1 26 26 ASP C C 26 173.108 173.108 178.601 -5.493 17635 7356 1 13 . 1 1 26 26 ASP CA C 26 57.323 57.323 57.178 0.145 17635 7357 1 13 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.521 -0.469 17635 7358 1 13 . 1 1 26 26 ASP H H 26 8.312 8.312 8.157 0.155 17635 7359 1 13 . 1 1 27 27 TYR N N 27 119.224 119.224 119.680 -0.456 17635 7360 1 13 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.366 -0.166 17635 7361 1 13 . 1 1 27 27 TYR C C 27 172.908 172.908 176.423 -3.515 17635 7362 1 13 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.666 1.350 17635 7363 1 13 . 1 1 27 27 TYR CB C 27 39.932 39.932 38.598 1.334 17635 7364 1 13 . 1 1 27 27 TYR H H 27 7.533 7.533 7.763 -0.230 17635 7365 1 13 . 1 1 28 28 PHE N N 28 112.595 112.595 118.478 -5.883 17635 7366 1 13 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.040 0.290 17635 7367 1 13 . 1 1 28 28 PHE C C 28 173.082 173.082 175.176 -2.094 17635 7368 1 13 . 1 1 28 28 PHE CA C 28 61.784 61.784 56.347 5.437 17635 7369 1 13 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.229 1.774 17635 7370 1 13 . 1 1 28 28 PHE H H 28 7.974 7.974 7.662 0.312 17635 7371 1 13 . 1 1 29 29 LYS N N 29 118.820 118.820 118.015 0.805 17635 7372 1 13 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.662 0.255 17635 7373 1 13 . 1 1 29 29 LYS C C 29 173.682 173.682 176.784 -3.102 17635 7374 1 13 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.243 2.037 17635 7375 1 13 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.659 -0.368 17635 7376 1 13 . 1 1 29 29 LYS H H 29 8.325 8.325 7.405 0.920 17635 7377 1 13 . 1 1 30 30 GLN N N 30 116.232 116.232 118.675 -2.443 17635 7378 1 13 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.223 -0.088 17635 7379 1 13 . 1 1 30 30 GLN C C 30 173.790 173.790 176.948 -3.158 17635 7380 1 13 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.422 0.124 17635 7381 1 13 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.922 0.977 17635 7382 1 13 . 1 1 30 30 GLN H H 30 7.518 7.518 8.079 -0.561 17635 7383 1 13 . 1 1 31 31 ILE N N 31 116.489 116.489 118.816 -2.327 17635 7384 1 13 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.194 0.045 17635 7385 1 13 . 1 1 31 31 ILE C C 31 175.599 175.599 175.538 0.061 17635 7386 1 13 . 1 1 31 31 ILE CA C 31 58.221 58.221 60.893 -2.672 17635 7387 1 13 . 1 1 31 31 ILE CB C 31 40.334 40.334 39.174 1.160 17635 7388 1 13 . 1 1 31 31 ILE H H 31 7.809 7.809 7.881 -0.072 17635 7389 1 13 . 1 1 32 32 GLY N N 32 107.416 107.416 104.744 2.672 17635 7390 1 13 . 1 1 32 32 GLY C C 32 180.182 180.182 171.927 8.255 17635 7391 1 13 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.731 0.263 17635 7392 1 13 . 1 1 32 32 GLY H H 32 7.344 7.344 7.506 -0.162 17635 7393 1 13 . 1 1 33 33 ILE N N 33 117.784 117.784 120.517 -2.733 17635 7394 1 13 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.214 -0.125 17635 7395 1 13 . 1 1 33 33 ILE C C 33 173.301 173.301 175.122 -1.821 17635 7396 1 13 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.607 1.034 17635 7397 1 13 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.221 -0.562 17635 7398 1 13 . 1 1 33 33 ILE H H 33 8.173 8.173 8.417 -0.244 17635 7399 1 13 . 1 1 34 34 ILE N N 34 131.781 131.781 126.404 5.377 17635 7400 1 13 . 1 1 34 34 ILE HA H 34 3.787 3.787 3.870 -0.083 17635 7401 1 13 . 1 1 34 34 ILE C C 34 174.663 174.663 175.753 -1.090 17635 7402 1 13 . 1 1 34 34 ILE CA C 34 61.370 61.370 59.536 1.834 17635 7403 1 13 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.461 -0.466 17635 7404 1 13 . 1 1 34 34 ILE H H 34 8.687 8.687 8.207 0.480 17635 7405 1 13 . 1 1 35 35 LYS N N 35 130.372 130.372 128.449 1.923 17635 7406 1 13 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.048 0.036 17635 7407 1 13 . 1 1 35 35 LYS C C 35 175.376 175.376 176.920 -1.544 17635 7408 1 13 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.859 0.614 17635 7409 1 13 . 1 1 35 35 LYS CB C 35 33.664 33.664 30.851 2.813 17635 7410 1 13 . 1 1 35 35 LYS H H 35 8.680 8.680 8.192 0.488 17635 7411 1 13 . 1 1 36 36 THR N N 36 118.312 118.312 118.758 -0.446 17635 7412 1 13 . 1 1 36 36 THR HA H 36 4.415 4.415 4.267 0.148 17635 7413 1 13 . 1 1 36 36 THR C C 36 176.394 176.394 174.296 2.098 17635 7414 1 13 . 1 1 36 36 THR CA C 36 61.340 61.340 61.425 -0.085 17635 7415 1 13 . 1 1 36 36 THR CB C 36 70.809 70.809 70.455 0.354 17635 7416 1 13 . 1 1 36 36 THR H H 36 8.456 8.456 8.133 0.323 17635 7417 1 13 . 1 1 37 37 ASN N N 37 124.092 124.092 121.343 2.749 17635 7418 1 13 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.827 -0.297 17635 7419 1 13 . 1 1 37 37 ASN C C 37 174.235 174.235 175.967 -1.732 17635 7420 1 13 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.746 1.318 17635 7421 1 13 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.270 -0.343 17635 7422 1 13 . 1 1 37 37 ASN H H 37 8.794 8.794 8.620 0.174 17635 7423 1 13 . 1 1 38 38 LYS N N 38 127.969 127.969 121.295 6.674 17635 7424 1 13 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.158 -0.154 17635 7425 1 13 . 1 1 38 38 LYS C C 38 172.702 172.702 176.898 -4.196 17635 7426 1 13 . 1 1 38 38 LYS CA C 38 58.458 58.458 57.686 0.772 17635 7427 1 13 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.436 0.730 17635 7428 1 13 . 1 1 38 38 LYS H H 38 8.962 8.962 8.725 0.237 17635 7429 1 13 . 1 1 39 39 LYS N N 39 117.413 117.413 118.003 -0.590 17635 7430 1 13 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.287 -0.029 17635 7431 1 13 . 1 1 39 39 LYS C C 39 172.261 172.261 177.122 -4.861 17635 7432 1 13 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.028 0.291 17635 7433 1 13 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.184 0.613 17635 7434 1 13 . 1 1 39 39 LYS H H 39 8.314 8.314 7.995 0.319 17635 7435 1 13 . 1 1 40 40 THR N N 40 105.547 105.547 108.620 -3.073 17635 7436 1 13 . 1 1 40 40 THR HA H 40 4.465 4.465 4.438 0.027 17635 7437 1 13 . 1 1 40 40 THR C C 40 174.021 174.021 175.848 -1.827 17635 7438 1 13 . 1 1 40 40 THR CA C 40 61.260 61.260 60.976 0.284 17635 7439 1 13 . 1 1 40 40 THR CB C 40 70.997 70.997 68.793 2.204 17635 7440 1 13 . 1 1 40 40 THR H H 40 7.422 7.422 7.501 -0.079 17635 7441 1 13 . 1 1 41 41 GLY N N 41 111.631 111.631 111.210 0.421 17635 7442 1 13 . 1 1 41 41 GLY C C 41 176.727 176.727 173.897 2.830 17635 7443 1 13 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.559 0.171 17635 7444 1 13 . 1 1 41 41 GLY H H 41 8.644 8.644 8.160 0.484 17635 7445 1 13 . 1 1 42 42 GLN N N 42 118.894 118.894 118.676 0.218 17635 7446 1 13 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.852 -0.183 17635 7447 1 13 . 1 1 42 42 GLN C C 42 177.178 177.178 173.613 3.565 17635 7448 1 13 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.352 1.229 17635 7449 1 13 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.349 -0.119 17635 7450 1 13 . 1 1 42 42 GLN H H 42 7.662 7.662 8.758 -1.096 17635 7451 1 13 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.196 0.399 17635 7452 1 13 . 1 1 43 43 PRO C C 43 172.629 172.629 176.180 -3.551 17635 7453 1 13 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.837 -1.015 17635 7454 1 13 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.061 0.635 17635 7455 1 13 . 1 1 44 44 MET N N 44 124.162 124.162 122.097 2.065 17635 7456 1 13 . 1 1 44 44 MET HA H 44 4.432 4.432 4.691 -0.259 17635 7457 1 13 . 1 1 44 44 MET C C 44 176.474 176.474 174.834 1.640 17635 7458 1 13 . 1 1 44 44 MET CA C 44 55.419 55.419 54.897 0.522 17635 7459 1 13 . 1 1 44 44 MET CB C 44 30.555 30.555 35.472 -4.917 17635 7460 1 13 . 1 1 44 44 MET H H 44 8.874 8.874 8.121 0.752 17635 7461 1 13 . 1 1 45 45 ILE N N 45 126.237 126.237 121.693 4.544 17635 7462 1 13 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.540 0.262 17635 7463 1 13 . 1 1 45 45 ILE C C 45 176.415 176.415 174.329 2.086 17635 7464 1 13 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.080 -0.863 17635 7465 1 13 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.365 -0.139 17635 7466 1 13 . 1 1 45 45 ILE H H 45 7.730 7.730 8.490 -0.760 17635 7467 1 13 . 1 1 46 46 ASN N N 46 124.735 124.735 124.721 0.014 17635 7468 1 13 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.021 -0.080 17635 7469 1 13 . 1 1 46 46 ASN C C 46 176.836 176.836 173.497 3.339 17635 7470 1 13 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.380 -0.819 17635 7471 1 13 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.236 0.234 17635 7472 1 13 . 1 1 46 46 ASN H H 46 8.384 8.384 8.867 -0.483 17635 7473 1 13 . 1 1 47 47 LEU N N 47 122.487 122.487 124.900 -2.413 17635 7474 1 13 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.499 0.216 17635 7475 1 13 . 1 1 47 47 LEU C C 47 174.190 174.190 176.064 -1.874 17635 7476 1 13 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.654 -0.322 17635 7477 1 13 . 1 1 47 47 LEU CB C 47 42.277 42.277 43.644 -1.367 17635 7478 1 13 . 1 1 47 47 LEU H H 47 8.594 8.594 8.276 0.318 17635 7479 1 13 . 1 1 48 48 TYR N N 48 121.842 121.842 120.235 1.607 17635 7480 1 13 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.917 -0.150 17635 7481 1 13 . 1 1 48 48 TYR C C 48 173.649 173.649 175.653 -2.004 17635 7482 1 13 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.675 1.219 17635 7483 1 13 . 1 1 48 48 TYR CB C 48 39.199 39.199 40.547 -1.348 17635 7484 1 13 . 1 1 48 48 TYR H H 48 7.666 7.666 8.333 -0.667 17635 7485 1 13 . 1 1 49 49 THR N N 49 116.554 116.554 113.217 3.337 17635 7486 1 13 . 1 1 49 49 THR HA H 49 4.806 4.806 4.439 0.367 17635 7487 1 13 . 1 1 49 49 THR C C 49 176.654 176.654 172.767 3.887 17635 7488 1 13 . 1 1 49 49 THR CA C 49 60.693 60.693 59.559 1.134 17635 7489 1 13 . 1 1 49 49 THR CB C 49 71.437 71.437 71.177 0.259 17635 7490 1 13 . 1 1 49 49 THR H H 49 8.965 8.965 8.398 0.567 17635 7491 1 13 . 1 1 50 50 ASP N N 50 123.826 123.826 124.115 -0.289 17635 7492 1 13 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.782 -0.158 17635 7493 1 13 . 1 1 50 50 ASP C C 50 173.380 173.380 176.750 -3.370 17635 7494 1 13 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.631 -0.543 17635 7495 1 13 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.340 1.526 17635 7496 1 13 . 1 1 50 50 ASP H H 50 8.939 8.939 8.663 0.276 17635 7497 1 13 . 1 1 51 51 ARG N N 51 127.794 127.794 125.425 2.369 17635 7498 1 13 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.186 -0.141 17635 7499 1 13 . 1 1 51 51 ARG C C 51 173.101 173.101 176.473 -3.372 17635 7500 1 13 . 1 1 51 51 ARG CA C 51 58.562 58.562 57.922 0.640 17635 7501 1 13 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.616 0.551 17635 7502 1 13 . 1 1 51 51 ARG H H 51 8.958 8.958 8.719 0.239 17635 7503 1 13 . 1 1 52 52 GLU N N 52 117.542 117.542 120.106 -2.564 17635 7504 1 13 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.389 -0.111 17635 7505 1 13 . 1 1 52 52 GLU C C 52 172.201 172.201 177.950 -5.749 17635 7506 1 13 . 1 1 52 52 GLU CA C 52 58.524 58.524 57.622 0.902 17635 7507 1 13 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.512 0.765 17635 7508 1 13 . 1 1 52 52 GLU H H 52 8.561 8.561 8.204 0.357 17635 7509 1 13 . 1 1 53 53 THR N N 53 107.065 107.065 109.043 -1.978 17635 7510 1 13 . 1 1 53 53 THR HA H 53 4.436 4.436 4.152 0.284 17635 7511 1 13 . 1 1 53 53 THR C C 53 173.851 173.851 175.638 -1.787 17635 7512 1 13 . 1 1 53 53 THR CA C 53 61.944 61.944 62.668 -0.724 17635 7513 1 13 . 1 1 53 53 THR CB C 53 71.197 71.197 69.336 1.861 17635 7514 1 13 . 1 1 53 53 THR H H 53 8.087 8.087 7.919 0.168 17635 7515 1 13 . 1 1 54 54 GLY N N 54 111.295 111.295 111.874 -0.579 17635 7516 1 13 . 1 1 54 54 GLY C C 54 176.747 176.747 173.943 2.804 17635 7517 1 13 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.486 0.217 17635 7518 1 13 . 1 1 54 54 GLY H H 54 8.423 8.423 7.922 0.501 17635 7519 1 13 . 1 1 55 55 LYS N N 55 119.673 119.673 119.503 0.170 17635 7520 1 13 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.892 -0.539 17635 7521 1 13 . 1 1 55 55 LYS C C 55 173.854 173.854 175.464 -1.610 17635 7522 1 13 . 1 1 55 55 LYS CA C 55 55.842 55.842 55.446 0.397 17635 7523 1 13 . 1 1 55 55 LYS CB C 55 33.821 33.821 34.978 -1.157 17635 7524 1 13 . 1 1 55 55 LYS H H 55 7.767 7.767 7.771 -0.004 17635 7525 1 13 . 1 1 56 56 LEU N N 56 122.426 122.426 117.919 4.507 17635 7526 1 13 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.527 -0.171 17635 7527 1 13 . 1 1 56 56 LEU C C 56 172.534 172.534 175.775 -3.241 17635 7528 1 13 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.224 2.031 17635 7529 1 13 . 1 1 56 56 LEU CB C 56 41.654 41.654 45.294 -3.639 17635 7530 1 13 . 1 1 56 56 LEU H H 56 8.768 8.768 8.203 0.565 17635 7531 1 13 . 1 1 57 57 LYS N N 57 118.264 118.264 119.947 -1.683 17635 7532 1 13 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.292 -0.004 17635 7533 1 13 . 1 1 57 57 LYS C C 57 173.648 173.648 177.550 -3.902 17635 7534 1 13 . 1 1 57 57 LYS CA C 57 56.264 56.264 57.359 -1.095 17635 7535 1 13 . 1 1 57 57 LYS CB C 57 34.062 34.062 34.043 0.019 17635 7536 1 13 . 1 1 57 57 LYS H H 57 8.012 8.012 8.800 -0.788 17635 7537 1 13 . 1 1 58 58 GLY N N 58 108.514 108.514 106.736 1.778 17635 7538 1 13 . 1 1 58 58 GLY C C 58 177.876 177.876 172.379 5.497 17635 7539 1 13 . 1 1 58 58 GLY CA C 58 46.364 46.364 44.901 1.463 17635 7540 1 13 . 1 1 58 58 GLY H H 58 8.334 8.334 8.096 0.238 17635 7541 1 13 . 1 1 59 59 GLU N N 59 116.119 116.119 116.321 -0.202 17635 7542 1 13 . 1 1 59 59 GLU HA H 59 5.521 5.521 4.875 0.646 17635 7543 1 13 . 1 1 59 59 GLU C C 59 173.860 173.860 173.530 0.330 17635 7544 1 13 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.898 -1.873 17635 7545 1 13 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.545 0.759 17635 7546 1 13 . 1 1 59 59 GLU H H 59 7.202 7.202 7.676 -0.474 17635 7547 1 13 . 1 1 60 60 ALA N N 60 123.607 123.607 121.421 2.186 17635 7548 1 13 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.707 0.900 17635 7549 1 13 . 1 1 60 60 ALA C C 60 173.923 173.923 175.376 -1.453 17635 7550 1 13 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.836 -0.892 17635 7551 1 13 . 1 1 60 60 ALA CB C 60 24.059 24.059 22.711 1.348 17635 7552 1 13 . 1 1 60 60 ALA H H 60 8.930 8.930 9.063 -0.133 17635 7553 1 13 . 1 1 61 61 THR N N 61 108.384 108.384 114.604 -6.220 17635 7554 1 13 . 1 1 61 61 THR HA H 61 5.743 5.743 5.012 0.731 17635 7555 1 13 . 1 1 61 61 THR C C 61 176.172 176.172 174.009 2.163 17635 7556 1 13 . 1 1 61 61 THR CA C 61 59.625 59.625 61.073 -1.448 17635 7557 1 13 . 1 1 61 61 THR CB C 61 71.224 71.224 69.888 1.335 17635 7558 1 13 . 1 1 61 61 THR H H 61 8.452 8.452 8.766 -0.314 17635 7559 1 13 . 1 1 62 62 VAL N N 62 120.200 120.200 126.030 -5.830 17635 7560 1 13 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.249 -0.005 17635 7561 1 13 . 1 1 62 62 VAL C C 62 175.994 175.994 175.017 0.977 17635 7562 1 13 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.295 0.131 17635 7563 1 13 . 1 1 62 62 VAL CB C 62 34.685 34.685 34.088 0.597 17635 7564 1 13 . 1 1 62 62 VAL H H 62 8.071 8.071 8.664 -0.593 17635 7565 1 13 . 1 1 63 63 SER N N 63 121.689 121.689 122.097 -0.408 17635 7566 1 13 . 1 1 63 63 SER HA H 63 5.261 5.261 4.806 0.455 17635 7567 1 13 . 1 1 63 63 SER C C 63 177.943 177.943 173.727 4.216 17635 7568 1 13 . 1 1 63 63 SER CA C 63 57.662 57.662 57.805 -0.143 17635 7569 1 13 . 1 1 63 63 SER CB C 63 64.427 64.427 64.398 0.029 17635 7570 1 13 . 1 1 63 63 SER H H 63 7.695 7.695 8.110 -0.415 17635 7571 1 13 . 1 1 64 64 PHE N N 64 122.640 122.640 123.403 -0.763 17635 7572 1 13 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.719 0.135 17635 7573 1 13 . 1 1 64 64 PHE C C 64 174.605 174.605 175.967 -1.362 17635 7574 1 13 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.643 0.561 17635 7575 1 13 . 1 1 64 64 PHE CB C 64 41.976 41.976 42.528 -0.552 17635 7576 1 13 . 1 1 64 64 PHE H H 64 9.025 9.025 8.784 0.241 17635 7577 1 13 . 1 1 65 65 ASP N N 65 119.943 119.943 122.468 -2.525 17635 7578 1 13 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.469 -0.034 17635 7579 1 13 . 1 1 65 65 ASP C C 65 174.396 174.396 175.717 -1.321 17635 7580 1 13 . 1 1 65 65 ASP CA C 65 57.442 57.442 56.269 1.173 17635 7581 1 13 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.805 0.229 17635 7582 1 13 . 1 1 65 65 ASP H H 65 8.512 8.512 8.741 -0.229 17635 7583 1 13 . 1 1 66 66 ASP N N 66 116.125 116.125 118.765 -2.640 17635 7584 1 13 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.147 0.252 17635 7585 1 13 . 1 1 66 66 ASP C C 66 175.936 175.936 174.628 1.308 17635 7586 1 13 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.659 -0.866 17635 7587 1 13 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.475 0.444 17635 7588 1 13 . 1 1 66 66 ASP H H 66 8.323 8.323 7.810 0.513 17635 7589 1 13 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.476 -0.026 17635 7590 1 13 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.678 0.246 17635 7591 1 13 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.450 -0.619 17635 7592 1 13 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.342 0.077 17635 7593 1 13 . 1 1 68 68 PRO C C 68 171.345 171.345 179.170 -7.825 17635 7594 1 13 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.190 0.045 17635 7595 1 13 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.167 -0.170 17635 7596 1 13 . 1 1 69 69 SER N N 69 114.544 114.544 113.889 0.655 17635 7597 1 13 . 1 1 69 69 SER HA H 69 4.036 4.036 4.079 -0.043 17635 7598 1 13 . 1 1 69 69 SER C C 69 176.535 176.535 176.095 0.440 17635 7599 1 13 . 1 1 69 69 SER CA C 69 61.837 61.837 61.234 0.603 17635 7600 1 13 . 1 1 69 69 SER CB C 69 62.773 62.773 62.879 -0.106 17635 7601 1 13 . 1 1 69 69 SER H H 69 8.004 8.004 8.007 -0.003 17635 7602 1 13 . 1 1 70 70 ALA N N 70 122.649 122.649 123.766 -1.117 17635 7603 1 13 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.334 0.259 17635 7604 1 13 . 1 1 70 70 ALA C C 70 172.686 172.686 178.989 -6.303 17635 7605 1 13 . 1 1 70 70 ALA CA C 70 55.036 55.036 54.938 0.098 17635 7606 1 13 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.214 -0.350 17635 7607 1 13 . 1 1 70 70 ALA H H 70 7.383 7.383 7.581 -0.198 17635 7608 1 13 . 1 1 71 71 LYS N N 71 116.308 116.308 119.616 -3.308 17635 7609 1 13 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.509 0.266 17635 7610 1 13 . 1 1 71 71 LYS C C 71 172.333 172.333 178.393 -6.060 17635 7611 1 13 . 1 1 71 71 LYS CA C 71 59.002 59.002 57.765 1.237 17635 7612 1 13 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.675 0.767 17635 7613 1 13 . 1 1 71 71 LYS H H 71 7.159 7.159 7.460 -0.301 17635 7614 1 13 . 1 1 72 72 ALA N N 72 119.806 119.806 120.781 -0.975 17635 7615 1 13 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.020 0.146 17635 7616 1 13 . 1 1 72 72 ALA C C 72 170.530 170.530 179.771 -9.241 17635 7617 1 13 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.895 -0.180 17635 7618 1 13 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.897 -0.077 17635 7619 1 13 . 1 1 72 72 ALA H H 72 7.924 7.924 7.800 0.124 17635 7620 1 13 . 1 1 73 73 ALA N N 73 120.524 120.524 120.825 -0.301 17635 7621 1 13 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.037 0.242 17635 7622 1 13 . 1 1 73 73 ALA C C 73 171.039 171.039 179.490 -8.451 17635 7623 1 13 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.964 0.415 17635 7624 1 13 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.668 0.463 17635 7625 1 13 . 1 1 73 73 ALA H H 73 8.104 8.104 7.448 0.656 17635 7626 1 13 . 1 1 74 74 ILE N N 74 119.875 119.875 118.157 1.718 17635 7627 1 13 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.963 -0.549 17635 7628 1 13 . 1 1 74 74 ILE C C 74 172.435 172.435 177.666 -5.231 17635 7629 1 13 . 1 1 74 74 ILE CA C 74 65.844 65.844 64.960 0.884 17635 7630 1 13 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.875 0.868 17635 7631 1 13 . 1 1 74 74 ILE H H 74 7.574 7.574 7.750 -0.176 17635 7632 1 13 . 1 1 75 75 ASP N N 75 117.867 117.867 117.972 -0.105 17635 7633 1 13 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.460 -0.149 17635 7634 1 13 . 1 1 75 75 ASP C C 75 172.054 172.054 176.624 -4.570 17635 7635 1 13 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.512 0.649 17635 7636 1 13 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.118 -0.587 17635 7637 1 13 . 1 1 75 75 ASP H H 75 7.937 7.937 8.200 -0.263 17635 7638 1 13 . 1 1 76 76 TRP N N 76 117.313 117.313 120.221 -2.908 17635 7639 1 13 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.410 -0.054 17635 7640 1 13 . 1 1 76 76 TRP C C 76 173.272 173.272 176.961 -3.689 17635 7641 1 13 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.715 0.747 17635 7642 1 13 . 1 1 76 76 TRP CB C 76 30.777 30.777 30.066 0.711 17635 7643 1 13 . 1 1 76 76 TRP H H 76 8.475 8.475 7.565 0.910 17635 7644 1 13 . 1 1 77 77 PHE N N 77 112.019 112.019 117.973 -5.954 17635 7645 1 13 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.425 0.223 17635 7646 1 13 . 1 1 77 77 PHE C C 77 173.747 173.747 176.121 -2.374 17635 7647 1 13 . 1 1 77 77 PHE CA C 77 59.921 59.921 61.057 -1.136 17635 7648 1 13 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.694 2.036 17635 7649 1 13 . 1 1 77 77 PHE H H 77 8.488 8.488 7.814 0.674 17635 7650 1 13 . 1 1 78 78 ASP N N 78 118.408 118.408 119.832 -1.424 17635 7651 1 13 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.443 0.021 17635 7652 1 13 . 1 1 78 78 ASP C C 78 172.542 172.542 176.775 -4.233 17635 7653 1 13 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.197 3.493 17635 7654 1 13 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.111 1.775 17635 7655 1 13 . 1 1 78 78 ASP H H 78 7.978 7.978 8.619 -0.641 17635 7656 1 13 . 1 1 79 79 GLY N N 79 115.548 115.548 104.147 11.401 17635 7657 1 13 . 1 1 79 79 GLY C C 79 175.680 175.680 174.226 1.454 17635 7658 1 13 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.764 1.308 17635 7659 1 13 . 1 1 79 79 GLY H H 79 8.615 8.615 7.983 0.632 17635 7660 1 13 . 1 1 80 80 LYS N N 80 120.271 120.271 119.301 0.970 17635 7661 1 13 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.441 0.021 17635 7662 1 13 . 1 1 80 80 LYS C C 80 175.853 175.853 175.352 0.501 17635 7663 1 13 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.096 0.054 17635 7664 1 13 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.452 -1.026 17635 7665 1 13 . 1 1 80 80 LYS H H 80 8.013 8.013 7.860 0.153 17635 7666 1 13 . 1 1 81 81 GLU N N 81 115.765 115.765 118.519 -2.754 17635 7667 1 13 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.263 -0.565 17635 7668 1 13 . 1 1 81 81 GLU C C 81 173.263 173.263 175.443 -2.180 17635 7669 1 13 . 1 1 81 81 GLU CA C 81 55.924 55.924 54.857 1.067 17635 7670 1 13 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.755 0.287 17635 7671 1 13 . 1 1 81 81 GLU H H 81 8.201 8.201 8.271 -0.070 17635 7672 1 13 . 1 1 82 82 PHE N N 82 127.080 127.080 125.507 1.573 17635 7673 1 13 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.390 0.106 17635 7674 1 13 . 1 1 82 82 PHE C C 82 175.349 175.349 174.702 0.647 17635 7675 1 13 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.941 0.775 17635 7676 1 13 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.928 2.066 17635 7677 1 13 . 1 1 82 82 PHE H H 82 9.162 9.162 8.984 0.178 17635 7678 1 13 . 1 1 83 83 SER N N 83 125.136 125.136 119.733 5.403 17635 7679 1 13 . 1 1 83 83 SER HA H 83 3.803 3.803 4.156 -0.353 17635 7680 1 13 . 1 1 83 83 SER C C 83 175.543 175.543 174.723 0.820 17635 7681 1 13 . 1 1 83 83 SER CA C 83 58.371 58.371 58.946 -0.575 17635 7682 1 13 . 1 1 83 83 SER CB C 83 62.519 62.519 61.595 0.924 17635 7683 1 13 . 1 1 83 83 SER H H 83 9.193 9.193 8.720 0.473 17635 7684 1 13 . 1 1 84 84 GLY N N 84 103.581 103.581 104.339 -0.758 17635 7685 1 13 . 1 1 84 84 GLY C C 84 177.188 177.188 172.962 4.226 17635 7686 1 13 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.974 0.078 17635 7687 1 13 . 1 1 84 84 GLY H H 84 8.446 8.446 8.246 0.200 17635 7688 1 13 . 1 1 85 85 ASN N N 85 119.051 119.051 117.169 1.882 17635 7689 1 13 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.229 0.105 17635 7690 1 13 . 1 1 85 85 ASN C C 85 178.020 178.020 172.745 5.275 17635 7691 1 13 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.589 -0.118 17635 7692 1 13 . 1 1 85 85 ASN CB C 85 41.117 41.117 40.360 0.757 17635 7693 1 13 . 1 1 85 85 ASN H H 85 7.762 7.762 8.070 -0.308 17635 7694 1 13 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.286 -0.619 17635 7695 1 13 . 1 1 86 86 PRO C C 86 173.474 173.474 176.115 -2.641 17635 7696 1 13 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.562 0.148 17635 7697 1 13 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.372 -0.502 17635 7698 1 13 . 1 1 87 87 ILE N N 87 117.270 117.270 116.299 0.971 17635 7699 1 13 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.360 -0.214 17635 7700 1 13 . 1 1 87 87 ILE C C 87 174.495 174.495 174.332 0.163 17635 7701 1 13 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.564 0.927 17635 7702 1 13 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.722 -1.051 17635 7703 1 13 . 1 1 87 87 ILE H H 87 8.469 8.469 8.191 0.278 17635 7704 1 13 . 1 1 88 88 LYS N N 88 122.271 122.271 122.448 -0.177 17635 7705 1 13 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.681 0.511 17635 7706 1 13 . 1 1 88 88 LYS C C 88 174.393 174.393 175.040 -0.647 17635 7707 1 13 . 1 1 88 88 LYS CA C 88 54.138 54.138 53.895 0.243 17635 7708 1 13 . 1 1 88 88 LYS CB C 88 35.049 35.049 32.856 2.193 17635 7709 1 13 . 1 1 88 88 LYS H H 88 8.353 8.353 8.248 0.105 17635 7710 1 13 . 1 1 89 89 VAL N N 89 125.661 125.661 126.758 -1.097 17635 7711 1 13 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.583 0.380 17635 7712 1 13 . 1 1 89 89 VAL C C 89 177.160 177.160 175.604 1.556 17635 7713 1 13 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.910 -0.549 17635 7714 1 13 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.384 2.386 17635 7715 1 13 . 1 1 89 89 VAL H H 89 9.414 9.414 8.742 0.672 17635 7716 1 13 . 1 1 90 90 SER N N 90 119.538 119.538 121.939 -2.401 17635 7717 1 13 . 1 1 90 90 SER HA H 90 4.710 4.710 4.759 -0.049 17635 7718 1 13 . 1 1 90 90 SER C C 90 176.533 176.533 173.318 3.215 17635 7719 1 13 . 1 1 90 90 SER CA C 90 56.936 56.936 56.903 0.033 17635 7720 1 13 . 1 1 90 90 SER CB C 90 66.470 66.470 66.282 0.188 17635 7721 1 13 . 1 1 90 90 SER H H 90 8.945 8.945 8.465 0.480 17635 7722 1 13 . 1 1 91 91 PHE N N 91 120.115 120.115 121.981 -1.866 17635 7723 1 13 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.434 0.239 17635 7724 1 13 . 1 1 91 91 PHE C C 91 173.349 173.349 176.175 -2.826 17635 7725 1 13 . 1 1 91 91 PHE CA C 91 61.155 61.155 58.062 3.093 17635 7726 1 13 . 1 1 91 91 PHE CB C 91 39.503 39.503 38.844 0.659 17635 7727 1 13 . 1 1 91 91 PHE H H 91 8.919 8.919 8.657 0.262 17635 7728 1 13 . 1 1 92 92 ALA N N 92 124.386 124.386 132.718 -8.332 17635 7729 1 13 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.527 -0.171 17635 7730 1 13 . 1 1 92 92 ALA C C 92 172.984 172.984 176.543 -3.559 17635 7731 1 13 . 1 1 92 92 ALA CA C 92 52.098 52.098 51.295 0.803 17635 7732 1 13 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.322 1.085 17635 7733 1 13 . 1 1 92 92 ALA H H 92 8.563 8.563 8.636 -0.073 17635 7734 1 13 . 1 1 93 93 THR N N 93 116.073 116.073 116.505 -0.432 17635 7735 1 13 . 1 1 93 93 THR HA H 93 4.208 4.208 4.304 -0.096 17635 7736 1 13 . 1 1 93 93 THR C C 93 176.032 176.032 174.503 1.529 17635 7737 1 13 . 1 1 93 93 THR CA C 93 62.255 62.255 62.593 -0.338 17635 7738 1 13 . 1 1 93 93 THR CB C 93 69.708 69.708 69.593 0.115 17635 7739 1 13 . 1 1 93 93 THR H H 93 8.312 8.312 7.754 0.558 17635 7740 1 13 . 1 1 94 94 ARG N N 94 124.359 124.359 124.050 0.309 17635 7741 1 13 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.052 0.285 17635 7742 1 13 . 1 1 94 94 ARG C C 94 174.426 174.426 174.684 -0.258 17635 7743 1 13 . 1 1 94 94 ARG CA C 94 56.055 56.055 57.254 -1.199 17635 7744 1 13 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.427 0.484 17635 7745 1 13 . 1 1 94 94 ARG H H 94 8.493 8.493 8.557 -0.064 17635 7746 1 13 . 1 1 95 95 ARG N N 95 122.515 122.515 124.773 -2.258 17635 7747 1 13 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.630 -0.402 17635 7748 1 13 . 1 1 95 95 ARG C C 95 174.306 174.306 174.734 -0.428 17635 7749 1 13 . 1 1 95 95 ARG CA C 95 56.142 56.142 54.997 1.145 17635 7750 1 13 . 1 1 95 95 ARG CB C 95 30.966 30.966 30.509 0.457 17635 7751 1 13 . 1 1 95 95 ARG H H 95 8.343 8.343 8.516 -0.173 17635 7752 1 13 . 1 1 96 96 ALA N N 96 125.127 125.127 127.374 -2.247 17635 7753 1 13 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.038 0.171 17635 7754 1 13 . 1 1 96 96 ALA C C 96 173.226 173.226 176.548 -3.322 17635 7755 1 13 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.240 0.530 17635 7756 1 13 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.033 0.160 17635 7757 1 13 . 1 1 96 96 ALA H H 96 8.402 8.402 8.377 0.025 17635 7758 1 13 . 1 1 97 97 ASP N N 97 118.483 118.483 119.504 -1.021 17635 7759 1 13 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.767 -0.269 17635 7760 1 13 . 1 1 97 97 ASP C C 97 174.302 174.302 176.901 -2.599 17635 7761 1 13 . 1 1 97 97 ASP CA C 97 54.091 54.091 53.780 0.311 17635 7762 1 13 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.443 -0.536 17635 7763 1 13 . 1 1 97 97 ASP H H 97 8.206 8.206 8.284 -0.078 17635 7764 1 13 . 1 1 98 98 PHE N N 98 120.321 120.321 118.436 1.885 17635 7765 1 13 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.087 0.403 17635 7766 1 13 . 1 1 98 98 PHE C C 98 174.878 174.878 173.969 0.909 17635 7767 1 13 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.691 -0.531 17635 7768 1 13 . 1 1 98 98 PHE CB C 98 39.303 39.303 39.528 -0.225 17635 7769 1 13 . 1 1 98 98 PHE H H 98 7.990 7.990 8.399 -0.409 17635 7770 1 13 . 1 1 99 99 ASN N N 99 120.016 120.016 119.668 0.348 17635 7771 1 13 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.847 -0.238 17635 7772 1 13 . 1 1 99 99 ASN C C 99 175.348 175.348 174.301 1.047 17635 7773 1 13 . 1 1 99 99 ASN CA C 99 53.313 53.313 52.738 0.575 17635 7774 1 13 . 1 1 99 99 ASN CB C 99 38.727 38.727 40.003 -1.276 17635 7775 1 13 . 1 1 99 99 ASN H H 99 8.336 8.336 8.333 0.003 17635 7776 1 13 . 1 1 100 100 ARG N N 100 121.374 121.374 118.603 2.771 17635 7777 1 13 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.187 0.086 17635 7778 1 13 . 1 1 100 100 ARG C C 100 173.627 173.627 175.000 -1.373 17635 7779 1 13 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.444 0.049 17635 7780 1 13 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.385 0.134 17635 7781 1 13 . 1 1 100 100 ARG H H 100 8.181 8.181 8.553 -0.372 17635 7782 1 13 . 1 1 101 101 GLY N N 101 109.586 109.586 108.801 0.785 17635 7783 1 13 . 1 1 101 101 GLY C C 101 175.739 175.739 174.398 1.341 17635 7784 1 13 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.965 0.416 17635 7785 1 13 . 1 1 101 101 GLY H H 101 8.413 8.413 9.212 -0.799 17635 7786 1 13 . 1 1 102 102 GLY N N 102 108.692 108.692 108.552 0.140 17635 7787 1 13 . 1 1 102 102 GLY C C 102 176.286 176.286 175.437 0.849 17635 7788 1 13 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.839 -0.501 17635 7789 1 13 . 1 1 102 102 GLY H H 102 8.281 8.281 9.395 -1.114 17635 7790 1 13 . 1 1 103 103 GLY N N 103 108.844 108.844 109.185 -0.341 17635 7791 1 13 . 1 1 103 103 GLY C C 103 175.798 175.798 175.589 0.209 17635 7792 1 13 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.981 0.365 17635 7793 1 13 . 1 1 103 103 GLY H H 103 8.364 8.364 8.314 0.050 17635 7794 1 13 . 1 1 104 104 ASN N N 104 118.527 118.527 119.326 -0.799 17635 7795 1 13 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.344 0.374 17635 7796 1 13 . 1 1 104 104 ASN C C 104 174.547 174.547 175.694 -1.147 17635 7797 1 13 . 1 1 104 104 ASN CA C 104 53.209 53.209 54.645 -1.436 17635 7798 1 13 . 1 1 104 104 ASN CB C 104 38.879 38.879 37.664 1.215 17635 7799 1 13 . 1 1 104 104 ASN H H 104 8.438 8.438 8.245 0.193 17635 7800 1 13 . 1 1 105 105 GLY N N 105 109.166 109.166 111.997 -2.831 17635 7801 1 13 . 1 1 105 105 GLY C C 105 176.074 176.074 174.237 1.837 17635 7802 1 13 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.652 -0.050 17635 7803 1 13 . 1 1 105 105 GLY H H 105 8.477 8.477 8.267 0.210 17635 7804 1 13 . 1 1 106 106 ARG N N 106 120.341 120.341 122.704 -2.363 17635 7805 1 13 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.380 -0.029 17635 7806 1 13 . 1 1 106 106 ARG C C 106 173.491 173.491 177.316 -3.825 17635 7807 1 13 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.428 0.799 17635 7808 1 13 . 1 1 106 106 ARG CB C 106 30.629 30.629 31.991 -1.362 17635 7809 1 13 . 1 1 106 106 ARG H H 106 8.244 8.244 8.233 0.011 17635 7810 1 13 . 1 1 107 107 GLY N N 107 109.856 109.856 108.265 1.591 17635 7811 1 13 . 1 1 107 107 GLY C C 107 175.834 175.834 174.850 0.984 17635 7812 1 13 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.951 0.490 17635 7813 1 13 . 1 1 107 107 GLY H H 107 8.522 8.522 9.297 -0.775 17635 7814 1 14 . 1 1 2 2 GLN N N 2 121.692 121.692 118.620 3.072 17635 7815 1 14 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.055 0.211 17635 7816 1 14 . 1 1 2 2 GLN C C 2 175.248 175.248 174.513 0.735 17635 7817 1 14 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.656 -0.660 17635 7818 1 14 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.678 0.961 17635 7819 1 14 . 1 1 2 2 GLN H H 2 8.621 8.621 8.474 0.147 17635 7820 1 14 . 1 1 3 3 ASP N N 3 121.801 121.801 119.621 2.180 17635 7821 1 14 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.754 -0.186 17635 7822 1 14 . 1 1 3 3 ASP C C 3 174.336 174.336 176.002 -1.666 17635 7823 1 14 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.592 -0.530 17635 7824 1 14 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.189 -0.118 17635 7825 1 14 . 1 1 3 3 ASP H H 3 8.436 8.436 8.550 -0.114 17635 7826 1 14 . 1 1 4 4 ASN N N 4 120.292 120.292 116.544 3.748 17635 7827 1 14 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.820 -0.183 17635 7828 1 14 . 1 1 4 4 ASN C C 4 174.415 174.415 175.177 -0.762 17635 7829 1 14 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.256 0.605 17635 7830 1 14 . 1 1 4 4 ASN CB C 4 38.534 38.534 39.531 -0.996 17635 7831 1 14 . 1 1 4 4 ASN H H 4 8.528 8.528 8.300 0.228 17635 7832 1 14 . 1 1 5 5 SER N N 5 117.091 117.091 115.078 2.013 17635 7833 1 14 . 1 1 5 5 SER HA H 5 4.163 4.163 4.732 -0.569 17635 7834 1 14 . 1 1 5 5 SER C C 5 176.370 176.370 174.369 2.001 17635 7835 1 14 . 1 1 5 5 SER CA C 5 60.846 60.846 58.051 2.795 17635 7836 1 14 . 1 1 5 5 SER CB C 5 63.136 63.136 63.496 -0.360 17635 7837 1 14 . 1 1 5 5 SER H H 5 8.470 8.470 8.338 0.132 17635 7838 1 14 . 1 1 6 6 ASP N N 6 119.436 119.436 121.100 -1.664 17635 7839 1 14 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.323 0.372 17635 7840 1 14 . 1 1 6 6 ASP C C 6 175.048 175.048 174.997 0.051 17635 7841 1 14 . 1 1 6 6 ASP CA C 6 53.094 53.094 55.689 -2.595 17635 7842 1 14 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.733 0.202 17635 7843 1 14 . 1 1 6 6 ASP H H 6 8.218 8.218 8.180 0.038 17635 7844 1 14 . 1 1 7 7 ASN N N 7 119.696 119.696 114.042 5.654 17635 7845 1 14 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.307 0.321 17635 7846 1 14 . 1 1 7 7 ASN C C 7 176.539 176.539 174.910 1.629 17635 7847 1 14 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.002 0.156 17635 7848 1 14 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.044 0.815 17635 7849 1 14 . 1 1 7 7 ASN H H 7 7.734 7.734 8.174 -0.440 17635 7850 1 14 . 1 1 8 8 ASN N N 8 119.436 119.436 115.404 4.032 17635 7851 1 14 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.315 0.553 17635 7852 1 14 . 1 1 8 8 ASN C C 8 175.327 175.327 175.863 -0.536 17635 7853 1 14 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.514 -1.310 17635 7854 1 14 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.491 0.004 17635 7855 1 14 . 1 1 8 8 ASN H H 8 8.350 8.350 8.449 -0.099 17635 7856 1 14 . 1 1 9 9 THR N N 9 118.650 118.650 115.371 3.279 17635 7857 1 14 . 1 1 9 9 THR HA H 9 5.557 5.557 4.878 0.679 17635 7858 1 14 . 1 1 9 9 THR C C 9 177.117 177.117 174.304 2.813 17635 7859 1 14 . 1 1 9 9 THR CA C 9 62.314 62.314 62.959 -0.645 17635 7860 1 14 . 1 1 9 9 THR CB C 9 71.225 71.225 69.135 2.090 17635 7861 1 14 . 1 1 9 9 THR H H 9 8.428 8.428 7.395 1.033 17635 7862 1 14 . 1 1 10 10 ILE N N 10 118.556 118.556 120.028 -1.472 17635 7863 1 14 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.181 -0.016 17635 7864 1 14 . 1 1 10 10 ILE C C 10 176.837 176.837 174.121 2.716 17635 7865 1 14 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.495 0.803 17635 7866 1 14 . 1 1 10 10 ILE CB C 10 39.880 39.880 42.050 -2.170 17635 7867 1 14 . 1 1 10 10 ILE H H 10 8.770 8.770 8.880 -0.110 17635 7868 1 14 . 1 1 11 11 PHE N N 11 123.798 123.798 120.379 3.419 17635 7869 1 14 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.827 0.593 17635 7870 1 14 . 1 1 11 11 PHE C C 11 177.066 177.066 175.249 1.817 17635 7871 1 14 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.140 0.222 17635 7872 1 14 . 1 1 11 11 PHE CB C 11 41.868 41.868 40.176 1.692 17635 7873 1 14 . 1 1 11 11 PHE H H 11 9.548 9.548 8.444 1.104 17635 7874 1 14 . 1 1 12 12 VAL N N 12 127.993 127.993 125.833 2.160 17635 7875 1 14 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.467 0.491 17635 7876 1 14 . 1 1 12 12 VAL C C 12 176.965 176.965 174.847 2.118 17635 7877 1 14 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.713 -1.878 17635 7878 1 14 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.035 2.765 17635 7879 1 14 . 1 1 12 12 VAL H H 12 8.940 8.940 9.087 -0.147 17635 7880 1 14 . 1 1 13 13 GLN N N 13 122.289 122.289 126.124 -3.835 17635 7881 1 14 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.985 -0.206 17635 7882 1 14 . 1 1 13 13 GLN C C 13 175.631 175.631 175.700 -0.069 17635 7883 1 14 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.789 0.320 17635 7884 1 14 . 1 1 13 13 GLN CB C 13 34.132 34.132 31.468 2.664 17635 7885 1 14 . 1 1 13 13 GLN H H 13 8.747 8.747 8.134 0.613 17635 7886 1 14 . 1 1 14 14 GLY N N 14 109.212 109.212 112.362 -3.150 17635 7887 1 14 . 1 1 14 14 GLY C C 14 175.436 175.436 172.241 3.195 17635 7888 1 14 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.495 -0.065 17635 7889 1 14 . 1 1 14 14 GLY H H 14 8.236 8.236 8.497 -0.261 17635 7890 1 14 . 1 1 15 15 LEU N N 15 117.824 117.824 118.290 -0.466 17635 7891 1 14 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.784 -1.078 17635 7892 1 14 . 1 1 15 15 LEU C C 15 174.111 174.111 175.029 -0.918 17635 7893 1 14 . 1 1 15 15 LEU CA C 15 55.718 55.718 54.902 0.816 17635 7894 1 14 . 1 1 15 15 LEU CB C 15 42.433 42.433 42.796 -0.363 17635 7895 1 14 . 1 1 15 15 LEU H H 15 8.442 8.442 7.968 0.474 17635 7896 1 14 . 1 1 16 16 GLY N N 16 105.063 105.063 107.514 -2.451 17635 7897 1 14 . 1 1 16 16 GLY C C 16 177.771 177.771 173.790 3.981 17635 7898 1 14 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.560 -1.466 17635 7899 1 14 . 1 1 16 16 GLY H H 16 8.006 8.006 8.064 -0.058 17635 7900 1 14 . 1 1 17 17 GLU N N 17 113.781 113.781 120.238 -6.457 17635 7901 1 14 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.376 -0.257 17635 7902 1 14 . 1 1 17 17 GLU C C 17 173.937 173.937 175.445 -1.508 17635 7903 1 14 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.258 1.023 17635 7904 1 14 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.314 1.121 17635 7905 1 14 . 1 1 17 17 GLU H H 17 8.134 8.134 8.398 -0.264 17635 7906 1 14 . 1 1 18 18 ASN N N 18 116.660 116.660 117.009 -0.349 17635 7907 1 14 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.589 0.352 17635 7908 1 14 . 1 1 18 18 ASN C C 18 175.900 175.900 174.674 1.226 17635 7909 1 14 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.854 -0.376 17635 7910 1 14 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.638 -1.153 17635 7911 1 14 . 1 1 18 18 ASN H H 18 8.407 8.407 7.989 0.418 17635 7912 1 14 . 1 1 19 19 VAL N N 19 118.323 118.323 123.000 -4.677 17635 7913 1 14 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.514 0.638 17635 7914 1 14 . 1 1 19 19 VAL C C 19 177.655 177.655 174.602 3.053 17635 7915 1 14 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.606 -1.729 17635 7916 1 14 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.600 1.913 17635 7917 1 14 . 1 1 19 19 VAL H H 19 6.855 6.855 7.691 -0.836 17635 7918 1 14 . 1 1 20 20 THR N N 20 111.636 111.636 118.140 -6.504 17635 7919 1 14 . 1 1 20 20 THR HA H 20 4.719 4.719 4.664 0.055 17635 7920 1 14 . 1 1 20 20 THR C C 20 175.266 175.266 175.127 0.139 17635 7921 1 14 . 1 1 20 20 THR CA C 20 58.698 58.698 59.366 -0.668 17635 7922 1 14 . 1 1 20 20 THR CB C 20 72.948 72.948 72.325 0.623 17635 7923 1 14 . 1 1 20 20 THR H H 20 7.328 7.328 7.620 -0.292 17635 7924 1 14 . 1 1 21 21 ILE N N 21 122.147 122.147 123.428 -1.281 17635 7925 1 14 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.588 -0.070 17635 7926 1 14 . 1 1 21 21 ILE C C 21 173.198 173.198 177.768 -4.570 17635 7927 1 14 . 1 1 21 21 ILE CA C 21 65.772 65.772 65.832 -0.060 17635 7928 1 14 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.580 0.003 17635 7929 1 14 . 1 1 21 21 ILE H H 21 9.074 9.074 8.905 0.169 17635 7930 1 14 . 1 1 22 22 GLU N N 22 118.154 118.154 120.426 -2.272 17635 7931 1 14 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.049 -0.063 17635 7932 1 14 . 1 1 22 22 GLU C C 22 171.799 171.799 178.957 -7.158 17635 7933 1 14 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.654 0.959 17635 7934 1 14 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.798 -0.007 17635 7935 1 14 . 1 1 22 22 GLU H H 22 8.814 8.814 8.596 0.218 17635 7936 1 14 . 1 1 23 23 SER N N 23 115.921 115.921 117.149 -1.228 17635 7937 1 14 . 1 1 23 23 SER HA H 23 4.384 4.384 4.591 -0.207 17635 7938 1 14 . 1 1 23 23 SER C C 23 172.447 172.447 176.721 -4.274 17635 7939 1 14 . 1 1 23 23 SER CA C 23 61.239 61.239 61.236 0.003 17635 7940 1 14 . 1 1 23 23 SER CB C 23 62.838 62.838 62.631 0.207 17635 7941 1 14 . 1 1 23 23 SER H H 23 8.236 8.236 8.073 0.163 17635 7942 1 14 . 1 1 24 24 VAL N N 24 124.867 124.867 123.081 1.786 17635 7943 1 14 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.355 -0.607 17635 7944 1 14 . 1 1 24 24 VAL C C 24 173.016 173.016 177.894 -4.878 17635 7945 1 14 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.490 0.763 17635 7946 1 14 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.590 -0.056 17635 7947 1 14 . 1 1 24 24 VAL H H 24 7.973 7.973 8.561 -0.588 17635 7948 1 14 . 1 1 25 25 ALA N N 25 123.198 123.198 121.625 1.573 17635 7949 1 14 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.041 -0.142 17635 7950 1 14 . 1 1 25 25 ALA C C 25 171.061 171.061 179.355 -8.294 17635 7951 1 14 . 1 1 25 25 ALA CA C 25 55.695 55.695 55.280 0.415 17635 7952 1 14 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.076 -0.338 17635 7953 1 14 . 1 1 25 25 ALA H H 25 8.695 8.695 8.621 0.074 17635 7954 1 14 . 1 1 26 26 ASP N N 26 115.503 115.503 119.554 -4.051 17635 7955 1 14 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.478 -0.155 17635 7956 1 14 . 1 1 26 26 ASP C C 26 173.108 173.108 177.544 -4.436 17635 7957 1 14 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.609 0.714 17635 7958 1 14 . 1 1 26 26 ASP CB C 26 41.052 41.052 40.950 0.102 17635 7959 1 14 . 1 1 26 26 ASP H H 26 8.312 8.312 8.256 0.056 17635 7960 1 14 . 1 1 27 27 TYR N N 27 119.224 119.224 114.888 4.336 17635 7961 1 14 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.679 -0.479 17635 7962 1 14 . 1 1 27 27 TYR C C 27 172.908 172.908 175.221 -2.313 17635 7963 1 14 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.267 2.749 17635 7964 1 14 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.900 0.032 17635 7965 1 14 . 1 1 27 27 TYR H H 27 7.533 7.533 7.912 -0.379 17635 7966 1 14 . 1 1 28 28 PHE N N 28 112.595 112.595 119.374 -6.779 17635 7967 1 14 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.172 0.158 17635 7968 1 14 . 1 1 28 28 PHE C C 28 173.082 173.082 175.520 -2.438 17635 7969 1 14 . 1 1 28 28 PHE CA C 28 61.784 61.784 57.659 4.125 17635 7970 1 14 . 1 1 28 28 PHE CB C 28 40.003 40.003 40.750 -0.747 17635 7971 1 14 . 1 1 28 28 PHE H H 28 7.974 7.974 8.445 -0.471 17635 7972 1 14 . 1 1 29 29 LYS N N 29 118.820 118.820 118.934 -0.114 17635 7973 1 14 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.427 0.490 17635 7974 1 14 . 1 1 29 29 LYS C C 29 173.682 173.682 176.996 -3.314 17635 7975 1 14 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.960 1.320 17635 7976 1 14 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.651 -0.360 17635 7977 1 14 . 1 1 29 29 LYS H H 29 8.325 8.325 7.492 0.833 17635 7978 1 14 . 1 1 30 30 GLN N N 30 116.232 116.232 119.353 -3.121 17635 7979 1 14 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.177 -0.042 17635 7980 1 14 . 1 1 30 30 GLN C C 30 173.790 173.790 177.835 -4.045 17635 7981 1 14 . 1 1 30 30 GLN CA C 30 57.546 57.546 58.086 -0.540 17635 7982 1 14 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.680 1.218 17635 7983 1 14 . 1 1 30 30 GLN H H 30 7.518 7.518 7.894 -0.376 17635 7984 1 14 . 1 1 31 31 ILE N N 31 116.489 116.489 118.333 -1.844 17635 7985 1 14 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.009 0.230 17635 7986 1 14 . 1 1 31 31 ILE C C 31 175.599 175.599 175.872 -0.273 17635 7987 1 14 . 1 1 31 31 ILE CA C 31 58.221 58.221 62.422 -4.201 17635 7988 1 14 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.422 1.911 17635 7989 1 14 . 1 1 31 31 ILE H H 31 7.809 7.809 7.847 -0.038 17635 7990 1 14 . 1 1 32 32 GLY N N 32 107.416 107.416 104.616 2.800 17635 7991 1 14 . 1 1 32 32 GLY C C 32 180.182 180.182 172.311 7.871 17635 7992 1 14 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.596 0.398 17635 7993 1 14 . 1 1 32 32 GLY H H 32 7.344 7.344 7.489 -0.145 17635 7994 1 14 . 1 1 33 33 ILE N N 33 117.784 117.784 121.097 -3.313 17635 7995 1 14 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.436 -0.347 17635 7996 1 14 . 1 1 33 33 ILE C C 33 173.301 173.301 175.624 -2.323 17635 7997 1 14 . 1 1 33 33 ILE CA C 33 61.641 61.641 61.028 0.613 17635 7998 1 14 . 1 1 33 33 ILE CB C 33 38.659 38.659 38.074 0.585 17635 7999 1 14 . 1 1 33 33 ILE H H 33 8.173 8.173 8.267 -0.094 17635 8000 1 14 . 1 1 34 34 ILE N N 34 131.781 131.781 129.015 2.766 17635 8001 1 14 . 1 1 34 34 ILE HA H 34 3.787 3.787 3.878 -0.091 17635 8002 1 14 . 1 1 34 34 ILE C C 34 174.663 174.663 176.402 -1.739 17635 8003 1 14 . 1 1 34 34 ILE CA C 34 61.370 61.370 61.505 -0.135 17635 8004 1 14 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.086 -0.091 17635 8005 1 14 . 1 1 34 34 ILE H H 34 8.687 8.687 8.606 0.081 17635 8006 1 14 . 1 1 35 35 LYS N N 35 130.372 130.372 129.184 1.188 17635 8007 1 14 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.319 -0.235 17635 8008 1 14 . 1 1 35 35 LYS C C 35 175.376 175.376 176.593 -1.217 17635 8009 1 14 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.779 0.694 17635 8010 1 14 . 1 1 35 35 LYS CB C 35 33.664 33.664 30.847 2.817 17635 8011 1 14 . 1 1 35 35 LYS H H 35 8.680 8.680 8.633 0.047 17635 8012 1 14 . 1 1 36 36 THR N N 36 118.312 118.312 119.965 -1.653 17635 8013 1 14 . 1 1 36 36 THR HA H 36 4.415 4.415 4.295 0.120 17635 8014 1 14 . 1 1 36 36 THR C C 36 176.394 176.394 173.934 2.460 17635 8015 1 14 . 1 1 36 36 THR CA C 36 61.340 61.340 62.564 -1.224 17635 8016 1 14 . 1 1 36 36 THR CB C 36 70.809 70.809 69.317 1.492 17635 8017 1 14 . 1 1 36 36 THR H H 36 8.456 8.456 8.063 0.393 17635 8018 1 14 . 1 1 37 37 ASN N N 37 124.092 124.092 123.074 1.018 17635 8019 1 14 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.867 -0.337 17635 8020 1 14 . 1 1 37 37 ASN C C 37 174.235 174.235 175.577 -1.342 17635 8021 1 14 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.776 1.288 17635 8022 1 14 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.758 -0.831 17635 8023 1 14 . 1 1 37 37 ASN H H 37 8.794 8.794 8.681 0.113 17635 8024 1 14 . 1 1 38 38 LYS N N 38 127.969 127.969 121.877 6.092 17635 8025 1 14 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.204 -0.200 17635 8026 1 14 . 1 1 38 38 LYS C C 38 172.702 172.702 176.928 -4.226 17635 8027 1 14 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.654 -0.196 17635 8028 1 14 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.040 0.127 17635 8029 1 14 . 1 1 38 38 LYS H H 38 8.962 8.962 8.613 0.349 17635 8030 1 14 . 1 1 39 39 LYS N N 39 117.413 117.413 118.827 -1.414 17635 8031 1 14 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.229 0.029 17635 8032 1 14 . 1 1 39 39 LYS C C 39 172.261 172.261 177.497 -5.236 17635 8033 1 14 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.668 -0.349 17635 8034 1 14 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.601 0.196 17635 8035 1 14 . 1 1 39 39 LYS H H 39 8.314 8.314 8.164 0.150 17635 8036 1 14 . 1 1 40 40 THR N N 40 105.547 105.547 107.497 -1.950 17635 8037 1 14 . 1 1 40 40 THR HA H 40 4.465 4.465 4.476 -0.011 17635 8038 1 14 . 1 1 40 40 THR C C 40 174.021 174.021 175.760 -1.739 17635 8039 1 14 . 1 1 40 40 THR CA C 40 61.260 61.260 61.618 -0.358 17635 8040 1 14 . 1 1 40 40 THR CB C 40 70.997 70.997 69.409 1.588 17635 8041 1 14 . 1 1 40 40 THR H H 40 7.422 7.422 7.631 -0.209 17635 8042 1 14 . 1 1 41 41 GLY N N 41 111.631 111.631 110.876 0.755 17635 8043 1 14 . 1 1 41 41 GLY C C 41 176.727 176.727 173.715 3.012 17635 8044 1 14 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.397 0.333 17635 8045 1 14 . 1 1 41 41 GLY H H 41 8.644 8.644 8.261 0.383 17635 8046 1 14 . 1 1 42 42 GLN N N 42 118.894 118.894 119.864 -0.970 17635 8047 1 14 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.829 -0.160 17635 8048 1 14 . 1 1 42 42 GLN C C 42 177.178 177.178 173.615 3.563 17635 8049 1 14 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.553 1.028 17635 8050 1 14 . 1 1 42 42 GLN CB C 42 29.230 29.230 30.366 -1.137 17635 8051 1 14 . 1 1 42 42 GLN H H 42 7.662 7.662 7.530 0.132 17635 8052 1 14 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.341 0.254 17635 8053 1 14 . 1 1 43 43 PRO C C 43 172.629 172.629 175.706 -3.077 17635 8054 1 14 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.855 -1.032 17635 8055 1 14 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.103 0.593 17635 8056 1 14 . 1 1 44 44 MET N N 44 124.162 124.162 121.399 2.763 17635 8057 1 14 . 1 1 44 44 MET HA H 44 4.432 4.432 4.597 -0.165 17635 8058 1 14 . 1 1 44 44 MET C C 44 176.474 176.474 174.463 2.011 17635 8059 1 14 . 1 1 44 44 MET CA C 44 55.419 55.419 54.696 0.723 17635 8060 1 14 . 1 1 44 44 MET CB C 44 30.555 30.555 34.149 -3.594 17635 8061 1 14 . 1 1 44 44 MET H H 44 8.874 8.874 8.383 0.491 17635 8062 1 14 . 1 1 45 45 ILE N N 45 126.237 126.237 123.416 2.821 17635 8063 1 14 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.645 0.157 17635 8064 1 14 . 1 1 45 45 ILE C C 45 176.415 176.415 174.465 1.950 17635 8065 1 14 . 1 1 45 45 ILE CA C 45 59.216 59.216 59.814 -0.598 17635 8066 1 14 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.255 -0.029 17635 8067 1 14 . 1 1 45 45 ILE H H 45 7.730 7.730 8.350 -0.620 17635 8068 1 14 . 1 1 46 46 ASN N N 46 124.735 124.735 123.302 1.433 17635 8069 1 14 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.902 0.039 17635 8070 1 14 . 1 1 46 46 ASN C C 46 176.836 176.836 173.643 3.193 17635 8071 1 14 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.087 -0.526 17635 8072 1 14 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.737 -0.267 17635 8073 1 14 . 1 1 46 46 ASN H H 46 8.384 8.384 8.829 -0.445 17635 8074 1 14 . 1 1 47 47 LEU N N 47 122.487 122.487 120.969 1.518 17635 8075 1 14 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.617 0.098 17635 8076 1 14 . 1 1 47 47 LEU C C 47 174.190 174.190 176.257 -2.067 17635 8077 1 14 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.682 -0.350 17635 8078 1 14 . 1 1 47 47 LEU CB C 47 42.277 42.277 43.516 -1.239 17635 8079 1 14 . 1 1 47 47 LEU H H 47 8.594 8.594 8.373 0.221 17635 8080 1 14 . 1 1 48 48 TYR N N 48 121.842 121.842 124.690 -2.848 17635 8081 1 14 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.515 0.252 17635 8082 1 14 . 1 1 48 48 TYR C C 48 173.649 173.649 175.394 -1.745 17635 8083 1 14 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.876 1.018 17635 8084 1 14 . 1 1 48 48 TYR CB C 48 39.199 39.199 36.466 2.733 17635 8085 1 14 . 1 1 48 48 TYR H H 48 7.666 7.666 8.675 -1.009 17635 8086 1 14 . 1 1 49 49 THR N N 49 116.554 116.554 114.359 2.195 17635 8087 1 14 . 1 1 49 49 THR HA H 49 4.806 4.806 4.653 0.153 17635 8088 1 14 . 1 1 49 49 THR C C 49 176.654 176.654 173.788 2.866 17635 8089 1 14 . 1 1 49 49 THR CA C 49 60.693 60.693 60.100 0.593 17635 8090 1 14 . 1 1 49 49 THR CB C 49 71.437 71.437 72.102 -0.665 17635 8091 1 14 . 1 1 49 49 THR H H 49 8.965 8.965 8.162 0.803 17635 8092 1 14 . 1 1 50 50 ASP N N 50 123.826 123.826 124.215 -0.389 17635 8093 1 14 . 1 1 50 50 ASP HA H 50 4.624 4.624 5.012 -0.388 17635 8094 1 14 . 1 1 50 50 ASP C C 50 173.380 173.380 176.381 -3.001 17635 8095 1 14 . 1 1 50 50 ASP CA C 50 54.088 54.088 53.859 0.229 17635 8096 1 14 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.510 0.357 17635 8097 1 14 . 1 1 50 50 ASP H H 50 8.939 8.939 8.849 0.090 17635 8098 1 14 . 1 1 51 51 ARG N N 51 127.794 127.794 124.172 3.622 17635 8099 1 14 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.142 -0.097 17635 8100 1 14 . 1 1 51 51 ARG C C 51 173.101 173.101 177.080 -3.979 17635 8101 1 14 . 1 1 51 51 ARG CA C 51 58.562 58.562 57.940 0.622 17635 8102 1 14 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.346 0.821 17635 8103 1 14 . 1 1 51 51 ARG H H 51 8.958 8.958 8.597 0.361 17635 8104 1 14 . 1 1 52 52 GLU N N 52 117.542 117.542 118.490 -0.948 17635 8105 1 14 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.227 0.051 17635 8106 1 14 . 1 1 52 52 GLU C C 52 172.201 172.201 177.323 -5.122 17635 8107 1 14 . 1 1 52 52 GLU CA C 52 58.524 58.524 58.706 -0.182 17635 8108 1 14 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.422 0.856 17635 8109 1 14 . 1 1 52 52 GLU H H 52 8.561 8.561 8.184 0.377 17635 8110 1 14 . 1 1 53 53 THR N N 53 107.065 107.065 111.243 -4.178 17635 8111 1 14 . 1 1 53 53 THR HA H 53 4.436 4.436 4.630 -0.194 17635 8112 1 14 . 1 1 53 53 THR C C 53 173.851 173.851 174.611 -0.760 17635 8113 1 14 . 1 1 53 53 THR CA C 53 61.944 61.944 61.053 0.891 17635 8114 1 14 . 1 1 53 53 THR CB C 53 71.197 71.197 69.474 1.723 17635 8115 1 14 . 1 1 53 53 THR H H 53 8.087 8.087 7.629 0.458 17635 8116 1 14 . 1 1 54 54 GLY N N 54 111.295 111.295 110.373 0.922 17635 8117 1 14 . 1 1 54 54 GLY C C 54 176.747 176.747 174.315 2.432 17635 8118 1 14 . 1 1 54 54 GLY CA C 54 45.703 45.703 46.048 -0.345 17635 8119 1 14 . 1 1 54 54 GLY H H 54 8.423 8.423 7.936 0.487 17635 8120 1 14 . 1 1 55 55 LYS N N 55 119.673 119.673 120.119 -0.446 17635 8121 1 14 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.634 -0.281 17635 8122 1 14 . 1 1 55 55 LYS C C 55 173.854 173.854 175.407 -1.553 17635 8123 1 14 . 1 1 55 55 LYS CA C 55 55.842 55.842 54.657 1.185 17635 8124 1 14 . 1 1 55 55 LYS CB C 55 33.821 33.821 34.186 -0.365 17635 8125 1 14 . 1 1 55 55 LYS H H 55 7.767 7.767 7.551 0.216 17635 8126 1 14 . 1 1 56 56 LEU N N 56 122.426 122.426 124.196 -1.770 17635 8127 1 14 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.414 -0.058 17635 8128 1 14 . 1 1 56 56 LEU C C 56 172.534 172.534 177.311 -4.777 17635 8129 1 14 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.851 1.404 17635 8130 1 14 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.831 -1.177 17635 8131 1 14 . 1 1 56 56 LEU H H 56 8.768 8.768 8.746 0.022 17635 8132 1 14 . 1 1 57 57 LYS N N 57 118.264 118.264 121.242 -2.978 17635 8133 1 14 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.394 -0.106 17635 8134 1 14 . 1 1 57 57 LYS C C 57 173.648 173.648 177.258 -3.610 17635 8135 1 14 . 1 1 57 57 LYS CA C 57 56.264 56.264 55.824 0.440 17635 8136 1 14 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.234 1.828 17635 8137 1 14 . 1 1 57 57 LYS H H 57 8.012 8.012 8.518 -0.506 17635 8138 1 14 . 1 1 58 58 GLY N N 58 108.514 108.514 108.931 -0.417 17635 8139 1 14 . 1 1 58 58 GLY C C 58 177.876 177.876 173.192 4.684 17635 8140 1 14 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.723 0.641 17635 8141 1 14 . 1 1 58 58 GLY H H 58 8.334 8.334 8.591 -0.257 17635 8142 1 14 . 1 1 59 59 GLU N N 59 116.119 116.119 118.624 -2.505 17635 8143 1 14 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.024 0.497 17635 8144 1 14 . 1 1 59 59 GLU C C 59 173.860 173.860 173.552 0.308 17635 8145 1 14 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.253 -2.228 17635 8146 1 14 . 1 1 59 59 GLU CB C 59 34.304 34.304 34.078 0.226 17635 8147 1 14 . 1 1 59 59 GLU H H 59 7.202 7.202 7.843 -0.641 17635 8148 1 14 . 1 1 60 60 ALA N N 60 123.607 123.607 126.596 -2.989 17635 8149 1 14 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.617 0.990 17635 8150 1 14 . 1 1 60 60 ALA C C 60 173.923 173.923 174.800 -0.877 17635 8151 1 14 . 1 1 60 60 ALA CA C 60 50.943 50.943 50.801 0.142 17635 8152 1 14 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.009 1.050 17635 8153 1 14 . 1 1 60 60 ALA H H 60 8.930 8.930 8.975 -0.045 17635 8154 1 14 . 1 1 61 61 THR N N 61 108.384 108.384 115.222 -6.838 17635 8155 1 14 . 1 1 61 61 THR HA H 61 5.743 5.743 4.964 0.779 17635 8156 1 14 . 1 1 61 61 THR C C 61 176.172 176.172 173.861 2.311 17635 8157 1 14 . 1 1 61 61 THR CA C 61 59.625 59.625 59.879 -0.254 17635 8158 1 14 . 1 1 61 61 THR CB C 61 71.224 71.224 69.593 1.631 17635 8159 1 14 . 1 1 61 61 THR H H 61 8.452 8.452 8.456 -0.004 17635 8160 1 14 . 1 1 62 62 VAL N N 62 120.200 120.200 127.694 -7.494 17635 8161 1 14 . 1 1 62 62 VAL HA H 62 4.244 4.244 3.945 0.299 17635 8162 1 14 . 1 1 62 62 VAL C C 62 175.994 175.994 174.509 1.485 17635 8163 1 14 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.212 0.214 17635 8164 1 14 . 1 1 62 62 VAL CB C 62 34.685 34.685 31.708 2.977 17635 8165 1 14 . 1 1 62 62 VAL H H 62 8.071 8.071 7.973 0.098 17635 8166 1 14 . 1 1 63 63 SER N N 63 121.689 121.689 122.589 -0.900 17635 8167 1 14 . 1 1 63 63 SER HA H 63 5.261 5.261 4.636 0.625 17635 8168 1 14 . 1 1 63 63 SER C C 63 177.943 177.943 173.305 4.638 17635 8169 1 14 . 1 1 63 63 SER CA C 63 57.662 57.662 57.130 0.532 17635 8170 1 14 . 1 1 63 63 SER CB C 63 64.427 64.427 63.915 0.512 17635 8171 1 14 . 1 1 63 63 SER H H 63 7.695 7.695 7.959 -0.264 17635 8172 1 14 . 1 1 64 64 PHE N N 64 122.640 122.640 126.300 -3.660 17635 8173 1 14 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.655 0.199 17635 8174 1 14 . 1 1 64 64 PHE C C 64 174.605 174.605 176.024 -1.419 17635 8175 1 14 . 1 1 64 64 PHE CA C 64 58.204 58.204 58.602 -0.398 17635 8176 1 14 . 1 1 64 64 PHE CB C 64 41.976 41.976 40.890 1.086 17635 8177 1 14 . 1 1 64 64 PHE H H 64 9.025 9.025 8.316 0.709 17635 8178 1 14 . 1 1 65 65 ASP N N 65 119.943 119.943 121.248 -1.305 17635 8179 1 14 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.638 -0.203 17635 8180 1 14 . 1 1 65 65 ASP C C 65 174.396 174.396 175.737 -1.341 17635 8181 1 14 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.908 1.534 17635 8182 1 14 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.066 -0.032 17635 8183 1 14 . 1 1 65 65 ASP H H 65 8.512 8.512 9.259 -0.747 17635 8184 1 14 . 1 1 66 66 ASP N N 66 116.125 116.125 117.328 -1.203 17635 8185 1 14 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.065 0.334 17635 8186 1 14 . 1 1 66 66 ASP C C 66 175.936 175.936 174.912 1.024 17635 8187 1 14 . 1 1 66 66 ASP CA C 66 50.793 50.793 50.853 -0.060 17635 8188 1 14 . 1 1 66 66 ASP CB C 66 42.919 42.919 40.947 1.972 17635 8189 1 14 . 1 1 66 66 ASP H H 66 8.323 8.323 7.787 0.536 17635 8190 1 14 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.256 0.194 17635 8191 1 14 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.341 0.584 17635 8192 1 14 . 1 1 67 67 PRO CB C 67 29.830 29.830 29.998 -0.168 17635 8193 1 14 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.192 0.227 17635 8194 1 14 . 1 1 68 68 PRO C C 68 171.345 171.345 178.852 -7.507 17635 8195 1 14 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.777 0.458 17635 8196 1 14 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.922 0.075 17635 8197 1 14 . 1 1 69 69 SER N N 69 114.544 114.544 114.125 0.419 17635 8198 1 14 . 1 1 69 69 SER HA H 69 4.036 4.036 3.909 0.127 17635 8199 1 14 . 1 1 69 69 SER C C 69 176.535 176.535 175.761 0.774 17635 8200 1 14 . 1 1 69 69 SER CA C 69 61.837 61.837 61.182 0.655 17635 8201 1 14 . 1 1 69 69 SER CB C 69 62.773 62.773 62.334 0.439 17635 8202 1 14 . 1 1 69 69 SER H H 69 8.004 8.004 8.007 -0.003 17635 8203 1 14 . 1 1 70 70 ALA N N 70 122.649 122.649 123.914 -1.265 17635 8204 1 14 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.594 -0.001 17635 8205 1 14 . 1 1 70 70 ALA C C 70 172.686 172.686 179.445 -6.759 17635 8206 1 14 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.347 -0.311 17635 8207 1 14 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.113 -0.249 17635 8208 1 14 . 1 1 70 70 ALA H H 70 7.383 7.383 7.419 -0.036 17635 8209 1 14 . 1 1 71 71 LYS N N 71 116.308 116.308 119.438 -3.130 17635 8210 1 14 . 1 1 71 71 LYS HA H 71 3.775 3.775 4.267 -0.492 17635 8211 1 14 . 1 1 71 71 LYS C C 71 172.333 172.333 178.755 -6.422 17635 8212 1 14 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.564 0.438 17635 8213 1 14 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.267 0.175 17635 8214 1 14 . 1 1 71 71 LYS H H 71 7.159 7.159 7.441 -0.282 17635 8215 1 14 . 1 1 72 72 ALA N N 72 119.806 119.806 120.634 -0.828 17635 8216 1 14 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.085 0.081 17635 8217 1 14 . 1 1 72 72 ALA C C 72 170.530 170.530 179.826 -9.296 17635 8218 1 14 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.991 -0.276 17635 8219 1 14 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.076 -0.256 17635 8220 1 14 . 1 1 72 72 ALA H H 72 7.924 7.924 7.973 -0.049 17635 8221 1 14 . 1 1 73 73 ALA N N 73 120.524 120.524 121.226 -0.702 17635 8222 1 14 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.254 0.025 17635 8223 1 14 . 1 1 73 73 ALA C C 73 171.039 171.039 179.783 -8.744 17635 8224 1 14 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.901 0.478 17635 8225 1 14 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.560 0.571 17635 8226 1 14 . 1 1 73 73 ALA H H 73 8.104 8.104 7.464 0.640 17635 8227 1 14 . 1 1 74 74 ILE N N 74 119.875 119.875 118.421 1.454 17635 8228 1 14 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.831 -0.417 17635 8229 1 14 . 1 1 74 74 ILE C C 74 172.435 172.435 177.731 -5.296 17635 8230 1 14 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.222 0.622 17635 8231 1 14 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.861 0.882 17635 8232 1 14 . 1 1 74 74 ILE H H 74 7.574 7.574 8.108 -0.534 17635 8233 1 14 . 1 1 75 75 ASP N N 75 117.867 117.867 118.387 -0.520 17635 8234 1 14 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.522 -0.211 17635 8235 1 14 . 1 1 75 75 ASP C C 75 172.054 172.054 176.843 -4.789 17635 8236 1 14 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.977 0.184 17635 8237 1 14 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.416 -0.885 17635 8238 1 14 . 1 1 75 75 ASP H H 75 7.937 7.937 7.981 -0.044 17635 8239 1 14 . 1 1 76 76 TRP N N 76 117.313 117.313 120.194 -2.881 17635 8240 1 14 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.655 -0.299 17635 8241 1 14 . 1 1 76 76 TRP C C 76 173.272 173.272 176.597 -3.325 17635 8242 1 14 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.310 1.152 17635 8243 1 14 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.928 0.849 17635 8244 1 14 . 1 1 76 76 TRP H H 76 8.475 8.475 8.081 0.394 17635 8245 1 14 . 1 1 77 77 PHE N N 77 112.019 112.019 117.568 -5.549 17635 8246 1 14 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.105 0.543 17635 8247 1 14 . 1 1 77 77 PHE C C 77 173.747 173.747 176.393 -2.646 17635 8248 1 14 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.697 -0.776 17635 8249 1 14 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.251 2.479 17635 8250 1 14 . 1 1 77 77 PHE H H 77 8.488 8.488 8.011 0.477 17635 8251 1 14 . 1 1 78 78 ASP N N 78 118.408 118.408 120.510 -2.102 17635 8252 1 14 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.673 -0.209 17635 8253 1 14 . 1 1 78 78 ASP C C 78 172.542 172.542 176.569 -4.027 17635 8254 1 14 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.306 3.384 17635 8255 1 14 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.381 1.505 17635 8256 1 14 . 1 1 78 78 ASP H H 78 7.978 7.978 8.508 -0.530 17635 8257 1 14 . 1 1 79 79 GLY N N 79 115.548 115.548 105.663 9.885 17635 8258 1 14 . 1 1 79 79 GLY C C 79 175.680 175.680 173.553 2.127 17635 8259 1 14 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.237 0.835 17635 8260 1 14 . 1 1 79 79 GLY H H 79 8.615 8.615 8.466 0.149 17635 8261 1 14 . 1 1 80 80 LYS N N 80 120.271 120.271 119.538 0.733 17635 8262 1 14 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.559 -0.097 17635 8263 1 14 . 1 1 80 80 LYS C C 80 175.853 175.853 175.554 0.299 17635 8264 1 14 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.658 0.492 17635 8265 1 14 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.701 -1.275 17635 8266 1 14 . 1 1 80 80 LYS H H 80 8.013 8.013 8.053 -0.040 17635 8267 1 14 . 1 1 81 81 GLU N N 81 115.765 115.765 118.347 -2.582 17635 8268 1 14 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.040 -0.342 17635 8269 1 14 . 1 1 81 81 GLU C C 81 173.263 173.263 176.013 -2.750 17635 8270 1 14 . 1 1 81 81 GLU CA C 81 55.924 55.924 54.695 1.229 17635 8271 1 14 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.161 0.881 17635 8272 1 14 . 1 1 81 81 GLU H H 81 8.201 8.201 8.483 -0.282 17635 8273 1 14 . 1 1 82 82 PHE N N 82 127.080 127.080 125.347 1.733 17635 8274 1 14 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.444 0.052 17635 8275 1 14 . 1 1 82 82 PHE C C 82 175.349 175.349 175.868 -0.519 17635 8276 1 14 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.642 1.074 17635 8277 1 14 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.175 2.819 17635 8278 1 14 . 1 1 82 82 PHE H H 82 9.162 9.162 9.030 0.132 17635 8279 1 14 . 1 1 83 83 SER N N 83 125.136 125.136 120.102 5.034 17635 8280 1 14 . 1 1 83 83 SER HA H 83 3.803 3.803 4.158 -0.355 17635 8281 1 14 . 1 1 83 83 SER C C 83 175.543 175.543 174.343 1.200 17635 8282 1 14 . 1 1 83 83 SER CA C 83 58.371 58.371 59.697 -1.326 17635 8283 1 14 . 1 1 83 83 SER CB C 83 62.519 62.519 62.753 -0.234 17635 8284 1 14 . 1 1 83 83 SER H H 83 9.193 9.193 9.241 -0.048 17635 8285 1 14 . 1 1 84 84 GLY N N 84 103.581 103.581 106.531 -2.950 17635 8286 1 14 . 1 1 84 84 GLY C C 84 177.188 177.188 173.857 3.331 17635 8287 1 14 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.762 0.290 17635 8288 1 14 . 1 1 84 84 GLY H H 84 8.446 8.446 8.222 0.224 17635 8289 1 14 . 1 1 85 85 ASN N N 85 119.051 119.051 121.522 -2.471 17635 8290 1 14 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.140 0.194 17635 8291 1 14 . 1 1 85 85 ASN C C 85 178.020 178.020 172.860 5.160 17635 8292 1 14 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.279 -0.808 17635 8293 1 14 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.536 2.581 17635 8294 1 14 . 1 1 85 85 ASN H H 85 7.762 7.762 8.159 -0.397 17635 8295 1 14 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.669 -1.002 17635 8296 1 14 . 1 1 86 86 PRO C C 86 173.474 173.474 176.328 -2.854 17635 8297 1 14 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.274 0.436 17635 8298 1 14 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.060 -1.190 17635 8299 1 14 . 1 1 87 87 ILE N N 87 117.270 117.270 116.083 1.187 17635 8300 1 14 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.182 -0.036 17635 8301 1 14 . 1 1 87 87 ILE C C 87 174.495 174.495 174.711 -0.216 17635 8302 1 14 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.595 0.896 17635 8303 1 14 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.622 -0.951 17635 8304 1 14 . 1 1 87 87 ILE H H 87 8.469 8.469 9.250 -0.781 17635 8305 1 14 . 1 1 88 88 LYS N N 88 122.271 122.271 120.100 2.171 17635 8306 1 14 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.812 0.380 17635 8307 1 14 . 1 1 88 88 LYS C C 88 174.393 174.393 175.232 -0.839 17635 8308 1 14 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.879 -0.741 17635 8309 1 14 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.806 0.243 17635 8310 1 14 . 1 1 88 88 LYS H H 88 8.353 8.353 8.208 0.145 17635 8311 1 14 . 1 1 89 89 VAL N N 89 125.661 125.661 125.532 0.129 17635 8312 1 14 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.714 0.249 17635 8313 1 14 . 1 1 89 89 VAL C C 89 177.160 177.160 176.179 0.981 17635 8314 1 14 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.240 -0.879 17635 8315 1 14 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.367 2.404 17635 8316 1 14 . 1 1 89 89 VAL H H 89 9.414 9.414 8.603 0.811 17635 8317 1 14 . 1 1 90 90 SER N N 90 119.538 119.538 122.158 -2.620 17635 8318 1 14 . 1 1 90 90 SER HA H 90 4.710 4.710 4.867 -0.157 17635 8319 1 14 . 1 1 90 90 SER C C 90 176.533 176.533 173.692 2.841 17635 8320 1 14 . 1 1 90 90 SER CA C 90 56.936 56.936 57.025 -0.089 17635 8321 1 14 . 1 1 90 90 SER CB C 90 66.470 66.470 65.842 0.628 17635 8322 1 14 . 1 1 90 90 SER H H 90 8.945 8.945 8.307 0.638 17635 8323 1 14 . 1 1 91 91 PHE N N 91 120.115 120.115 121.475 -1.360 17635 8324 1 14 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.605 0.068 17635 8325 1 14 . 1 1 91 91 PHE C C 91 173.349 173.349 176.440 -3.091 17635 8326 1 14 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.239 4.916 17635 8327 1 14 . 1 1 91 91 PHE CB C 91 39.503 39.503 38.178 1.325 17635 8328 1 14 . 1 1 91 91 PHE H H 91 8.919 8.919 8.631 0.288 17635 8329 1 14 . 1 1 92 92 ALA N N 92 124.386 124.386 129.992 -5.606 17635 8330 1 14 . 1 1 92 92 ALA HA H 92 4.356 4.356 3.281 1.075 17635 8331 1 14 . 1 1 92 92 ALA C C 92 172.984 172.984 176.048 -3.064 17635 8332 1 14 . 1 1 92 92 ALA CA C 92 52.098 52.098 53.071 -0.973 17635 8333 1 14 . 1 1 92 92 ALA CB C 92 19.406 19.406 19.038 0.368 17635 8334 1 14 . 1 1 92 92 ALA H H 92 8.563 8.563 8.005 0.558 17635 8335 1 14 . 1 1 93 93 THR N N 93 116.073 116.073 118.250 -2.177 17635 8336 1 14 . 1 1 93 93 THR HA H 93 4.208 4.208 4.262 -0.054 17635 8337 1 14 . 1 1 93 93 THR C C 93 176.032 176.032 174.607 1.425 17635 8338 1 14 . 1 1 93 93 THR CA C 93 62.255 62.255 60.373 1.883 17635 8339 1 14 . 1 1 93 93 THR CB C 93 69.708 69.708 70.310 -0.602 17635 8340 1 14 . 1 1 93 93 THR H H 93 8.312 8.312 7.033 1.279 17635 8341 1 14 . 1 1 94 94 ARG N N 94 124.359 124.359 121.121 3.238 17635 8342 1 14 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.181 0.156 17635 8343 1 14 . 1 1 94 94 ARG C C 94 174.426 174.426 175.573 -1.147 17635 8344 1 14 . 1 1 94 94 ARG CA C 94 56.055 56.055 57.651 -1.596 17635 8345 1 14 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.895 0.016 17635 8346 1 14 . 1 1 94 94 ARG H H 94 8.493 8.493 8.441 0.052 17635 8347 1 14 . 1 1 95 95 ARG N N 95 122.515 122.515 121.782 0.733 17635 8348 1 14 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.672 -0.444 17635 8349 1 14 . 1 1 95 95 ARG C C 95 174.306 174.306 175.039 -0.733 17635 8350 1 14 . 1 1 95 95 ARG CA C 95 56.142 56.142 54.967 1.175 17635 8351 1 14 . 1 1 95 95 ARG CB C 95 30.966 30.966 31.457 -0.491 17635 8352 1 14 . 1 1 95 95 ARG H H 95 8.343 8.343 8.293 0.050 17635 8353 1 14 . 1 1 96 96 ALA N N 96 125.127 125.127 122.630 2.497 17635 8354 1 14 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.685 -0.476 17635 8355 1 14 . 1 1 96 96 ALA C C 96 173.226 173.226 176.998 -3.772 17635 8356 1 14 . 1 1 96 96 ALA CA C 96 52.770 52.770 51.314 1.456 17635 8357 1 14 . 1 1 96 96 ALA CB C 96 19.193 19.193 20.088 -0.895 17635 8358 1 14 . 1 1 96 96 ALA H H 96 8.402 8.402 8.178 0.224 17635 8359 1 14 . 1 1 97 97 ASP N N 97 118.483 118.483 120.859 -2.376 17635 8360 1 14 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.693 -0.195 17635 8361 1 14 . 1 1 97 97 ASP C C 97 174.302 174.302 176.233 -1.931 17635 8362 1 14 . 1 1 97 97 ASP CA C 97 54.091 54.091 55.453 -1.362 17635 8363 1 14 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.462 -0.555 17635 8364 1 14 . 1 1 97 97 ASP H H 97 8.206 8.206 8.667 -0.461 17635 8365 1 14 . 1 1 98 98 PHE N N 98 120.321 120.321 118.605 1.716 17635 8366 1 14 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.488 0.002 17635 8367 1 14 . 1 1 98 98 PHE C C 98 174.878 174.878 173.822 1.056 17635 8368 1 14 . 1 1 98 98 PHE CA C 98 58.160 58.160 57.276 0.884 17635 8369 1 14 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.900 0.403 17635 8370 1 14 . 1 1 98 98 PHE H H 98 7.990 7.990 8.270 -0.280 17635 8371 1 14 . 1 1 99 99 ASN N N 99 120.016 120.016 119.460 0.556 17635 8372 1 14 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.320 0.289 17635 8373 1 14 . 1 1 99 99 ASN C C 99 175.348 175.348 174.278 1.070 17635 8374 1 14 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.838 -0.525 17635 8375 1 14 . 1 1 99 99 ASN CB C 99 38.727 38.727 37.911 0.816 17635 8376 1 14 . 1 1 99 99 ASN H H 99 8.336 8.336 8.224 0.112 17635 8377 1 14 . 1 1 100 100 ARG N N 100 121.374 121.374 118.995 2.379 17635 8378 1 14 . 1 1 100 100 ARG HA H 100 4.273 4.273 3.962 0.311 17635 8379 1 14 . 1 1 100 100 ARG C C 100 173.627 173.627 175.034 -1.407 17635 8380 1 14 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.999 -0.507 17635 8381 1 14 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.180 0.339 17635 8382 1 14 . 1 1 100 100 ARG H H 100 8.181 8.181 8.533 -0.352 17635 8383 1 14 . 1 1 101 101 GLY N N 101 109.586 109.586 111.816 -2.230 17635 8384 1 14 . 1 1 101 101 GLY C C 101 175.739 175.739 174.092 1.647 17635 8385 1 14 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.657 0.723 17635 8386 1 14 . 1 1 101 101 GLY H H 101 8.413 8.413 8.647 -0.234 17635 8387 1 14 . 1 1 102 102 GLY N N 102 108.692 108.692 109.683 -0.991 17635 8388 1 14 . 1 1 102 102 GLY C C 102 176.286 176.286 175.102 1.184 17635 8389 1 14 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.461 0.877 17635 8390 1 14 . 1 1 102 102 GLY H H 102 8.281 8.281 7.932 0.349 17635 8391 1 14 . 1 1 103 103 GLY N N 103 108.844 108.844 109.606 -0.762 17635 8392 1 14 . 1 1 103 103 GLY C C 103 175.798 175.798 174.231 1.567 17635 8393 1 14 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.816 0.529 17635 8394 1 14 . 1 1 103 103 GLY H H 103 8.364 8.364 8.508 -0.144 17635 8395 1 14 . 1 1 104 104 ASN N N 104 118.527 118.527 119.407 -0.880 17635 8396 1 14 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.446 0.272 17635 8397 1 14 . 1 1 104 104 ASN C C 104 174.547 174.547 175.850 -1.303 17635 8398 1 14 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.774 -0.565 17635 8399 1 14 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.498 0.381 17635 8400 1 14 . 1 1 104 104 ASN H H 104 8.438 8.438 8.398 0.040 17635 8401 1 14 . 1 1 105 105 GLY N N 105 109.166 109.166 108.173 0.993 17635 8402 1 14 . 1 1 105 105 GLY C C 105 176.074 176.074 174.342 1.732 17635 8403 1 14 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.001 0.601 17635 8404 1 14 . 1 1 105 105 GLY H H 105 8.477 8.477 8.736 -0.259 17635 8405 1 14 . 1 1 106 106 ARG N N 106 120.341 120.341 124.614 -4.273 17635 8406 1 14 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.566 -0.215 17635 8407 1 14 . 1 1 106 106 ARG C C 106 173.491 173.491 176.893 -3.402 17635 8408 1 14 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.225 1.002 17635 8409 1 14 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.355 0.274 17635 8410 1 14 . 1 1 106 106 ARG H H 106 8.244 8.244 8.219 0.025 17635 8411 1 14 . 1 1 107 107 GLY N N 107 109.856 109.856 112.899 -3.043 17635 8412 1 14 . 1 1 107 107 GLY C C 107 175.834 175.834 174.234 1.600 17635 8413 1 14 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.790 0.651 17635 8414 1 14 . 1 1 107 107 GLY H H 107 8.522 8.522 8.739 -0.217 17635 8415 1 15 . 1 1 2 2 GLN N N 2 121.692 121.692 119.744 1.948 17635 8416 1 15 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.143 0.123 17635 8417 1 15 . 1 1 2 2 GLN C C 2 175.248 175.248 174.649 0.599 17635 8418 1 15 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.896 0.100 17635 8419 1 15 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.762 0.877 17635 8420 1 15 . 1 1 2 2 GLN H H 2 8.621 8.621 8.401 0.220 17635 8421 1 15 . 1 1 3 3 ASP N N 3 121.801 121.801 120.248 1.553 17635 8422 1 15 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.702 -0.134 17635 8423 1 15 . 1 1 3 3 ASP C C 3 174.336 174.336 175.303 -0.967 17635 8424 1 15 . 1 1 3 3 ASP CA C 3 54.062 54.062 53.333 0.729 17635 8425 1 15 . 1 1 3 3 ASP CB C 3 41.071 41.071 39.725 1.346 17635 8426 1 15 . 1 1 3 3 ASP H H 3 8.436 8.436 8.745 -0.309 17635 8427 1 15 . 1 1 4 4 ASN N N 4 120.292 120.292 118.756 1.536 17635 8428 1 15 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.853 -0.216 17635 8429 1 15 . 1 1 4 4 ASN C C 4 174.415 174.415 174.957 -0.542 17635 8430 1 15 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.448 1.413 17635 8431 1 15 . 1 1 4 4 ASN CB C 4 38.534 38.534 40.071 -1.537 17635 8432 1 15 . 1 1 4 4 ASN H H 4 8.528 8.528 7.545 0.983 17635 8433 1 15 . 1 1 5 5 SER N N 5 117.091 117.091 115.757 1.334 17635 8434 1 15 . 1 1 5 5 SER HA H 5 4.163 4.163 4.518 -0.355 17635 8435 1 15 . 1 1 5 5 SER C C 5 176.370 176.370 173.759 2.611 17635 8436 1 15 . 1 1 5 5 SER CA C 5 60.846 60.846 57.648 3.197 17635 8437 1 15 . 1 1 5 5 SER CB C 5 63.136 63.136 63.638 -0.502 17635 8438 1 15 . 1 1 5 5 SER H H 5 8.470 8.470 8.718 -0.248 17635 8439 1 15 . 1 1 6 6 ASP N N 6 119.436 119.436 119.057 0.379 17635 8440 1 15 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.579 0.116 17635 8441 1 15 . 1 1 6 6 ASP C C 6 175.048 175.048 175.502 -0.454 17635 8442 1 15 . 1 1 6 6 ASP CA C 6 53.094 53.094 54.652 -1.558 17635 8443 1 15 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.535 0.400 17635 8444 1 15 . 1 1 6 6 ASP H H 6 8.218 8.218 8.301 -0.083 17635 8445 1 15 . 1 1 7 7 ASN N N 7 119.696 119.696 117.486 2.210 17635 8446 1 15 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.284 0.344 17635 8447 1 15 . 1 1 7 7 ASN C C 7 176.539 176.539 175.483 1.056 17635 8448 1 15 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.400 -0.242 17635 8449 1 15 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.787 0.072 17635 8450 1 15 . 1 1 7 7 ASN H H 7 7.734 7.734 7.701 0.033 17635 8451 1 15 . 1 1 8 8 ASN N N 8 119.436 119.436 118.738 0.698 17635 8452 1 15 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.434 0.434 17635 8453 1 15 . 1 1 8 8 ASN C C 8 175.327 175.327 176.067 -0.740 17635 8454 1 15 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.642 -1.438 17635 8455 1 15 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.285 0.210 17635 8456 1 15 . 1 1 8 8 ASN H H 8 8.350 8.350 8.612 -0.262 17635 8457 1 15 . 1 1 9 9 THR N N 9 118.650 118.650 116.995 1.655 17635 8458 1 15 . 1 1 9 9 THR HA H 9 5.557 5.557 4.390 1.167 17635 8459 1 15 . 1 1 9 9 THR C C 9 177.117 177.117 174.558 2.559 17635 8460 1 15 . 1 1 9 9 THR CA C 9 62.314 62.314 63.222 -0.908 17635 8461 1 15 . 1 1 9 9 THR CB C 9 71.225 71.225 68.462 2.763 17635 8462 1 15 . 1 1 9 9 THR H H 9 8.428 8.428 7.554 0.874 17635 8463 1 15 . 1 1 10 10 ILE N N 10 118.556 118.556 121.425 -2.869 17635 8464 1 15 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.960 0.205 17635 8465 1 15 . 1 1 10 10 ILE C C 10 176.837 176.837 174.593 2.244 17635 8466 1 15 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.680 0.618 17635 8467 1 15 . 1 1 10 10 ILE CB C 10 39.880 39.880 40.890 -1.010 17635 8468 1 15 . 1 1 10 10 ILE H H 10 8.770 8.770 8.745 0.025 17635 8469 1 15 . 1 1 11 11 PHE N N 11 123.798 123.798 119.431 4.367 17635 8470 1 15 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.824 0.596 17635 8471 1 15 . 1 1 11 11 PHE C C 11 177.066 177.066 174.933 2.133 17635 8472 1 15 . 1 1 11 11 PHE CA C 11 55.362 55.362 56.469 -1.107 17635 8473 1 15 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.232 0.636 17635 8474 1 15 . 1 1 11 11 PHE H H 11 9.548 9.548 8.074 1.474 17635 8475 1 15 . 1 1 12 12 VAL N N 12 127.993 127.993 125.653 2.340 17635 8476 1 15 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.492 0.466 17635 8477 1 15 . 1 1 12 12 VAL C C 12 176.965 176.965 175.127 1.838 17635 8478 1 15 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.452 -1.617 17635 8479 1 15 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.231 2.569 17635 8480 1 15 . 1 1 12 12 VAL H H 12 8.940 8.940 8.713 0.227 17635 8481 1 15 . 1 1 13 13 GLN N N 13 122.289 122.289 126.946 -4.657 17635 8482 1 15 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.533 0.246 17635 8483 1 15 . 1 1 13 13 GLN C C 13 175.631 175.631 175.722 -0.091 17635 8484 1 15 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.971 0.139 17635 8485 1 15 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.401 3.731 17635 8486 1 15 . 1 1 13 13 GLN H H 13 8.747 8.747 8.822 -0.075 17635 8487 1 15 . 1 1 14 14 GLY N N 14 109.212 109.212 112.736 -3.524 17635 8488 1 15 . 1 1 14 14 GLY C C 14 175.436 175.436 172.703 2.733 17635 8489 1 15 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.359 0.071 17635 8490 1 15 . 1 1 14 14 GLY H H 14 8.236 8.236 8.939 -0.703 17635 8491 1 15 . 1 1 15 15 LEU N N 15 117.824 117.824 122.236 -4.412 17635 8492 1 15 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.534 -0.828 17635 8493 1 15 . 1 1 15 15 LEU C C 15 174.111 174.111 177.243 -3.132 17635 8494 1 15 . 1 1 15 15 LEU CA C 15 55.718 55.718 54.632 1.086 17635 8495 1 15 . 1 1 15 15 LEU CB C 15 42.433 42.433 42.412 0.021 17635 8496 1 15 . 1 1 15 15 LEU H H 15 8.442 8.442 7.619 0.823 17635 8497 1 15 . 1 1 16 16 GLY N N 16 105.063 105.063 105.892 -0.829 17635 8498 1 15 . 1 1 16 16 GLY C C 16 177.771 177.771 173.372 4.399 17635 8499 1 15 . 1 1 16 16 GLY CA C 16 44.094 44.094 45.486 -1.392 17635 8500 1 15 . 1 1 16 16 GLY H H 16 8.006 8.006 8.040 -0.034 17635 8501 1 15 . 1 1 17 17 GLU N N 17 113.781 113.781 119.150 -5.369 17635 8502 1 15 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.431 -0.312 17635 8503 1 15 . 1 1 17 17 GLU C C 17 173.937 173.937 175.347 -1.410 17635 8504 1 15 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.391 0.890 17635 8505 1 15 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.389 1.048 17635 8506 1 15 . 1 1 17 17 GLU H H 17 8.134 8.134 8.197 -0.062 17635 8507 1 15 . 1 1 18 18 ASN N N 18 116.660 116.660 116.901 -0.241 17635 8508 1 15 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.542 0.399 17635 8509 1 15 . 1 1 18 18 ASN C C 18 175.900 175.900 174.027 1.873 17635 8510 1 15 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.299 0.179 17635 8511 1 15 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.169 -0.684 17635 8512 1 15 . 1 1 18 18 ASN H H 18 8.407 8.407 7.799 0.608 17635 8513 1 15 . 1 1 19 19 VAL N N 19 118.323 118.323 121.205 -2.882 17635 8514 1 15 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.561 0.591 17635 8515 1 15 . 1 1 19 19 VAL C C 19 177.655 177.655 174.782 2.873 17635 8516 1 15 . 1 1 19 19 VAL CA C 19 61.877 61.877 64.273 -2.396 17635 8517 1 15 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.543 1.970 17635 8518 1 15 . 1 1 19 19 VAL H H 19 6.855 6.855 7.540 -0.685 17635 8519 1 15 . 1 1 20 20 THR N N 20 111.636 111.636 118.004 -6.368 17635 8520 1 15 . 1 1 20 20 THR HA H 20 4.719 4.719 4.522 0.197 17635 8521 1 15 . 1 1 20 20 THR C C 20 175.266 175.266 174.251 1.015 17635 8522 1 15 . 1 1 20 20 THR CA C 20 58.698 58.698 60.583 -1.885 17635 8523 1 15 . 1 1 20 20 THR CB C 20 72.948 72.948 71.685 1.263 17635 8524 1 15 . 1 1 20 20 THR H H 20 7.328 7.328 7.632 -0.304 17635 8525 1 15 . 1 1 21 21 ILE N N 21 122.147 122.147 123.304 -1.157 17635 8526 1 15 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.632 -0.114 17635 8527 1 15 . 1 1 21 21 ILE C C 21 173.198 173.198 177.437 -4.239 17635 8528 1 15 . 1 1 21 21 ILE CA C 21 65.772 65.772 65.713 0.059 17635 8529 1 15 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.775 -0.192 17635 8530 1 15 . 1 1 21 21 ILE H H 21 9.074 9.074 8.665 0.409 17635 8531 1 15 . 1 1 22 22 GLU N N 22 118.154 118.154 120.530 -2.376 17635 8532 1 15 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.069 -0.083 17635 8533 1 15 . 1 1 22 22 GLU C C 22 171.799 171.799 178.601 -6.802 17635 8534 1 15 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.912 0.701 17635 8535 1 15 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.507 0.284 17635 8536 1 15 . 1 1 22 22 GLU H H 22 8.814 8.814 8.542 0.272 17635 8537 1 15 . 1 1 23 23 SER N N 23 115.921 115.921 115.625 0.296 17635 8538 1 15 . 1 1 23 23 SER HA H 23 4.384 4.384 4.270 0.114 17635 8539 1 15 . 1 1 23 23 SER C C 23 172.447 172.447 176.539 -4.092 17635 8540 1 15 . 1 1 23 23 SER CA C 23 61.239 61.239 61.436 -0.197 17635 8541 1 15 . 1 1 23 23 SER CB C 23 62.838 62.838 62.612 0.226 17635 8542 1 15 . 1 1 23 23 SER H H 23 8.236 8.236 7.992 0.244 17635 8543 1 15 . 1 1 24 24 VAL N N 24 124.867 124.867 123.009 1.858 17635 8544 1 15 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.034 -0.286 17635 8545 1 15 . 1 1 24 24 VAL C C 24 173.016 173.016 177.913 -4.897 17635 8546 1 15 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.847 0.407 17635 8547 1 15 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.535 -0.002 17635 8548 1 15 . 1 1 24 24 VAL H H 24 7.973 7.973 8.250 -0.277 17635 8549 1 15 . 1 1 25 25 ALA N N 25 123.198 123.198 121.875 1.323 17635 8550 1 15 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.160 -0.261 17635 8551 1 15 . 1 1 25 25 ALA C C 25 171.061 171.061 178.832 -7.771 17635 8552 1 15 . 1 1 25 25 ALA CA C 25 55.695 55.695 55.066 0.629 17635 8553 1 15 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.298 -0.560 17635 8554 1 15 . 1 1 25 25 ALA H H 25 8.695 8.695 8.362 0.333 17635 8555 1 15 . 1 1 26 26 ASP N N 26 115.503 115.503 117.996 -2.493 17635 8556 1 15 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.588 -0.265 17635 8557 1 15 . 1 1 26 26 ASP C C 26 173.108 173.108 178.279 -5.171 17635 8558 1 15 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.549 0.774 17635 8559 1 15 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.409 -0.357 17635 8560 1 15 . 1 1 26 26 ASP H H 26 8.312 8.312 8.170 0.142 17635 8561 1 15 . 1 1 27 27 TYR N N 27 119.224 119.224 118.666 0.558 17635 8562 1 15 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.696 -0.496 17635 8563 1 15 . 1 1 27 27 TYR C C 27 172.908 172.908 176.239 -3.331 17635 8564 1 15 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.027 1.989 17635 8565 1 15 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.302 0.630 17635 8566 1 15 . 1 1 27 27 TYR H H 27 7.533 7.533 7.946 -0.413 17635 8567 1 15 . 1 1 28 28 PHE N N 28 112.595 112.595 118.853 -6.258 17635 8568 1 15 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.218 0.112 17635 8569 1 15 . 1 1 28 28 PHE C C 28 173.082 173.082 174.933 -1.851 17635 8570 1 15 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.389 6.395 17635 8571 1 15 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.520 1.482 17635 8572 1 15 . 1 1 28 28 PHE H H 28 7.974 7.974 8.088 -0.114 17635 8573 1 15 . 1 1 29 29 LYS N N 29 118.820 118.820 117.233 1.587 17635 8574 1 15 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.916 0.001 17635 8575 1 15 . 1 1 29 29 LYS C C 29 173.682 173.682 176.435 -2.753 17635 8576 1 15 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.840 2.439 17635 8577 1 15 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.787 -0.496 17635 8578 1 15 . 1 1 29 29 LYS H H 29 8.325 8.325 7.919 0.406 17635 8579 1 15 . 1 1 30 30 GLN N N 30 116.232 116.232 117.666 -1.434 17635 8580 1 15 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.252 -0.117 17635 8581 1 15 . 1 1 30 30 GLN C C 30 173.790 173.790 176.746 -2.956 17635 8582 1 15 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.396 0.150 17635 8583 1 15 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.068 0.830 17635 8584 1 15 . 1 1 30 30 GLN H H 30 7.518 7.518 8.093 -0.575 17635 8585 1 15 . 1 1 31 31 ILE N N 31 116.489 116.489 118.658 -2.169 17635 8586 1 15 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.969 0.270 17635 8587 1 15 . 1 1 31 31 ILE C C 31 175.599 175.599 175.079 0.520 17635 8588 1 15 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.811 -3.590 17635 8589 1 15 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.601 1.733 17635 8590 1 15 . 1 1 31 31 ILE H H 31 7.809 7.809 8.108 -0.299 17635 8591 1 15 . 1 1 32 32 GLY N N 32 107.416 107.416 105.042 2.374 17635 8592 1 15 . 1 1 32 32 GLY C C 32 180.182 180.182 171.917 8.265 17635 8593 1 15 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.431 0.563 17635 8594 1 15 . 1 1 32 32 GLY H H 32 7.344 7.344 7.180 0.164 17635 8595 1 15 . 1 1 33 33 ILE N N 33 117.784 117.784 120.675 -2.891 17635 8596 1 15 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.460 -0.371 17635 8597 1 15 . 1 1 33 33 ILE C C 33 173.301 173.301 175.347 -2.046 17635 8598 1 15 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.373 1.268 17635 8599 1 15 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.639 -0.980 17635 8600 1 15 . 1 1 33 33 ILE H H 33 8.173 8.173 8.197 -0.024 17635 8601 1 15 . 1 1 34 34 ILE N N 34 131.781 131.781 128.012 3.769 17635 8602 1 15 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.537 -0.750 17635 8603 1 15 . 1 1 34 34 ILE C C 34 174.663 174.663 176.295 -1.632 17635 8604 1 15 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.968 0.402 17635 8605 1 15 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.322 -0.327 17635 8606 1 15 . 1 1 34 34 ILE H H 34 8.687 8.687 8.805 -0.118 17635 8607 1 15 . 1 1 35 35 LYS N N 35 130.372 130.372 129.540 0.832 17635 8608 1 15 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.137 -0.053 17635 8609 1 15 . 1 1 35 35 LYS C C 35 175.376 175.376 176.339 -0.963 17635 8610 1 15 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.769 0.704 17635 8611 1 15 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.355 2.309 17635 8612 1 15 . 1 1 35 35 LYS H H 35 8.680 8.680 8.881 -0.201 17635 8613 1 15 . 1 1 36 36 THR N N 36 118.312 118.312 121.371 -3.059 17635 8614 1 15 . 1 1 36 36 THR HA H 36 4.415 4.415 4.272 0.143 17635 8615 1 15 . 1 1 36 36 THR C C 36 176.394 176.394 174.675 1.719 17635 8616 1 15 . 1 1 36 36 THR CA C 36 61.340 61.340 64.025 -2.685 17635 8617 1 15 . 1 1 36 36 THR CB C 36 70.809 70.809 69.536 1.273 17635 8618 1 15 . 1 1 36 36 THR H H 36 8.456 8.456 8.282 0.174 17635 8619 1 15 . 1 1 37 37 ASN N N 37 124.092 124.092 121.608 2.484 17635 8620 1 15 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.853 -0.323 17635 8621 1 15 . 1 1 37 37 ASN C C 37 174.235 174.235 175.739 -1.504 17635 8622 1 15 . 1 1 37 37 ASN CA C 37 53.064 53.064 52.261 0.803 17635 8623 1 15 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.936 -1.009 17635 8624 1 15 . 1 1 37 37 ASN H H 37 8.794 8.794 9.061 -0.267 17635 8625 1 15 . 1 1 38 38 LYS N N 38 127.969 127.969 123.150 4.819 17635 8626 1 15 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.253 -0.249 17635 8627 1 15 . 1 1 38 38 LYS C C 38 172.702 172.702 176.512 -3.810 17635 8628 1 15 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.544 -0.086 17635 8629 1 15 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.809 0.358 17635 8630 1 15 . 1 1 38 38 LYS H H 38 8.962 8.962 8.740 0.222 17635 8631 1 15 . 1 1 39 39 LYS N N 39 117.413 117.413 116.938 0.475 17635 8632 1 15 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.398 -0.140 17635 8633 1 15 . 1 1 39 39 LYS C C 39 172.261 172.261 176.843 -4.582 17635 8634 1 15 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.474 0.845 17635 8635 1 15 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.677 0.120 17635 8636 1 15 . 1 1 39 39 LYS H H 39 8.314 8.314 8.107 0.207 17635 8637 1 15 . 1 1 40 40 THR N N 40 105.547 105.547 109.649 -4.102 17635 8638 1 15 . 1 1 40 40 THR HA H 40 4.465 4.465 4.588 -0.123 17635 8639 1 15 . 1 1 40 40 THR C C 40 174.021 174.021 175.653 -1.632 17635 8640 1 15 . 1 1 40 40 THR CA C 40 61.260 61.260 61.898 -0.638 17635 8641 1 15 . 1 1 40 40 THR CB C 40 70.997 70.997 71.063 -0.066 17635 8642 1 15 . 1 1 40 40 THR H H 40 7.422 7.422 7.391 0.031 17635 8643 1 15 . 1 1 41 41 GLY N N 41 111.631 111.631 112.173 -0.542 17635 8644 1 15 . 1 1 41 41 GLY C C 41 176.727 176.727 173.518 3.209 17635 8645 1 15 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.757 -0.027 17635 8646 1 15 . 1 1 41 41 GLY H H 41 8.644 8.644 8.412 0.232 17635 8647 1 15 . 1 1 42 42 GLN N N 42 118.894 118.894 118.256 0.638 17635 8648 1 15 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.849 -0.180 17635 8649 1 15 . 1 1 42 42 GLN C C 42 177.178 177.178 173.380 3.798 17635 8650 1 15 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.634 0.947 17635 8651 1 15 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.929 -0.699 17635 8652 1 15 . 1 1 42 42 GLN H H 42 7.662 7.662 7.916 -0.254 17635 8653 1 15 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.317 0.278 17635 8654 1 15 . 1 1 43 43 PRO C C 43 172.629 172.629 176.181 -3.552 17635 8655 1 15 . 1 1 43 43 PRO CA C 43 62.822 62.822 64.249 -1.427 17635 8656 1 15 . 1 1 43 43 PRO CB C 43 32.696 32.696 31.948 0.748 17635 8657 1 15 . 1 1 44 44 MET N N 44 124.162 124.162 121.955 2.207 17635 8658 1 15 . 1 1 44 44 MET HA H 44 4.432 4.432 4.750 -0.319 17635 8659 1 15 . 1 1 44 44 MET C C 44 176.474 176.474 175.599 0.875 17635 8660 1 15 . 1 1 44 44 MET CA C 44 55.419 55.419 55.174 0.245 17635 8661 1 15 . 1 1 44 44 MET CB C 44 30.555 30.555 34.457 -3.902 17635 8662 1 15 . 1 1 44 44 MET H H 44 8.874 8.874 8.323 0.551 17635 8663 1 15 . 1 1 45 45 ILE N N 45 126.237 126.237 123.967 2.270 17635 8664 1 15 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.442 0.360 17635 8665 1 15 . 1 1 45 45 ILE C C 45 176.415 176.415 174.088 2.327 17635 8666 1 15 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.116 -0.900 17635 8667 1 15 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.513 -0.287 17635 8668 1 15 . 1 1 45 45 ILE H H 45 7.730 7.730 8.315 -0.585 17635 8669 1 15 . 1 1 46 46 ASN N N 46 124.735 124.735 124.179 0.556 17635 8670 1 15 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.919 0.022 17635 8671 1 15 . 1 1 46 46 ASN C C 46 176.836 176.836 173.252 3.584 17635 8672 1 15 . 1 1 46 46 ASN CA C 46 51.561 51.561 51.550 0.011 17635 8673 1 15 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.642 -0.172 17635 8674 1 15 . 1 1 46 46 ASN H H 46 8.384 8.384 8.636 -0.252 17635 8675 1 15 . 1 1 47 47 LEU N N 47 122.487 122.487 121.214 1.273 17635 8676 1 15 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.434 0.281 17635 8677 1 15 . 1 1 47 47 LEU C C 47 174.190 174.190 175.978 -1.788 17635 8678 1 15 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.022 -0.690 17635 8679 1 15 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.825 -2.548 17635 8680 1 15 . 1 1 47 47 LEU H H 47 8.594 8.594 8.222 0.372 17635 8681 1 15 . 1 1 48 48 TYR N N 48 121.842 121.842 121.515 0.327 17635 8682 1 15 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.842 -0.075 17635 8683 1 15 . 1 1 48 48 TYR C C 48 173.649 173.649 175.531 -1.882 17635 8684 1 15 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.040 1.854 17635 8685 1 15 . 1 1 48 48 TYR CB C 48 39.199 39.199 38.945 0.254 17635 8686 1 15 . 1 1 48 48 TYR H H 48 7.666 7.666 8.321 -0.655 17635 8687 1 15 . 1 1 49 49 THR N N 49 116.554 116.554 114.280 2.274 17635 8688 1 15 . 1 1 49 49 THR HA H 49 4.806 4.806 4.605 0.201 17635 8689 1 15 . 1 1 49 49 THR C C 49 176.654 176.654 173.777 2.877 17635 8690 1 15 . 1 1 49 49 THR CA C 49 60.693 60.693 59.608 1.085 17635 8691 1 15 . 1 1 49 49 THR CB C 49 71.437 71.437 70.638 0.799 17635 8692 1 15 . 1 1 49 49 THR H H 49 8.965 8.965 8.439 0.526 17635 8693 1 15 . 1 1 50 50 ASP N N 50 123.826 123.826 121.111 2.715 17635 8694 1 15 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.658 -0.034 17635 8695 1 15 . 1 1 50 50 ASP C C 50 173.380 173.380 175.924 -2.544 17635 8696 1 15 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.320 -0.232 17635 8697 1 15 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.833 1.034 17635 8698 1 15 . 1 1 50 50 ASP H H 50 8.939 8.939 8.651 0.288 17635 8699 1 15 . 1 1 51 51 ARG N N 51 127.794 127.794 123.862 3.932 17635 8700 1 15 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.367 -0.322 17635 8701 1 15 . 1 1 51 51 ARG C C 51 173.101 173.101 175.938 -2.837 17635 8702 1 15 . 1 1 51 51 ARG CA C 51 58.562 58.562 55.626 2.936 17635 8703 1 15 . 1 1 51 51 ARG CB C 51 30.167 30.167 28.843 1.324 17635 8704 1 15 . 1 1 51 51 ARG H H 51 8.958 8.958 8.597 0.361 17635 8705 1 15 . 1 1 52 52 GLU N N 52 117.542 117.542 119.163 -1.621 17635 8706 1 15 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.376 -0.098 17635 8707 1 15 . 1 1 52 52 GLU C C 52 172.201 172.201 176.978 -4.777 17635 8708 1 15 . 1 1 52 52 GLU CA C 52 58.524 58.524 57.323 1.201 17635 8709 1 15 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.247 0.031 17635 8710 1 15 . 1 1 52 52 GLU H H 52 8.561 8.561 8.001 0.560 17635 8711 1 15 . 1 1 53 53 THR N N 53 107.065 107.065 111.123 -4.058 17635 8712 1 15 . 1 1 53 53 THR HA H 53 4.436 4.436 4.539 -0.103 17635 8713 1 15 . 1 1 53 53 THR C C 53 173.851 173.851 175.082 -1.231 17635 8714 1 15 . 1 1 53 53 THR CA C 53 61.944 61.944 62.310 -0.366 17635 8715 1 15 . 1 1 53 53 THR CB C 53 71.197 71.197 70.207 0.990 17635 8716 1 15 . 1 1 53 53 THR H H 53 8.087 8.087 7.890 0.197 17635 8717 1 15 . 1 1 54 54 GLY N N 54 111.295 111.295 109.900 1.395 17635 8718 1 15 . 1 1 54 54 GLY C C 54 176.747 176.747 174.351 2.396 17635 8719 1 15 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.935 0.768 17635 8720 1 15 . 1 1 54 54 GLY H H 54 8.423 8.423 7.806 0.617 17635 8721 1 15 . 1 1 55 55 LYS N N 55 119.673 119.673 120.612 -0.939 17635 8722 1 15 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.298 0.055 17635 8723 1 15 . 1 1 55 55 LYS C C 55 173.854 173.854 175.714 -1.860 17635 8724 1 15 . 1 1 55 55 LYS CA C 55 55.842 55.842 57.132 -1.290 17635 8725 1 15 . 1 1 55 55 LYS CB C 55 33.821 33.821 33.128 0.693 17635 8726 1 15 . 1 1 55 55 LYS H H 55 7.767 7.767 8.004 -0.237 17635 8727 1 15 . 1 1 56 56 LEU N N 56 122.426 122.426 114.944 7.482 17635 8728 1 15 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.837 -0.481 17635 8729 1 15 . 1 1 56 56 LEU C C 56 172.534 172.534 176.715 -4.181 17635 8730 1 15 . 1 1 56 56 LEU CA C 56 56.255 56.255 53.321 2.934 17635 8731 1 15 . 1 1 56 56 LEU CB C 56 41.654 41.654 43.573 -1.919 17635 8732 1 15 . 1 1 56 56 LEU H H 56 8.768 8.768 8.226 0.542 17635 8733 1 15 . 1 1 57 57 LYS N N 57 118.264 118.264 120.778 -2.514 17635 8734 1 15 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.084 0.204 17635 8735 1 15 . 1 1 57 57 LYS C C 57 173.648 173.648 177.716 -4.068 17635 8736 1 15 . 1 1 57 57 LYS CA C 57 56.264 56.264 57.665 -1.401 17635 8737 1 15 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.505 1.557 17635 8738 1 15 . 1 1 57 57 LYS H H 57 8.012 8.012 8.365 -0.353 17635 8739 1 15 . 1 1 58 58 GLY N N 58 108.514 108.514 107.387 1.127 17635 8740 1 15 . 1 1 58 58 GLY C C 58 177.876 177.876 172.325 5.551 17635 8741 1 15 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.233 1.131 17635 8742 1 15 . 1 1 58 58 GLY H H 58 8.334 8.334 8.326 0.008 17635 8743 1 15 . 1 1 59 59 GLU N N 59 116.119 116.119 116.453 -0.334 17635 8744 1 15 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.192 0.329 17635 8745 1 15 . 1 1 59 59 GLU C C 59 173.860 173.860 173.452 0.408 17635 8746 1 15 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.176 -1.151 17635 8747 1 15 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.505 0.799 17635 8748 1 15 . 1 1 59 59 GLU H H 59 7.202 7.202 7.535 -0.333 17635 8749 1 15 . 1 1 60 60 ALA N N 60 123.607 123.607 123.178 0.429 17635 8750 1 15 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.614 0.993 17635 8751 1 15 . 1 1 60 60 ALA C C 60 173.923 173.923 175.167 -1.244 17635 8752 1 15 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.152 -0.209 17635 8753 1 15 . 1 1 60 60 ALA CB C 60 24.059 24.059 22.840 1.219 17635 8754 1 15 . 1 1 60 60 ALA H H 60 8.930 8.930 8.897 0.033 17635 8755 1 15 . 1 1 61 61 THR N N 61 108.384 108.384 114.779 -6.395 17635 8756 1 15 . 1 1 61 61 THR HA H 61 5.743 5.743 4.335 1.408 17635 8757 1 15 . 1 1 61 61 THR C C 61 176.172 176.172 173.796 2.376 17635 8758 1 15 . 1 1 61 61 THR CA C 61 59.625 59.625 60.013 -0.388 17635 8759 1 15 . 1 1 61 61 THR CB C 61 71.224 71.224 69.232 1.992 17635 8760 1 15 . 1 1 61 61 THR H H 61 8.452 8.452 8.243 0.209 17635 8761 1 15 . 1 1 62 62 VAL N N 62 120.200 120.200 126.125 -5.925 17635 8762 1 15 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.180 0.064 17635 8763 1 15 . 1 1 62 62 VAL C C 62 175.994 175.994 174.709 1.285 17635 8764 1 15 . 1 1 62 62 VAL CA C 62 61.426 61.426 60.671 0.755 17635 8765 1 15 . 1 1 62 62 VAL CB C 62 34.685 34.685 33.922 0.763 17635 8766 1 15 . 1 1 62 62 VAL H H 62 8.071 8.071 8.299 -0.228 17635 8767 1 15 . 1 1 63 63 SER N N 63 121.689 121.689 121.311 0.378 17635 8768 1 15 . 1 1 63 63 SER HA H 63 5.261 5.261 4.693 0.568 17635 8769 1 15 . 1 1 63 63 SER C C 63 177.943 177.943 173.460 4.483 17635 8770 1 15 . 1 1 63 63 SER CA C 63 57.662 57.662 56.590 1.072 17635 8771 1 15 . 1 1 63 63 SER CB C 63 64.427 64.427 64.177 0.250 17635 8772 1 15 . 1 1 63 63 SER H H 63 7.695 7.695 8.266 -0.571 17635 8773 1 15 . 1 1 64 64 PHE N N 64 122.640 122.640 124.061 -1.421 17635 8774 1 15 . 1 1 64 64 PHE HA H 64 4.854 4.854 5.104 -0.250 17635 8775 1 15 . 1 1 64 64 PHE C C 64 174.605 174.605 176.235 -1.630 17635 8776 1 15 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.352 0.852 17635 8777 1 15 . 1 1 64 64 PHE CB C 64 41.976 41.976 41.636 0.340 17635 8778 1 15 . 1 1 64 64 PHE H H 64 9.025 9.025 7.884 1.141 17635 8779 1 15 . 1 1 65 65 ASP N N 65 119.943 119.943 121.540 -1.597 17635 8780 1 15 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.555 -0.120 17635 8781 1 15 . 1 1 65 65 ASP C C 65 174.396 174.396 176.112 -1.716 17635 8782 1 15 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.886 1.556 17635 8783 1 15 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.059 -0.025 17635 8784 1 15 . 1 1 65 65 ASP H H 65 8.512 8.512 9.098 -0.586 17635 8785 1 15 . 1 1 66 66 ASP N N 66 116.125 116.125 118.761 -2.636 17635 8786 1 15 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.071 0.328 17635 8787 1 15 . 1 1 66 66 ASP C C 66 175.936 175.936 175.251 0.685 17635 8788 1 15 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.150 -0.357 17635 8789 1 15 . 1 1 66 66 ASP CB C 66 42.919 42.919 41.948 0.971 17635 8790 1 15 . 1 1 66 66 ASP H H 66 8.323 8.323 7.974 0.349 17635 8791 1 15 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.353 0.097 17635 8792 1 15 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.495 0.430 17635 8793 1 15 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.458 -0.628 17635 8794 1 15 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.350 0.069 17635 8795 1 15 . 1 1 68 68 PRO C C 68 171.345 171.345 179.266 -7.921 17635 8796 1 15 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.096 0.139 17635 8797 1 15 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.071 -0.074 17635 8798 1 15 . 1 1 69 69 SER N N 69 114.544 114.544 114.384 0.160 17635 8799 1 15 . 1 1 69 69 SER HA H 69 4.036 4.036 3.995 0.041 17635 8800 1 15 . 1 1 69 69 SER C C 69 176.535 176.535 176.324 0.211 17635 8801 1 15 . 1 1 69 69 SER CA C 69 61.837 61.837 61.805 0.032 17635 8802 1 15 . 1 1 69 69 SER CB C 69 62.773 62.773 62.697 0.076 17635 8803 1 15 . 1 1 69 69 SER H H 69 8.004 8.004 8.285 -0.281 17635 8804 1 15 . 1 1 70 70 ALA N N 70 122.649 122.649 124.069 -1.420 17635 8805 1 15 . 1 1 70 70 ALA HA H 70 3.593 3.593 4.403 -0.810 17635 8806 1 15 . 1 1 70 70 ALA C C 70 172.686 172.686 179.722 -7.036 17635 8807 1 15 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.664 -0.629 17635 8808 1 15 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.490 -0.626 17635 8809 1 15 . 1 1 70 70 ALA H H 70 7.383 7.383 7.803 -0.420 17635 8810 1 15 . 1 1 71 71 LYS N N 71 116.308 116.308 120.036 -3.728 17635 8811 1 15 . 1 1 71 71 LYS HA H 71 3.775 3.775 4.007 -0.232 17635 8812 1 15 . 1 1 71 71 LYS C C 71 172.333 172.333 178.683 -6.350 17635 8813 1 15 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.547 0.455 17635 8814 1 15 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.887 0.555 17635 8815 1 15 . 1 1 71 71 LYS H H 71 7.159 7.159 7.786 -0.627 17635 8816 1 15 . 1 1 72 72 ALA N N 72 119.806 119.806 120.968 -1.162 17635 8817 1 15 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.079 0.087 17635 8818 1 15 . 1 1 72 72 ALA C C 72 170.530 170.530 179.719 -9.189 17635 8819 1 15 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.733 -0.018 17635 8820 1 15 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.880 -0.059 17635 8821 1 15 . 1 1 72 72 ALA H H 72 7.924 7.924 8.480 -0.556 17635 8822 1 15 . 1 1 73 73 ALA N N 73 120.524 120.524 121.197 -0.673 17635 8823 1 15 . 1 1 73 73 ALA HA H 73 4.279 4.279 3.880 0.399 17635 8824 1 15 . 1 1 73 73 ALA C C 73 171.039 171.039 179.408 -8.369 17635 8825 1 15 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.993 0.386 17635 8826 1 15 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.793 0.338 17635 8827 1 15 . 1 1 73 73 ALA H H 73 8.104 8.104 8.089 0.015 17635 8828 1 15 . 1 1 74 74 ILE N N 74 119.875 119.875 118.186 1.689 17635 8829 1 15 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.827 -0.413 17635 8830 1 15 . 1 1 74 74 ILE C C 74 172.435 172.435 177.663 -5.228 17635 8831 1 15 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.234 0.610 17635 8832 1 15 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.873 0.870 17635 8833 1 15 . 1 1 74 74 ILE H H 74 7.574 7.574 7.947 -0.373 17635 8834 1 15 . 1 1 75 75 ASP N N 75 117.867 117.867 118.066 -0.199 17635 8835 1 15 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.388 -0.077 17635 8836 1 15 . 1 1 75 75 ASP C C 75 172.054 172.054 176.364 -4.310 17635 8837 1 15 . 1 1 75 75 ASP CA C 75 57.161 57.161 57.054 0.107 17635 8838 1 15 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.282 -0.751 17635 8839 1 15 . 1 1 75 75 ASP H H 75 7.937 7.937 8.144 -0.207 17635 8840 1 15 . 1 1 76 76 TRP N N 76 117.313 117.313 120.734 -3.421 17635 8841 1 15 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.431 -0.075 17635 8842 1 15 . 1 1 76 76 TRP C C 76 173.272 173.272 176.495 -3.223 17635 8843 1 15 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.337 1.125 17635 8844 1 15 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.643 1.134 17635 8845 1 15 . 1 1 76 76 TRP H H 76 8.475 8.475 7.338 1.137 17635 8846 1 15 . 1 1 77 77 PHE N N 77 112.019 112.019 117.183 -5.164 17635 8847 1 15 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.080 0.568 17635 8848 1 15 . 1 1 77 77 PHE C C 77 173.747 173.747 176.422 -2.675 17635 8849 1 15 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.284 -0.363 17635 8850 1 15 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.385 2.345 17635 8851 1 15 . 1 1 77 77 PHE H H 77 8.488 8.488 7.175 1.313 17635 8852 1 15 . 1 1 78 78 ASP N N 78 118.408 118.408 120.797 -2.389 17635 8853 1 15 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.528 -0.064 17635 8854 1 15 . 1 1 78 78 ASP C C 78 172.542 172.542 176.122 -3.580 17635 8855 1 15 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.206 3.484 17635 8856 1 15 . 1 1 78 78 ASP CB C 78 41.886 41.886 40.502 1.384 17635 8857 1 15 . 1 1 78 78 ASP H H 78 7.978 7.978 8.586 -0.608 17635 8858 1 15 . 1 1 79 79 GLY N N 79 115.548 115.548 106.643 8.905 17635 8859 1 15 . 1 1 79 79 GLY C C 79 175.680 175.680 173.665 2.015 17635 8860 1 15 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.104 0.968 17635 8861 1 15 . 1 1 79 79 GLY H H 79 8.615 8.615 8.590 0.025 17635 8862 1 15 . 1 1 80 80 LYS N N 80 120.271 120.271 119.602 0.669 17635 8863 1 15 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.598 -0.136 17635 8864 1 15 . 1 1 80 80 LYS C C 80 175.853 175.853 175.273 0.580 17635 8865 1 15 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.275 -0.125 17635 8866 1 15 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.868 -1.442 17635 8867 1 15 . 1 1 80 80 LYS H H 80 8.013 8.013 8.259 -0.246 17635 8868 1 15 . 1 1 81 81 GLU N N 81 115.765 115.765 118.257 -2.492 17635 8869 1 15 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.058 -0.360 17635 8870 1 15 . 1 1 81 81 GLU C C 81 173.263 173.263 175.926 -2.663 17635 8871 1 15 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.429 0.495 17635 8872 1 15 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.479 0.563 17635 8873 1 15 . 1 1 81 81 GLU H H 81 8.201 8.201 8.528 -0.327 17635 8874 1 15 . 1 1 82 82 PHE N N 82 127.080 127.080 126.374 0.706 17635 8875 1 15 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.535 -0.039 17635 8876 1 15 . 1 1 82 82 PHE C C 82 175.349 175.349 175.941 -0.592 17635 8877 1 15 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.187 0.529 17635 8878 1 15 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.840 2.154 17635 8879 1 15 . 1 1 82 82 PHE H H 82 9.162 9.162 8.965 0.197 17635 8880 1 15 . 1 1 83 83 SER N N 83 125.136 125.136 121.255 3.881 17635 8881 1 15 . 1 1 83 83 SER HA H 83 3.803 3.803 4.221 -0.418 17635 8882 1 15 . 1 1 83 83 SER C C 83 175.543 175.543 174.158 1.385 17635 8883 1 15 . 1 1 83 83 SER CA C 83 58.371 58.371 59.591 -1.220 17635 8884 1 15 . 1 1 83 83 SER CB C 83 62.519 62.519 62.459 0.060 17635 8885 1 15 . 1 1 83 83 SER H H 83 9.193 9.193 9.240 -0.047 17635 8886 1 15 . 1 1 84 84 GLY N N 84 103.581 103.581 106.930 -3.349 17635 8887 1 15 . 1 1 84 84 GLY C C 84 177.188 177.188 174.215 2.973 17635 8888 1 15 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.828 0.224 17635 8889 1 15 . 1 1 84 84 GLY H H 84 8.446 8.446 8.270 0.176 17635 8890 1 15 . 1 1 85 85 ASN N N 85 119.051 119.051 121.719 -2.668 17635 8891 1 15 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.103 0.231 17635 8892 1 15 . 1 1 85 85 ASN C C 85 178.020 178.020 172.913 5.107 17635 8893 1 15 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.695 -1.224 17635 8894 1 15 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.410 2.707 17635 8895 1 15 . 1 1 85 85 ASN H H 85 7.762 7.762 8.180 -0.418 17635 8896 1 15 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.350 -0.683 17635 8897 1 15 . 1 1 86 86 PRO C C 86 173.474 173.474 176.155 -2.681 17635 8898 1 15 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.321 0.389 17635 8899 1 15 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.316 -1.446 17635 8900 1 15 . 1 1 87 87 ILE N N 87 117.270 117.270 115.161 2.109 17635 8901 1 15 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.347 -0.201 17635 8902 1 15 . 1 1 87 87 ILE C C 87 174.495 174.495 174.373 0.122 17635 8903 1 15 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.576 0.915 17635 8904 1 15 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.916 -1.245 17635 8905 1 15 . 1 1 87 87 ILE H H 87 8.469 8.469 9.159 -0.690 17635 8906 1 15 . 1 1 88 88 LYS N N 88 122.271 122.271 120.760 1.511 17635 8907 1 15 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.758 0.434 17635 8908 1 15 . 1 1 88 88 LYS C C 88 174.393 174.393 175.067 -0.674 17635 8909 1 15 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.532 -0.394 17635 8910 1 15 . 1 1 88 88 LYS CB C 88 35.049 35.049 35.192 -0.143 17635 8911 1 15 . 1 1 88 88 LYS H H 88 8.353 8.353 8.285 0.068 17635 8912 1 15 . 1 1 89 89 VAL N N 89 125.661 125.661 125.973 -0.312 17635 8913 1 15 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.964 -0.001 17635 8914 1 15 . 1 1 89 89 VAL C C 89 177.160 177.160 176.155 1.005 17635 8915 1 15 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.972 -0.611 17635 8916 1 15 . 1 1 89 89 VAL CB C 89 34.770 34.770 33.243 1.527 17635 8917 1 15 . 1 1 89 89 VAL H H 89 9.414 9.414 8.615 0.799 17635 8918 1 15 . 1 1 90 90 SER N N 90 119.538 119.538 120.286 -0.748 17635 8919 1 15 . 1 1 90 90 SER HA H 90 4.710 4.710 4.822 -0.112 17635 8920 1 15 . 1 1 90 90 SER C C 90 176.533 176.533 173.709 2.824 17635 8921 1 15 . 1 1 90 90 SER CA C 90 56.936 56.936 56.849 0.087 17635 8922 1 15 . 1 1 90 90 SER CB C 90 66.470 66.470 65.793 0.676 17635 8923 1 15 . 1 1 90 90 SER H H 90 8.945 8.945 8.535 0.410 17635 8924 1 15 . 1 1 91 91 PHE N N 91 120.115 120.115 123.457 -3.342 17635 8925 1 15 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.577 0.096 17635 8926 1 15 . 1 1 91 91 PHE C C 91 173.349 173.349 175.166 -1.817 17635 8927 1 15 . 1 1 91 91 PHE CA C 91 61.155 61.155 55.749 5.406 17635 8928 1 15 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.978 1.525 17635 8929 1 15 . 1 1 91 91 PHE H H 91 8.919 8.919 8.823 0.096 17635 8930 1 15 . 1 1 92 92 ALA N N 92 124.386 124.386 126.772 -2.386 17635 8931 1 15 . 1 1 92 92 ALA HA H 92 4.356 4.356 3.959 0.397 17635 8932 1 15 . 1 1 92 92 ALA C C 92 172.984 172.984 176.266 -3.282 17635 8933 1 15 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.115 -0.017 17635 8934 1 15 . 1 1 92 92 ALA CB C 92 19.406 19.406 17.752 1.654 17635 8935 1 15 . 1 1 92 92 ALA H H 92 8.563 8.563 8.212 0.351 17635 8936 1 15 . 1 1 93 93 THR N N 93 116.073 116.073 113.119 2.954 17635 8937 1 15 . 1 1 93 93 THR HA H 93 4.208 4.208 3.439 0.769 17635 8938 1 15 . 1 1 93 93 THR C C 93 176.032 176.032 174.080 1.952 17635 8939 1 15 . 1 1 93 93 THR CA C 93 62.255 62.255 62.979 -0.724 17635 8940 1 15 . 1 1 93 93 THR CB C 93 69.708 69.708 68.515 1.193 17635 8941 1 15 . 1 1 93 93 THR H H 93 8.312 8.312 6.617 1.695 17635 8942 1 15 . 1 1 94 94 ARG N N 94 124.359 124.359 118.101 6.258 17635 8943 1 15 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.027 0.310 17635 8944 1 15 . 1 1 94 94 ARG C C 94 174.426 174.426 176.712 -2.286 17635 8945 1 15 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.987 -0.932 17635 8946 1 15 . 1 1 94 94 ARG CB C 94 30.911 30.911 29.944 0.967 17635 8947 1 15 . 1 1 94 94 ARG H H 94 8.493 8.493 8.457 0.036 17635 8948 1 15 . 1 1 95 95 ARG N N 95 122.515 122.515 120.131 2.384 17635 8949 1 15 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.366 -0.138 17635 8950 1 15 . 1 1 95 95 ARG C C 95 174.306 174.306 175.391 -1.085 17635 8951 1 15 . 1 1 95 95 ARG CA C 95 56.142 56.142 55.254 0.888 17635 8952 1 15 . 1 1 95 95 ARG CB C 95 30.966 30.966 28.847 2.119 17635 8953 1 15 . 1 1 95 95 ARG H H 95 8.343 8.343 8.560 -0.217 17635 8954 1 15 . 1 1 96 96 ALA N N 96 125.127 125.127 125.325 -0.198 17635 8955 1 15 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.082 0.127 17635 8956 1 15 . 1 1 96 96 ALA C C 96 173.226 173.226 177.342 -4.116 17635 8957 1 15 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.188 0.582 17635 8958 1 15 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.195 -0.002 17635 8959 1 15 . 1 1 96 96 ALA H H 96 8.402 8.402 7.717 0.685 17635 8960 1 15 . 1 1 97 97 ASP N N 97 118.483 118.483 117.626 0.857 17635 8961 1 15 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.293 0.205 17635 8962 1 15 . 1 1 97 97 ASP C C 97 174.302 174.302 175.266 -0.964 17635 8963 1 15 . 1 1 97 97 ASP CA C 97 54.091 54.091 55.852 -1.761 17635 8964 1 15 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.778 0.129 17635 8965 1 15 . 1 1 97 97 ASP H H 97 8.206 8.206 8.235 -0.029 17635 8966 1 15 . 1 1 98 98 PHE N N 98 120.321 120.321 120.441 -0.120 17635 8967 1 15 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.580 -0.090 17635 8968 1 15 . 1 1 98 98 PHE C C 98 174.878 174.878 175.324 -0.446 17635 8969 1 15 . 1 1 98 98 PHE CA C 98 58.160 58.160 57.475 0.685 17635 8970 1 15 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.853 0.450 17635 8971 1 15 . 1 1 98 98 PHE H H 98 7.990 7.990 8.187 -0.197 17635 8972 1 15 . 1 1 99 99 ASN N N 99 120.016 120.016 117.259 2.757 17635 8973 1 15 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.375 0.234 17635 8974 1 15 . 1 1 99 99 ASN C C 99 175.348 175.348 174.771 0.577 17635 8975 1 15 . 1 1 99 99 ASN CA C 99 53.313 53.313 54.105 -0.791 17635 8976 1 15 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.037 0.690 17635 8977 1 15 . 1 1 99 99 ASN H H 99 8.336 8.336 8.371 -0.035 17635 8978 1 15 . 1 1 100 100 ARG N N 100 121.374 121.374 118.850 2.524 17635 8979 1 15 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.371 -0.098 17635 8980 1 15 . 1 1 100 100 ARG C C 100 173.627 173.627 176.577 -2.950 17635 8981 1 15 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.935 0.557 17635 8982 1 15 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.994 -0.475 17635 8983 1 15 . 1 1 100 100 ARG H H 100 8.181 8.181 7.970 0.211 17635 8984 1 15 . 1 1 101 101 GLY N N 101 109.586 109.586 107.642 1.944 17635 8985 1 15 . 1 1 101 101 GLY C C 101 175.739 175.739 174.877 0.862 17635 8986 1 15 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.312 1.069 17635 8987 1 15 . 1 1 101 101 GLY H H 101 8.413 8.413 8.233 0.180 17635 8988 1 15 . 1 1 102 102 GLY N N 102 108.692 108.692 109.066 -0.374 17635 8989 1 15 . 1 1 102 102 GLY C C 102 176.286 176.286 175.699 0.587 17635 8990 1 15 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.544 -0.205 17635 8991 1 15 . 1 1 102 102 GLY H H 102 8.281 8.281 8.467 -0.186 17635 8992 1 15 . 1 1 103 103 GLY N N 103 108.844 108.844 108.890 -0.046 17635 8993 1 15 . 1 1 103 103 GLY C C 103 175.798 175.798 175.054 0.744 17635 8994 1 15 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.713 0.633 17635 8995 1 15 . 1 1 103 103 GLY H H 103 8.364 8.364 8.450 -0.086 17635 8996 1 15 . 1 1 104 104 ASN N N 104 118.527 118.527 120.007 -1.480 17635 8997 1 15 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.461 0.257 17635 8998 1 15 . 1 1 104 104 ASN C C 104 174.547 174.547 174.839 -0.292 17635 8999 1 15 . 1 1 104 104 ASN CA C 104 53.209 53.209 54.124 -0.915 17635 9000 1 15 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.138 0.741 17635 9001 1 15 . 1 1 104 104 ASN H H 104 8.438 8.438 8.132 0.306 17635 9002 1 15 . 1 1 105 105 GLY N N 105 109.166 109.166 108.101 1.065 17635 9003 1 15 . 1 1 105 105 GLY C C 105 176.074 176.074 173.260 2.814 17635 9004 1 15 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.375 0.227 17635 9005 1 15 . 1 1 105 105 GLY H H 105 8.477 8.477 8.222 0.255 17635 9006 1 15 . 1 1 106 106 ARG N N 106 120.341 120.341 123.522 -3.181 17635 9007 1 15 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.693 -0.342 17635 9008 1 15 . 1 1 106 106 ARG C C 106 173.491 173.491 176.714 -3.223 17635 9009 1 15 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.114 1.113 17635 9010 1 15 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.357 0.272 17635 9011 1 15 . 1 1 106 106 ARG H H 106 8.244 8.244 8.384 -0.140 17635 9012 1 15 . 1 1 107 107 GLY N N 107 109.856 109.856 112.212 -2.356 17635 9013 1 15 . 1 1 107 107 GLY C C 107 175.834 175.834 175.073 0.761 17635 9014 1 15 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.400 1.041 17635 9015 1 15 . 1 1 107 107 GLY H H 107 8.522 8.522 8.310 0.212 17635 9016 1 16 . 1 1 2 2 GLN N N 2 121.692 121.692 120.547 1.145 17635 9017 1 16 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.053 0.213 17635 9018 1 16 . 1 1 2 2 GLN C C 2 175.248 175.248 175.391 -0.143 17635 9019 1 16 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.504 -0.508 17635 9020 1 16 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.196 1.443 17635 9021 1 16 . 1 1 2 2 GLN H H 2 8.621 8.621 8.590 0.031 17635 9022 1 16 . 1 1 3 3 ASP N N 3 121.801 121.801 121.582 0.219 17635 9023 1 16 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.728 -0.160 17635 9024 1 16 . 1 1 3 3 ASP C C 3 174.336 174.336 175.204 -0.868 17635 9025 1 16 . 1 1 3 3 ASP CA C 3 54.062 54.062 53.990 0.072 17635 9026 1 16 . 1 1 3 3 ASP CB C 3 41.071 41.071 39.984 1.087 17635 9027 1 16 . 1 1 3 3 ASP H H 3 8.436 8.436 8.454 -0.018 17635 9028 1 16 . 1 1 4 4 ASN N N 4 120.292 120.292 119.428 0.864 17635 9029 1 16 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.598 0.039 17635 9030 1 16 . 1 1 4 4 ASN C C 4 174.415 174.415 175.813 -1.398 17635 9031 1 16 . 1 1 4 4 ASN CA C 4 53.861 53.861 54.156 -0.295 17635 9032 1 16 . 1 1 4 4 ASN CB C 4 38.534 38.534 39.271 -0.737 17635 9033 1 16 . 1 1 4 4 ASN H H 4 8.528 8.528 7.785 0.743 17635 9034 1 16 . 1 1 5 5 SER N N 5 117.091 117.091 120.076 -2.985 17635 9035 1 16 . 1 1 5 5 SER HA H 5 4.163 4.163 4.588 -0.425 17635 9036 1 16 . 1 1 5 5 SER C C 5 176.370 176.370 174.845 1.525 17635 9037 1 16 . 1 1 5 5 SER CA C 5 60.846 60.846 59.486 1.360 17635 9038 1 16 . 1 1 5 5 SER CB C 5 63.136 63.136 63.805 -0.669 17635 9039 1 16 . 1 1 5 5 SER H H 5 8.470 8.470 8.450 0.020 17635 9040 1 16 . 1 1 6 6 ASP N N 6 119.436 119.436 122.695 -3.259 17635 9041 1 16 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.611 0.084 17635 9042 1 16 . 1 1 6 6 ASP C C 6 175.048 175.048 175.056 -0.008 17635 9043 1 16 . 1 1 6 6 ASP CA C 6 53.094 53.094 54.436 -1.342 17635 9044 1 16 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.339 0.596 17635 9045 1 16 . 1 1 6 6 ASP H H 6 8.218 8.218 8.124 0.094 17635 9046 1 16 . 1 1 7 7 ASN N N 7 119.696 119.696 115.504 4.192 17635 9047 1 16 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.462 0.166 17635 9048 1 16 . 1 1 7 7 ASN C C 7 176.539 176.539 175.009 1.530 17635 9049 1 16 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.608 -0.450 17635 9050 1 16 . 1 1 7 7 ASN CB C 7 38.859 38.859 37.505 1.354 17635 9051 1 16 . 1 1 7 7 ASN H H 7 7.734 7.734 8.142 -0.408 17635 9052 1 16 . 1 1 8 8 ASN N N 8 119.436 119.436 118.222 1.214 17635 9053 1 16 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.444 0.424 17635 9054 1 16 . 1 1 8 8 ASN C C 8 175.327 175.327 175.525 -0.198 17635 9055 1 16 . 1 1 8 8 ASN CA C 8 53.204 53.204 55.373 -2.169 17635 9056 1 16 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.810 -0.315 17635 9057 1 16 . 1 1 8 8 ASN H H 8 8.350 8.350 8.820 -0.470 17635 9058 1 16 . 1 1 9 9 THR N N 9 118.650 118.650 113.850 4.800 17635 9059 1 16 . 1 1 9 9 THR HA H 9 5.557 5.557 4.310 1.247 17635 9060 1 16 . 1 1 9 9 THR C C 9 177.117 177.117 174.773 2.344 17635 9061 1 16 . 1 1 9 9 THR CA C 9 62.314 62.314 63.566 -1.252 17635 9062 1 16 . 1 1 9 9 THR CB C 9 71.225 71.225 67.631 3.594 17635 9063 1 16 . 1 1 9 9 THR H H 9 8.428 8.428 7.677 0.751 17635 9064 1 16 . 1 1 10 10 ILE N N 10 118.556 118.556 122.485 -3.929 17635 9065 1 16 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.685 0.480 17635 9066 1 16 . 1 1 10 10 ILE C C 10 176.837 176.837 174.522 2.315 17635 9067 1 16 . 1 1 10 10 ILE CA C 10 59.298 59.298 59.289 0.009 17635 9068 1 16 . 1 1 10 10 ILE CB C 10 39.880 39.880 39.875 0.005 17635 9069 1 16 . 1 1 10 10 ILE H H 10 8.770 8.770 8.832 -0.062 17635 9070 1 16 . 1 1 11 11 PHE N N 11 123.798 123.798 121.177 2.621 17635 9071 1 16 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.902 0.518 17635 9072 1 16 . 1 1 11 11 PHE C C 11 177.066 177.066 174.454 2.612 17635 9073 1 16 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.486 -0.124 17635 9074 1 16 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.299 0.569 17635 9075 1 16 . 1 1 11 11 PHE H H 11 9.548 9.548 8.369 1.179 17635 9076 1 16 . 1 1 12 12 VAL N N 12 127.993 127.993 126.505 1.488 17635 9077 1 16 . 1 1 12 12 VAL HA H 12 4.958 4.958 5.371 -0.413 17635 9078 1 16 . 1 1 12 12 VAL C C 12 176.965 176.965 175.000 1.965 17635 9079 1 16 . 1 1 12 12 VAL CA C 12 59.835 59.835 60.493 -0.658 17635 9080 1 16 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.658 2.142 17635 9081 1 16 . 1 1 12 12 VAL H H 12 8.940 8.940 9.496 -0.556 17635 9082 1 16 . 1 1 13 13 GLN N N 13 122.289 122.289 127.400 -5.111 17635 9083 1 16 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.864 -0.085 17635 9084 1 16 . 1 1 13 13 GLN C C 13 175.631 175.631 175.635 -0.004 17635 9085 1 16 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.485 -0.375 17635 9086 1 16 . 1 1 13 13 GLN CB C 13 34.132 34.132 31.573 2.559 17635 9087 1 16 . 1 1 13 13 GLN H H 13 8.747 8.747 8.266 0.481 17635 9088 1 16 . 1 1 14 14 GLY N N 14 109.212 109.212 114.363 -5.151 17635 9089 1 16 . 1 1 14 14 GLY C C 14 175.436 175.436 172.840 2.596 17635 9090 1 16 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.362 0.068 17635 9091 1 16 . 1 1 14 14 GLY H H 14 8.236 8.236 9.176 -0.940 17635 9092 1 16 . 1 1 15 15 LEU N N 15 117.824 117.824 118.834 -1.010 17635 9093 1 16 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.552 -0.846 17635 9094 1 16 . 1 1 15 15 LEU C C 15 174.111 174.111 178.845 -4.734 17635 9095 1 16 . 1 1 15 15 LEU CA C 15 55.718 55.718 54.647 1.071 17635 9096 1 16 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.563 0.870 17635 9097 1 16 . 1 1 15 15 LEU H H 15 8.442 8.442 7.068 1.374 17635 9098 1 16 . 1 1 16 16 GLY N N 16 105.063 105.063 107.184 -2.121 17635 9099 1 16 . 1 1 16 16 GLY C C 16 177.771 177.771 174.898 2.873 17635 9100 1 16 . 1 1 16 16 GLY CA C 16 44.094 44.094 46.508 -2.414 17635 9101 1 16 . 1 1 16 16 GLY H H 16 8.006 8.006 8.605 -0.599 17635 9102 1 16 . 1 1 17 17 GLU N N 17 113.781 113.781 121.122 -7.341 17635 9103 1 16 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.430 -0.311 17635 9104 1 16 . 1 1 17 17 GLU C C 17 173.937 173.937 175.246 -1.309 17635 9105 1 16 . 1 1 17 17 GLU CA C 17 57.281 57.281 55.454 1.827 17635 9106 1 16 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.704 0.732 17635 9107 1 16 . 1 1 17 17 GLU H H 17 8.134 8.134 7.945 0.189 17635 9108 1 16 . 1 1 18 18 ASN N N 18 116.660 116.660 117.217 -0.557 17635 9109 1 16 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.511 0.430 17635 9110 1 16 . 1 1 18 18 ASN C C 18 175.900 175.900 175.081 0.819 17635 9111 1 16 . 1 1 18 18 ASN CA C 18 52.478 52.478 53.353 -0.875 17635 9112 1 16 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.206 -0.721 17635 9113 1 16 . 1 1 18 18 ASN H H 18 8.407 8.407 7.788 0.619 17635 9114 1 16 . 1 1 19 19 VAL N N 19 118.323 118.323 123.316 -4.993 17635 9115 1 16 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.703 0.449 17635 9116 1 16 . 1 1 19 19 VAL C C 19 177.655 177.655 174.773 2.882 17635 9117 1 16 . 1 1 19 19 VAL CA C 19 61.877 61.877 64.065 -2.188 17635 9118 1 16 . 1 1 19 19 VAL CB C 19 32.513 32.513 29.924 2.589 17635 9119 1 16 . 1 1 19 19 VAL H H 19 6.855 6.855 8.282 -1.427 17635 9120 1 16 . 1 1 20 20 THR N N 20 111.636 111.636 111.036 0.600 17635 9121 1 16 . 1 1 20 20 THR HA H 20 4.719 4.719 4.463 0.256 17635 9122 1 16 . 1 1 20 20 THR C C 20 175.266 175.266 174.398 0.868 17635 9123 1 16 . 1 1 20 20 THR CA C 20 58.698 58.698 60.340 -1.642 17635 9124 1 16 . 1 1 20 20 THR CB C 20 72.948 72.948 71.458 1.490 17635 9125 1 16 . 1 1 20 20 THR H H 20 7.328 7.328 7.671 -0.343 17635 9126 1 16 . 1 1 21 21 ILE N N 21 122.147 122.147 122.941 -0.794 17635 9127 1 16 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.826 -0.308 17635 9128 1 16 . 1 1 21 21 ILE C C 21 173.198 173.198 177.612 -4.414 17635 9129 1 16 . 1 1 21 21 ILE CA C 21 65.772 65.772 62.978 2.794 17635 9130 1 16 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.108 0.475 17635 9131 1 16 . 1 1 21 21 ILE H H 21 9.074 9.074 8.741 0.333 17635 9132 1 16 . 1 1 22 22 GLU N N 22 118.154 118.154 119.702 -1.548 17635 9133 1 16 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.018 -0.032 17635 9134 1 16 . 1 1 22 22 GLU C C 22 171.799 171.799 178.214 -6.415 17635 9135 1 16 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.537 1.076 17635 9136 1 16 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.432 0.359 17635 9137 1 16 . 1 1 22 22 GLU H H 22 8.814 8.814 8.725 0.089 17635 9138 1 16 . 1 1 23 23 SER N N 23 115.921 115.921 115.533 0.388 17635 9139 1 16 . 1 1 23 23 SER HA H 23 4.384 4.384 4.271 0.113 17635 9140 1 16 . 1 1 23 23 SER C C 23 172.447 172.447 176.721 -4.274 17635 9141 1 16 . 1 1 23 23 SER CA C 23 61.239 61.239 60.984 0.255 17635 9142 1 16 . 1 1 23 23 SER CB C 23 62.838 62.838 63.106 -0.268 17635 9143 1 16 . 1 1 23 23 SER H H 23 8.236 8.236 7.613 0.623 17635 9144 1 16 . 1 1 24 24 VAL N N 24 124.867 124.867 123.293 1.574 17635 9145 1 16 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.265 -0.517 17635 9146 1 16 . 1 1 24 24 VAL C C 24 173.016 173.016 178.184 -5.168 17635 9147 1 16 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.095 1.159 17635 9148 1 16 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.381 0.152 17635 9149 1 16 . 1 1 24 24 VAL H H 24 7.973 7.973 7.654 0.319 17635 9150 1 16 . 1 1 25 25 ALA N N 25 123.198 123.198 121.508 1.690 17635 9151 1 16 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.031 -0.132 17635 9152 1 16 . 1 1 25 25 ALA C C 25 171.061 171.061 178.868 -7.807 17635 9153 1 16 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.971 0.724 17635 9154 1 16 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.295 -0.557 17635 9155 1 16 . 1 1 25 25 ALA H H 25 8.695 8.695 8.602 0.093 17635 9156 1 16 . 1 1 26 26 ASP N N 26 115.503 115.503 118.897 -3.394 17635 9157 1 16 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.573 -0.250 17635 9158 1 16 . 1 1 26 26 ASP C C 26 173.108 173.108 178.346 -5.238 17635 9159 1 16 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.776 0.547 17635 9160 1 16 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.241 -0.189 17635 9161 1 16 . 1 1 26 26 ASP H H 26 8.312 8.312 8.377 -0.065 17635 9162 1 16 . 1 1 27 27 TYR N N 27 119.224 119.224 118.962 0.262 17635 9163 1 16 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.590 -0.390 17635 9164 1 16 . 1 1 27 27 TYR C C 27 172.908 172.908 176.638 -3.730 17635 9165 1 16 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.489 1.527 17635 9166 1 16 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.309 0.623 17635 9167 1 16 . 1 1 27 27 TYR H H 27 7.533 7.533 7.930 -0.397 17635 9168 1 16 . 1 1 28 28 PHE N N 28 112.595 112.595 119.113 -6.518 17635 9169 1 16 . 1 1 28 28 PHE HA H 28 4.330 4.330 3.929 0.401 17635 9170 1 16 . 1 1 28 28 PHE C C 28 173.082 173.082 175.011 -1.929 17635 9171 1 16 . 1 1 28 28 PHE CA C 28 61.784 61.784 56.998 4.786 17635 9172 1 16 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.587 1.417 17635 9173 1 16 . 1 1 28 28 PHE H H 28 7.974 7.974 8.299 -0.325 17635 9174 1 16 . 1 1 29 29 LYS N N 29 118.820 118.820 117.514 1.306 17635 9175 1 16 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.865 0.052 17635 9176 1 16 . 1 1 29 29 LYS C C 29 173.682 173.682 176.812 -3.130 17635 9177 1 16 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.040 2.240 17635 9178 1 16 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.816 -0.525 17635 9179 1 16 . 1 1 29 29 LYS H H 29 8.325 8.325 7.616 0.709 17635 9180 1 16 . 1 1 30 30 GLN N N 30 116.232 116.232 117.817 -1.585 17635 9181 1 16 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.366 -0.231 17635 9182 1 16 . 1 1 30 30 GLN C C 30 173.790 173.790 177.073 -3.283 17635 9183 1 16 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.350 0.196 17635 9184 1 16 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.134 0.765 17635 9185 1 16 . 1 1 30 30 GLN H H 30 7.518 7.518 8.222 -0.704 17635 9186 1 16 . 1 1 31 31 ILE N N 31 116.489 116.489 118.475 -1.986 17635 9187 1 16 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.165 0.074 17635 9188 1 16 . 1 1 31 31 ILE C C 31 175.599 175.599 176.132 -0.533 17635 9189 1 16 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.867 -3.647 17635 9190 1 16 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.980 1.354 17635 9191 1 16 . 1 1 31 31 ILE H H 31 7.809 7.809 8.531 -0.722 17635 9192 1 16 . 1 1 32 32 GLY N N 32 107.416 107.416 105.752 1.664 17635 9193 1 16 . 1 1 32 32 GLY C C 32 180.182 180.182 172.176 8.006 17635 9194 1 16 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.782 0.212 17635 9195 1 16 . 1 1 32 32 GLY H H 32 7.344 7.344 7.646 -0.302 17635 9196 1 16 . 1 1 33 33 ILE N N 33 117.784 117.784 120.951 -3.167 17635 9197 1 16 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.501 -0.412 17635 9198 1 16 . 1 1 33 33 ILE C C 33 173.301 173.301 175.189 -1.888 17635 9199 1 16 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.773 0.868 17635 9200 1 16 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.313 -0.654 17635 9201 1 16 . 1 1 33 33 ILE H H 33 8.173 8.173 8.471 -0.298 17635 9202 1 16 . 1 1 34 34 ILE N N 34 131.781 131.781 126.805 4.976 17635 9203 1 16 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.163 -0.376 17635 9204 1 16 . 1 1 34 34 ILE C C 34 174.663 174.663 175.631 -0.968 17635 9205 1 16 . 1 1 34 34 ILE CA C 34 61.370 61.370 59.749 1.621 17635 9206 1 16 . 1 1 34 34 ILE CB C 34 37.995 37.995 39.286 -1.291 17635 9207 1 16 . 1 1 34 34 ILE H H 34 8.687 8.687 8.549 0.138 17635 9208 1 16 . 1 1 35 35 LYS N N 35 130.372 130.372 126.425 3.947 17635 9209 1 16 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.276 -0.192 17635 9210 1 16 . 1 1 35 35 LYS C C 35 175.376 175.376 176.318 -0.942 17635 9211 1 16 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.962 0.511 17635 9212 1 16 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.400 2.264 17635 9213 1 16 . 1 1 35 35 LYS H H 35 8.680 8.680 8.525 0.155 17635 9214 1 16 . 1 1 36 36 THR N N 36 118.312 118.312 120.062 -1.750 17635 9215 1 16 . 1 1 36 36 THR HA H 36 4.415 4.415 4.359 0.056 17635 9216 1 16 . 1 1 36 36 THR C C 36 176.394 176.394 174.231 2.163 17635 9217 1 16 . 1 1 36 36 THR CA C 36 61.340 61.340 62.732 -1.392 17635 9218 1 16 . 1 1 36 36 THR CB C 36 70.809 70.809 69.306 1.502 17635 9219 1 16 . 1 1 36 36 THR H H 36 8.456 8.456 8.464 -0.008 17635 9220 1 16 . 1 1 37 37 ASN N N 37 124.092 124.092 123.155 0.937 17635 9221 1 16 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.874 -0.344 17635 9222 1 16 . 1 1 37 37 ASN C C 37 174.235 174.235 175.886 -1.651 17635 9223 1 16 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.958 1.106 17635 9224 1 16 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.564 -0.637 17635 9225 1 16 . 1 1 37 37 ASN H H 37 8.794 8.794 9.119 -0.325 17635 9226 1 16 . 1 1 38 38 LYS N N 38 127.969 127.969 123.237 4.732 17635 9227 1 16 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.205 -0.201 17635 9228 1 16 . 1 1 38 38 LYS C C 38 172.702 172.702 176.889 -4.187 17635 9229 1 16 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.936 -0.478 17635 9230 1 16 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.930 0.237 17635 9231 1 16 . 1 1 38 38 LYS H H 38 8.962 8.962 8.641 0.321 17635 9232 1 16 . 1 1 39 39 LYS N N 39 117.413 117.413 118.349 -0.936 17635 9233 1 16 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.254 0.004 17635 9234 1 16 . 1 1 39 39 LYS C C 39 172.261 172.261 177.629 -5.368 17635 9235 1 16 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.167 0.152 17635 9236 1 16 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.435 0.361 17635 9237 1 16 . 1 1 39 39 LYS H H 39 8.314 8.314 8.077 0.237 17635 9238 1 16 . 1 1 40 40 THR N N 40 105.547 105.547 107.119 -1.572 17635 9239 1 16 . 1 1 40 40 THR HA H 40 4.465 4.465 4.552 -0.087 17635 9240 1 16 . 1 1 40 40 THR C C 40 174.021 174.021 175.901 -1.880 17635 9241 1 16 . 1 1 40 40 THR CA C 40 61.260 61.260 61.640 -0.380 17635 9242 1 16 . 1 1 40 40 THR CB C 40 70.997 70.997 69.701 1.296 17635 9243 1 16 . 1 1 40 40 THR H H 40 7.422 7.422 7.671 -0.249 17635 9244 1 16 . 1 1 41 41 GLY N N 41 111.631 111.631 111.455 0.176 17635 9245 1 16 . 1 1 41 41 GLY C C 41 176.727 176.727 173.787 2.940 17635 9246 1 16 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.469 0.261 17635 9247 1 16 . 1 1 41 41 GLY H H 41 8.644 8.644 8.492 0.152 17635 9248 1 16 . 1 1 42 42 GLN N N 42 118.894 118.894 117.851 1.043 17635 9249 1 16 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.860 -0.191 17635 9250 1 16 . 1 1 42 42 GLN C C 42 177.178 177.178 173.308 3.870 17635 9251 1 16 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.289 1.292 17635 9252 1 16 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.100 0.130 17635 9253 1 16 . 1 1 42 42 GLN H H 42 7.662 7.662 7.629 0.033 17635 9254 1 16 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.279 0.316 17635 9255 1 16 . 1 1 43 43 PRO C C 43 172.629 172.629 176.085 -3.456 17635 9256 1 16 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.478 -0.656 17635 9257 1 16 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.195 0.501 17635 9258 1 16 . 1 1 44 44 MET N N 44 124.162 124.162 120.498 3.664 17635 9259 1 16 . 1 1 44 44 MET HA H 44 4.432 4.432 4.668 -0.236 17635 9260 1 16 . 1 1 44 44 MET C C 44 176.474 176.474 174.352 2.122 17635 9261 1 16 . 1 1 44 44 MET CA C 44 55.419 55.419 54.370 1.049 17635 9262 1 16 . 1 1 44 44 MET CB C 44 30.555 30.555 35.418 -4.863 17635 9263 1 16 . 1 1 44 44 MET H H 44 8.874 8.874 8.427 0.447 17635 9264 1 16 . 1 1 45 45 ILE N N 45 126.237 126.237 123.408 2.829 17635 9265 1 16 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.567 0.235 17635 9266 1 16 . 1 1 45 45 ILE C C 45 176.415 176.415 174.285 2.130 17635 9267 1 16 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.015 -0.799 17635 9268 1 16 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.734 -0.508 17635 9269 1 16 . 1 1 45 45 ILE H H 45 7.730 7.730 8.403 -0.673 17635 9270 1 16 . 1 1 46 46 ASN N N 46 124.735 124.735 123.964 0.771 17635 9271 1 16 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.046 -0.105 17635 9272 1 16 . 1 1 46 46 ASN C C 46 176.836 176.836 173.724 3.112 17635 9273 1 16 . 1 1 46 46 ASN CA C 46 51.561 51.561 51.285 0.276 17635 9274 1 16 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.132 0.338 17635 9275 1 16 . 1 1 46 46 ASN H H 46 8.384 8.384 8.977 -0.593 17635 9276 1 16 . 1 1 47 47 LEU N N 47 122.487 122.487 120.043 2.444 17635 9277 1 16 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.914 -0.199 17635 9278 1 16 . 1 1 47 47 LEU C C 47 174.190 174.190 175.990 -1.800 17635 9279 1 16 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.542 -1.210 17635 9280 1 16 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.301 -2.024 17635 9281 1 16 . 1 1 47 47 LEU H H 47 8.594 8.594 8.198 0.396 17635 9282 1 16 . 1 1 48 48 TYR N N 48 121.842 121.842 123.666 -1.824 17635 9283 1 16 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.777 -0.010 17635 9284 1 16 . 1 1 48 48 TYR C C 48 173.649 173.649 175.710 -2.061 17635 9285 1 16 . 1 1 48 48 TYR CA C 48 57.894 57.894 58.429 -0.535 17635 9286 1 16 . 1 1 48 48 TYR CB C 48 39.199 39.199 40.453 -1.254 17635 9287 1 16 . 1 1 48 48 TYR H H 48 7.666 7.666 9.277 -1.611 17635 9288 1 16 . 1 1 49 49 THR N N 49 116.554 116.554 113.285 3.269 17635 9289 1 16 . 1 1 49 49 THR HA H 49 4.806 4.806 4.680 0.126 17635 9290 1 16 . 1 1 49 49 THR C C 49 176.654 176.654 173.014 3.640 17635 9291 1 16 . 1 1 49 49 THR CA C 49 60.693 60.693 59.732 0.961 17635 9292 1 16 . 1 1 49 49 THR CB C 49 71.437 71.437 71.981 -0.544 17635 9293 1 16 . 1 1 49 49 THR H H 49 8.965 8.965 8.273 0.692 17635 9294 1 16 . 1 1 50 50 ASP N N 50 123.826 123.826 121.497 2.329 17635 9295 1 16 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.822 -0.198 17635 9296 1 16 . 1 1 50 50 ASP C C 50 173.380 173.380 176.482 -3.102 17635 9297 1 16 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.665 -0.577 17635 9298 1 16 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.146 0.721 17635 9299 1 16 . 1 1 50 50 ASP H H 50 8.939 8.939 8.755 0.184 17635 9300 1 16 . 1 1 51 51 ARG N N 51 127.794 127.794 119.490 8.304 17635 9301 1 16 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.457 -0.411 17635 9302 1 16 . 1 1 51 51 ARG C C 51 173.101 173.101 175.449 -2.348 17635 9303 1 16 . 1 1 51 51 ARG CA C 51 58.562 58.562 55.902 2.660 17635 9304 1 16 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.672 0.495 17635 9305 1 16 . 1 1 51 51 ARG H H 51 8.958 8.958 8.572 0.386 17635 9306 1 16 . 1 1 52 52 GLU N N 52 117.542 117.542 117.536 0.006 17635 9307 1 16 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.502 -0.224 17635 9308 1 16 . 1 1 52 52 GLU C C 52 172.201 172.201 175.898 -3.697 17635 9309 1 16 . 1 1 52 52 GLU CA C 52 58.524 58.524 56.284 2.240 17635 9310 1 16 . 1 1 52 52 GLU CB C 52 30.278 30.278 28.468 1.810 17635 9311 1 16 . 1 1 52 52 GLU H H 52 8.561 8.561 7.858 0.703 17635 9312 1 16 . 1 1 53 53 THR N N 53 107.065 107.065 113.051 -5.986 17635 9313 1 16 . 1 1 53 53 THR HA H 53 4.436 4.436 4.302 0.134 17635 9314 1 16 . 1 1 53 53 THR C C 53 173.851 173.851 175.054 -1.203 17635 9315 1 16 . 1 1 53 53 THR CA C 53 61.944 61.944 62.853 -0.909 17635 9316 1 16 . 1 1 53 53 THR CB C 53 71.197 71.197 69.019 2.179 17635 9317 1 16 . 1 1 53 53 THR H H 53 8.087 8.087 8.016 0.071 17635 9318 1 16 . 1 1 54 54 GLY N N 54 111.295 111.295 110.124 1.171 17635 9319 1 16 . 1 1 54 54 GLY C C 54 176.747 176.747 174.443 2.304 17635 9320 1 16 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.771 0.932 17635 9321 1 16 . 1 1 54 54 GLY H H 54 8.423 8.423 8.078 0.345 17635 9322 1 16 . 1 1 55 55 LYS N N 55 119.673 119.673 121.389 -1.716 17635 9323 1 16 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.244 0.109 17635 9324 1 16 . 1 1 55 55 LYS C C 55 173.854 173.854 176.534 -2.680 17635 9325 1 16 . 1 1 55 55 LYS CA C 55 55.842 55.842 56.996 -1.154 17635 9326 1 16 . 1 1 55 55 LYS CB C 55 33.821 33.821 33.383 0.438 17635 9327 1 16 . 1 1 55 55 LYS H H 55 7.767 7.767 7.641 0.126 17635 9328 1 16 . 1 1 56 56 LEU N N 56 122.426 122.426 116.688 5.738 17635 9329 1 16 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.796 -0.440 17635 9330 1 16 . 1 1 56 56 LEU C C 56 172.534 172.534 176.508 -3.974 17635 9331 1 16 . 1 1 56 56 LEU CA C 56 56.255 56.255 52.824 3.431 17635 9332 1 16 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.561 -0.907 17635 9333 1 16 . 1 1 56 56 LEU H H 56 8.768 8.768 8.304 0.464 17635 9334 1 16 . 1 1 57 57 LYS N N 57 118.264 118.264 118.898 -0.634 17635 9335 1 16 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.494 -0.206 17635 9336 1 16 . 1 1 57 57 LYS C C 57 173.648 173.648 177.609 -3.961 17635 9337 1 16 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.330 -0.065 17635 9338 1 16 . 1 1 57 57 LYS CB C 57 34.062 34.062 33.813 0.249 17635 9339 1 16 . 1 1 57 57 LYS H H 57 8.012 8.012 8.337 -0.325 17635 9340 1 16 . 1 1 58 58 GLY N N 58 108.514 108.514 107.660 0.854 17635 9341 1 16 . 1 1 58 58 GLY C C 58 177.876 177.876 172.713 5.163 17635 9342 1 16 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.108 1.256 17635 9343 1 16 . 1 1 58 58 GLY H H 58 8.334 8.334 8.060 0.274 17635 9344 1 16 . 1 1 59 59 GLU N N 59 116.119 116.119 117.791 -1.672 17635 9345 1 16 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.439 0.082 17635 9346 1 16 . 1 1 59 59 GLU C C 59 173.860 173.860 173.984 -0.124 17635 9347 1 16 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.161 -1.136 17635 9348 1 16 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.463 0.841 17635 9349 1 16 . 1 1 59 59 GLU H H 59 7.202 7.202 7.715 -0.513 17635 9350 1 16 . 1 1 60 60 ALA N N 60 123.607 123.607 124.039 -0.432 17635 9351 1 16 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.182 0.425 17635 9352 1 16 . 1 1 60 60 ALA C C 60 173.923 173.923 175.490 -1.567 17635 9353 1 16 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.972 -1.029 17635 9354 1 16 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.122 0.937 17635 9355 1 16 . 1 1 60 60 ALA H H 60 8.930 8.930 9.432 -0.502 17635 9356 1 16 . 1 1 61 61 THR N N 61 108.384 108.384 115.953 -7.569 17635 9357 1 16 . 1 1 61 61 THR HA H 61 5.743 5.743 4.989 0.754 17635 9358 1 16 . 1 1 61 61 THR C C 61 176.172 176.172 174.082 2.090 17635 9359 1 16 . 1 1 61 61 THR CA C 61 59.625 59.625 60.143 -0.518 17635 9360 1 16 . 1 1 61 61 THR CB C 61 71.224 71.224 69.468 1.756 17635 9361 1 16 . 1 1 61 61 THR H H 61 8.452 8.452 8.651 -0.199 17635 9362 1 16 . 1 1 62 62 VAL N N 62 120.200 120.200 127.188 -6.988 17635 9363 1 16 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.051 0.193 17635 9364 1 16 . 1 1 62 62 VAL C C 62 175.994 175.994 174.275 1.719 17635 9365 1 16 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.370 0.056 17635 9366 1 16 . 1 1 62 62 VAL CB C 62 34.685 34.685 33.463 1.222 17635 9367 1 16 . 1 1 62 62 VAL H H 62 8.071 8.071 8.376 -0.305 17635 9368 1 16 . 1 1 63 63 SER N N 63 121.689 121.689 121.969 -0.280 17635 9369 1 16 . 1 1 63 63 SER HA H 63 5.261 5.261 4.543 0.718 17635 9370 1 16 . 1 1 63 63 SER C C 63 177.943 177.943 172.710 5.233 17635 9371 1 16 . 1 1 63 63 SER CA C 63 57.662 57.662 58.247 -0.585 17635 9372 1 16 . 1 1 63 63 SER CB C 63 64.427 64.427 64.475 -0.048 17635 9373 1 16 . 1 1 63 63 SER H H 63 7.695 7.695 7.946 -0.251 17635 9374 1 16 . 1 1 64 64 PHE N N 64 122.640 122.640 120.029 2.611 17635 9375 1 16 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.825 0.029 17635 9376 1 16 . 1 1 64 64 PHE C C 64 174.605 174.605 175.452 -0.847 17635 9377 1 16 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.235 0.969 17635 9378 1 16 . 1 1 64 64 PHE CB C 64 41.976 41.976 43.300 -1.324 17635 9379 1 16 . 1 1 64 64 PHE H H 64 9.025 9.025 8.386 0.639 17635 9380 1 16 . 1 1 65 65 ASP N N 65 119.943 119.943 121.595 -1.652 17635 9381 1 16 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.680 -0.245 17635 9382 1 16 . 1 1 65 65 ASP C C 65 174.396 174.396 176.357 -1.961 17635 9383 1 16 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.931 1.511 17635 9384 1 16 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.330 -0.296 17635 9385 1 16 . 1 1 65 65 ASP H H 65 8.512 8.512 9.337 -0.825 17635 9386 1 16 . 1 1 66 66 ASP N N 66 116.125 116.125 118.544 -2.419 17635 9387 1 16 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.075 0.324 17635 9388 1 16 . 1 1 66 66 ASP C C 66 175.936 175.936 175.209 0.727 17635 9389 1 16 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.574 -0.781 17635 9390 1 16 . 1 1 66 66 ASP CB C 66 42.919 42.919 41.952 0.967 17635 9391 1 16 . 1 1 66 66 ASP H H 66 8.323 8.323 7.885 0.438 17635 9392 1 16 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.358 0.092 17635 9393 1 16 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.728 0.196 17635 9394 1 16 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.164 -0.334 17635 9395 1 16 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.221 0.198 17635 9396 1 16 . 1 1 68 68 PRO C C 68 171.345 171.345 179.041 -7.696 17635 9397 1 16 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.967 0.268 17635 9398 1 16 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.055 -0.058 17635 9399 1 16 . 1 1 69 69 SER N N 69 114.544 114.544 114.506 0.038 17635 9400 1 16 . 1 1 69 69 SER HA H 69 4.036 4.036 3.882 0.154 17635 9401 1 16 . 1 1 69 69 SER C C 69 176.535 176.535 175.729 0.806 17635 9402 1 16 . 1 1 69 69 SER CA C 69 61.837 61.837 61.676 0.161 17635 9403 1 16 . 1 1 69 69 SER CB C 69 62.773 62.773 62.453 0.320 17635 9404 1 16 . 1 1 69 69 SER H H 69 8.004 8.004 8.209 -0.205 17635 9405 1 16 . 1 1 70 70 ALA N N 70 122.649 122.649 123.744 -1.095 17635 9406 1 16 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.572 0.021 17635 9407 1 16 . 1 1 70 70 ALA C C 70 172.686 172.686 179.419 -6.733 17635 9408 1 16 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.257 -0.221 17635 9409 1 16 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.102 -0.238 17635 9410 1 16 . 1 1 70 70 ALA H H 70 7.383 7.383 7.405 -0.022 17635 9411 1 16 . 1 1 71 71 LYS N N 71 116.308 116.308 119.431 -3.123 17635 9412 1 16 . 1 1 71 71 LYS HA H 71 3.775 3.775 4.078 -0.303 17635 9413 1 16 . 1 1 71 71 LYS C C 71 172.333 172.333 178.736 -6.403 17635 9414 1 16 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.371 0.631 17635 9415 1 16 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.285 0.157 17635 9416 1 16 . 1 1 71 71 LYS H H 71 7.159 7.159 7.475 -0.316 17635 9417 1 16 . 1 1 72 72 ALA N N 72 119.806 119.806 120.885 -1.079 17635 9418 1 16 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.053 0.113 17635 9419 1 16 . 1 1 72 72 ALA C C 72 170.530 170.530 179.834 -9.304 17635 9420 1 16 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.900 -0.185 17635 9421 1 16 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.065 -0.245 17635 9422 1 16 . 1 1 72 72 ALA H H 72 7.924 7.924 8.485 -0.561 17635 9423 1 16 . 1 1 73 73 ALA N N 73 120.524 120.524 121.013 -0.489 17635 9424 1 16 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.224 0.055 17635 9425 1 16 . 1 1 73 73 ALA C C 73 171.039 171.039 179.524 -8.485 17635 9426 1 16 . 1 1 73 73 ALA CA C 73 55.379 55.379 55.144 0.235 17635 9427 1 16 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.980 0.151 17635 9428 1 16 . 1 1 73 73 ALA H H 73 8.104 8.104 7.890 0.214 17635 9429 1 16 . 1 1 74 74 ILE N N 74 119.875 119.875 118.149 1.726 17635 9430 1 16 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.734 -0.320 17635 9431 1 16 . 1 1 74 74 ILE C C 74 172.435 172.435 177.697 -5.262 17635 9432 1 16 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.080 0.764 17635 9433 1 16 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.644 1.099 17635 9434 1 16 . 1 1 74 74 ILE H H 74 7.574 7.574 7.769 -0.195 17635 9435 1 16 . 1 1 75 75 ASP N N 75 117.867 117.867 118.404 -0.537 17635 9436 1 16 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.465 -0.154 17635 9437 1 16 . 1 1 75 75 ASP C C 75 172.054 172.054 176.640 -4.586 17635 9438 1 16 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.634 0.527 17635 9439 1 16 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.357 -0.826 17635 9440 1 16 . 1 1 75 75 ASP H H 75 7.937 7.937 8.045 -0.108 17635 9441 1 16 . 1 1 76 76 TRP N N 76 117.313 117.313 120.305 -2.992 17635 9442 1 16 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.432 -0.076 17635 9443 1 16 . 1 1 76 76 TRP C C 76 173.272 173.272 176.682 -3.410 17635 9444 1 16 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.555 0.907 17635 9445 1 16 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.560 1.217 17635 9446 1 16 . 1 1 76 76 TRP H H 76 8.475 8.475 7.528 0.947 17635 9447 1 16 . 1 1 77 77 PHE N N 77 112.019 112.019 116.892 -4.873 17635 9448 1 16 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.012 0.636 17635 9449 1 16 . 1 1 77 77 PHE C C 77 173.747 173.747 175.477 -1.730 17635 9450 1 16 . 1 1 77 77 PHE CA C 77 59.921 59.921 59.688 0.233 17635 9451 1 16 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.345 2.385 17635 9452 1 16 . 1 1 77 77 PHE H H 77 8.488 8.488 7.067 1.421 17635 9453 1 16 . 1 1 78 78 ASP N N 78 118.408 118.408 119.209 -0.801 17635 9454 1 16 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.430 0.034 17635 9455 1 16 . 1 1 78 78 ASP C C 78 172.542 172.542 176.565 -4.023 17635 9456 1 16 . 1 1 78 78 ASP CA C 78 58.690 58.690 54.715 3.975 17635 9457 1 16 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.524 2.362 17635 9458 1 16 . 1 1 78 78 ASP H H 78 7.978 7.978 8.476 -0.498 17635 9459 1 16 . 1 1 79 79 GLY N N 79 115.548 115.548 102.584 12.964 17635 9460 1 16 . 1 1 79 79 GLY C C 79 175.680 175.680 173.381 2.299 17635 9461 1 16 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.792 1.280 17635 9462 1 16 . 1 1 79 79 GLY H H 79 8.615 8.615 8.301 0.314 17635 9463 1 16 . 1 1 80 80 LYS N N 80 120.271 120.271 119.666 0.605 17635 9464 1 16 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.391 0.071 17635 9465 1 16 . 1 1 80 80 LYS C C 80 175.853 175.853 175.191 0.662 17635 9466 1 16 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.242 -0.092 17635 9467 1 16 . 1 1 80 80 LYS CB C 80 32.426 32.426 33.901 -1.475 17635 9468 1 16 . 1 1 80 80 LYS H H 80 8.013 8.013 7.867 0.146 17635 9469 1 16 . 1 1 81 81 GLU N N 81 115.765 115.765 118.336 -2.571 17635 9470 1 16 . 1 1 81 81 GLU HA H 81 4.698 4.698 4.915 -0.217 17635 9471 1 16 . 1 1 81 81 GLU C C 81 173.263 173.263 175.825 -2.562 17635 9472 1 16 . 1 1 81 81 GLU CA C 81 55.924 55.924 54.901 1.023 17635 9473 1 16 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.071 0.971 17635 9474 1 16 . 1 1 81 81 GLU H H 81 8.201 8.201 8.479 -0.278 17635 9475 1 16 . 1 1 82 82 PHE N N 82 127.080 127.080 125.585 1.495 17635 9476 1 16 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.256 0.240 17635 9477 1 16 . 1 1 82 82 PHE C C 82 175.349 175.349 175.818 -0.469 17635 9478 1 16 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.698 1.018 17635 9479 1 16 . 1 1 82 82 PHE CB C 82 41.994 41.994 38.730 3.264 17635 9480 1 16 . 1 1 82 82 PHE H H 82 9.162 9.162 9.016 0.146 17635 9481 1 16 . 1 1 83 83 SER N N 83 125.136 125.136 119.791 5.345 17635 9482 1 16 . 1 1 83 83 SER HA H 83 3.803 3.803 4.168 -0.365 17635 9483 1 16 . 1 1 83 83 SER C C 83 175.543 175.543 174.681 0.862 17635 9484 1 16 . 1 1 83 83 SER CA C 83 58.371 58.371 59.851 -1.480 17635 9485 1 16 . 1 1 83 83 SER CB C 83 62.519 62.519 62.779 -0.260 17635 9486 1 16 . 1 1 83 83 SER H H 83 9.193 9.193 9.102 0.091 17635 9487 1 16 . 1 1 84 84 GLY N N 84 103.581 103.581 106.029 -2.448 17635 9488 1 16 . 1 1 84 84 GLY C C 84 177.188 177.188 173.648 3.540 17635 9489 1 16 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.833 0.219 17635 9490 1 16 . 1 1 84 84 GLY H H 84 8.446 8.446 8.108 0.338 17635 9491 1 16 . 1 1 85 85 ASN N N 85 119.051 119.051 121.426 -2.375 17635 9492 1 16 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.167 0.167 17635 9493 1 16 . 1 1 85 85 ASN C C 85 178.020 178.020 172.750 5.270 17635 9494 1 16 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.148 -0.677 17635 9495 1 16 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.628 2.489 17635 9496 1 16 . 1 1 85 85 ASN H H 85 7.762 7.762 8.176 -0.414 17635 9497 1 16 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.391 -0.724 17635 9498 1 16 . 1 1 86 86 PRO C C 86 173.474 173.474 176.062 -2.588 17635 9499 1 16 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.292 0.418 17635 9500 1 16 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.051 -1.181 17635 9501 1 16 . 1 1 87 87 ILE N N 87 117.270 117.270 115.552 1.718 17635 9502 1 16 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.425 -0.279 17635 9503 1 16 . 1 1 87 87 ILE C C 87 174.495 174.495 174.151 0.344 17635 9504 1 16 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.523 0.968 17635 9505 1 16 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.650 -0.979 17635 9506 1 16 . 1 1 87 87 ILE H H 87 8.469 8.469 9.144 -0.675 17635 9507 1 16 . 1 1 88 88 LYS N N 88 122.271 122.271 120.345 1.926 17635 9508 1 16 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.825 0.367 17635 9509 1 16 . 1 1 88 88 LYS C C 88 174.393 174.393 174.426 -0.033 17635 9510 1 16 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.219 -1.081 17635 9511 1 16 . 1 1 88 88 LYS CB C 88 35.049 35.049 36.172 -1.123 17635 9512 1 16 . 1 1 88 88 LYS H H 88 8.353 8.353 8.146 0.207 17635 9513 1 16 . 1 1 89 89 VAL N N 89 125.661 125.661 121.268 4.393 17635 9514 1 16 . 1 1 89 89 VAL HA H 89 4.963 4.963 5.354 -0.391 17635 9515 1 16 . 1 1 89 89 VAL C C 89 177.160 177.160 175.583 1.577 17635 9516 1 16 . 1 1 89 89 VAL CA C 89 61.361 61.361 60.336 1.026 17635 9517 1 16 . 1 1 89 89 VAL CB C 89 34.770 34.770 33.433 1.337 17635 9518 1 16 . 1 1 89 89 VAL H H 89 9.414 9.414 8.431 0.983 17635 9519 1 16 . 1 1 90 90 SER N N 90 119.538 119.538 121.494 -1.956 17635 9520 1 16 . 1 1 90 90 SER HA H 90 4.710 4.710 4.694 0.017 17635 9521 1 16 . 1 1 90 90 SER C C 90 176.533 176.533 173.653 2.880 17635 9522 1 16 . 1 1 90 90 SER CA C 90 56.936 56.936 56.964 -0.028 17635 9523 1 16 . 1 1 90 90 SER CB C 90 66.470 66.470 65.959 0.511 17635 9524 1 16 . 1 1 90 90 SER H H 90 8.945 8.945 8.313 0.632 17635 9525 1 16 . 1 1 91 91 PHE N N 91 120.115 120.115 120.242 -0.127 17635 9526 1 16 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.522 0.151 17635 9527 1 16 . 1 1 91 91 PHE C C 91 173.349 173.349 175.606 -2.257 17635 9528 1 16 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.645 4.510 17635 9529 1 16 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.175 2.328 17635 9530 1 16 . 1 1 91 91 PHE H H 91 8.919 8.919 8.619 0.300 17635 9531 1 16 . 1 1 92 92 ALA N N 92 124.386 124.386 122.584 1.802 17635 9532 1 16 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.182 0.174 17635 9533 1 16 . 1 1 92 92 ALA C C 92 172.984 172.984 177.406 -4.422 17635 9534 1 16 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.488 -0.390 17635 9535 1 16 . 1 1 92 92 ALA CB C 92 19.406 19.406 17.573 1.833 17635 9536 1 16 . 1 1 92 92 ALA H H 92 8.563 8.563 7.792 0.771 17635 9537 1 16 . 1 1 93 93 THR N N 93 116.073 116.073 113.803 2.270 17635 9538 1 16 . 1 1 93 93 THR HA H 93 4.208 4.208 4.220 -0.012 17635 9539 1 16 . 1 1 93 93 THR C C 93 176.032 176.032 174.721 1.311 17635 9540 1 16 . 1 1 93 93 THR CA C 93 62.255 62.255 63.216 -0.961 17635 9541 1 16 . 1 1 93 93 THR CB C 93 69.708 69.708 69.449 0.259 17635 9542 1 16 . 1 1 93 93 THR H H 93 8.312 8.312 8.584 -0.272 17635 9543 1 16 . 1 1 94 94 ARG N N 94 124.359 124.359 126.029 -1.670 17635 9544 1 16 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.512 -0.175 17635 9545 1 16 . 1 1 94 94 ARG C C 94 174.426 174.426 175.309 -0.883 17635 9546 1 16 . 1 1 94 94 ARG CA C 94 56.055 56.055 55.764 0.291 17635 9547 1 16 . 1 1 94 94 ARG CB C 94 30.911 30.911 32.346 -1.435 17635 9548 1 16 . 1 1 94 94 ARG H H 94 8.493 8.493 8.744 -0.251 17635 9549 1 16 . 1 1 95 95 ARG N N 95 122.515 122.515 121.290 1.225 17635 9550 1 16 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.070 0.158 17635 9551 1 16 . 1 1 95 95 ARG C C 95 174.306 174.306 176.134 -1.828 17635 9552 1 16 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.715 -0.573 17635 9553 1 16 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.366 1.600 17635 9554 1 16 . 1 1 95 95 ARG H H 95 8.343 8.343 8.653 -0.310 17635 9555 1 16 . 1 1 96 96 ALA N N 96 125.127 125.127 123.761 1.366 17635 9556 1 16 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.468 -0.259 17635 9557 1 16 . 1 1 96 96 ALA C C 96 173.226 173.226 176.432 -3.206 17635 9558 1 16 . 1 1 96 96 ALA CA C 96 52.770 52.770 51.640 1.130 17635 9559 1 16 . 1 1 96 96 ALA CB C 96 19.193 19.193 17.930 1.263 17635 9560 1 16 . 1 1 96 96 ALA H H 96 8.402 8.402 8.393 0.009 17635 9561 1 16 . 1 1 97 97 ASP N N 97 118.483 118.483 121.516 -3.033 17635 9562 1 16 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.547 -0.049 17635 9563 1 16 . 1 1 97 97 ASP C C 97 174.302 174.302 176.500 -2.198 17635 9564 1 16 . 1 1 97 97 ASP CA C 97 54.091 54.091 55.735 -1.644 17635 9565 1 16 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.371 -0.464 17635 9566 1 16 . 1 1 97 97 ASP H H 97 8.206 8.206 7.968 0.238 17635 9567 1 16 . 1 1 98 98 PHE N N 98 120.321 120.321 120.555 -0.234 17635 9568 1 16 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.675 -0.185 17635 9569 1 16 . 1 1 98 98 PHE C C 98 174.878 174.878 176.159 -1.281 17635 9570 1 16 . 1 1 98 98 PHE CA C 98 58.160 58.160 57.272 0.888 17635 9571 1 16 . 1 1 98 98 PHE CB C 98 39.303 39.303 40.028 -0.725 17635 9572 1 16 . 1 1 98 98 PHE H H 98 7.990 7.990 8.426 -0.436 17635 9573 1 16 . 1 1 99 99 ASN N N 99 120.016 120.016 124.414 -4.398 17635 9574 1 16 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.614 -0.005 17635 9575 1 16 . 1 1 99 99 ASN C C 99 175.348 175.348 174.756 0.592 17635 9576 1 16 . 1 1 99 99 ASN CA C 99 53.313 53.313 54.822 -1.509 17635 9577 1 16 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.229 -0.502 17635 9578 1 16 . 1 1 99 99 ASN H H 99 8.336 8.336 9.074 -0.738 17635 9579 1 16 . 1 1 100 100 ARG N N 100 121.374 121.374 119.071 2.303 17635 9580 1 16 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.284 -0.011 17635 9581 1 16 . 1 1 100 100 ARG C C 100 173.627 173.627 175.466 -1.839 17635 9582 1 16 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.072 0.420 17635 9583 1 16 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.884 -0.365 17635 9584 1 16 . 1 1 100 100 ARG H H 100 8.181 8.181 7.966 0.215 17635 9585 1 16 . 1 1 101 101 GLY N N 101 109.586 109.586 111.071 -1.485 17635 9586 1 16 . 1 1 101 101 GLY C C 101 175.739 175.739 174.272 1.467 17635 9587 1 16 . 1 1 101 101 GLY CA C 101 45.380 45.380 45.435 -0.056 17635 9588 1 16 . 1 1 101 101 GLY H H 101 8.413 8.413 8.430 -0.017 17635 9589 1 16 . 1 1 102 102 GLY N N 102 108.692 108.692 107.393 1.299 17635 9590 1 16 . 1 1 102 102 GLY C C 102 176.286 176.286 175.143 1.143 17635 9591 1 16 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.750 0.588 17635 9592 1 16 . 1 1 102 102 GLY H H 102 8.281 8.281 8.521 -0.240 17635 9593 1 16 . 1 1 103 103 GLY N N 103 108.844 108.844 108.318 0.526 17635 9594 1 16 . 1 1 103 103 GLY C C 103 175.798 175.798 174.221 1.577 17635 9595 1 16 . 1 1 103 103 GLY CA C 103 45.346 45.346 45.066 0.280 17635 9596 1 16 . 1 1 103 103 GLY H H 103 8.364 8.364 8.032 0.332 17635 9597 1 16 . 1 1 104 104 ASN N N 104 118.527 118.527 117.408 1.119 17635 9598 1 16 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.388 0.330 17635 9599 1 16 . 1 1 104 104 ASN C C 104 174.547 174.547 175.454 -0.907 17635 9600 1 16 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.382 -0.173 17635 9601 1 16 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.040 -0.161 17635 9602 1 16 . 1 1 104 104 ASN H H 104 8.438 8.438 8.360 0.078 17635 9603 1 16 . 1 1 105 105 GLY N N 105 109.166 109.166 108.152 1.014 17635 9604 1 16 . 1 1 105 105 GLY C C 105 176.074 176.074 173.818 2.256 17635 9605 1 16 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.141 0.461 17635 9606 1 16 . 1 1 105 105 GLY H H 105 8.477 8.477 8.524 -0.047 17635 9607 1 16 . 1 1 106 106 ARG N N 106 120.341 120.341 120.027 0.314 17635 9608 1 16 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.655 -0.304 17635 9609 1 16 . 1 1 106 106 ARG C C 106 173.491 173.491 176.132 -2.641 17635 9610 1 16 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.007 1.220 17635 9611 1 16 . 1 1 106 106 ARG CB C 106 30.629 30.629 31.254 -0.625 17635 9612 1 16 . 1 1 106 106 ARG H H 106 8.244 8.244 7.705 0.539 17635 9613 1 16 . 1 1 107 107 GLY N N 107 109.856 109.856 108.543 1.313 17635 9614 1 16 . 1 1 107 107 GLY C C 107 175.834 175.834 174.719 1.115 17635 9615 1 16 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.964 0.477 17635 9616 1 16 . 1 1 107 107 GLY H H 107 8.522 8.522 8.645 -0.123 17635 9617 1 17 . 1 1 2 2 GLN N N 2 121.692 121.692 117.191 4.501 17635 9618 1 17 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.205 0.061 17635 9619 1 17 . 1 1 2 2 GLN C C 2 175.248 175.248 175.070 0.178 17635 9620 1 17 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.782 -0.786 17635 9621 1 17 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.723 0.916 17635 9622 1 17 . 1 1 2 2 GLN H H 2 8.621 8.621 8.424 0.197 17635 9623 1 17 . 1 1 3 3 ASP N N 3 121.801 121.801 120.241 1.560 17635 9624 1 17 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.630 -0.062 17635 9625 1 17 . 1 1 3 3 ASP C C 3 174.336 174.336 175.332 -0.996 17635 9626 1 17 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.138 -0.076 17635 9627 1 17 . 1 1 3 3 ASP CB C 3 41.071 41.071 38.639 2.432 17635 9628 1 17 . 1 1 3 3 ASP H H 3 8.436 8.436 8.563 -0.127 17635 9629 1 17 . 1 1 4 4 ASN N N 4 120.292 120.292 119.794 0.498 17635 9630 1 17 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.887 -0.250 17635 9631 1 17 . 1 1 4 4 ASN C C 4 174.415 174.415 174.679 -0.264 17635 9632 1 17 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.553 1.308 17635 9633 1 17 . 1 1 4 4 ASN CB C 4 38.534 38.534 40.110 -1.576 17635 9634 1 17 . 1 1 4 4 ASN H H 4 8.528 8.528 8.261 0.267 17635 9635 1 17 . 1 1 5 5 SER N N 5 117.091 117.091 117.074 0.017 17635 9636 1 17 . 1 1 5 5 SER HA H 5 4.163 4.163 4.606 -0.443 17635 9637 1 17 . 1 1 5 5 SER C C 5 176.370 176.370 174.519 1.851 17635 9638 1 17 . 1 1 5 5 SER CA C 5 60.846 60.846 58.236 2.610 17635 9639 1 17 . 1 1 5 5 SER CB C 5 63.136 63.136 63.340 -0.203 17635 9640 1 17 . 1 1 5 5 SER H H 5 8.470 8.470 8.516 -0.046 17635 9641 1 17 . 1 1 6 6 ASP N N 6 119.436 119.436 121.085 -1.649 17635 9642 1 17 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.462 0.233 17635 9643 1 17 . 1 1 6 6 ASP C C 6 175.048 175.048 175.639 -0.591 17635 9644 1 17 . 1 1 6 6 ASP CA C 6 53.094 53.094 56.340 -3.246 17635 9645 1 17 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.852 0.083 17635 9646 1 17 . 1 1 6 6 ASP H H 6 8.218 8.218 8.305 -0.087 17635 9647 1 17 . 1 1 7 7 ASN N N 7 119.696 119.696 116.922 2.774 17635 9648 1 17 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.908 -0.280 17635 9649 1 17 . 1 1 7 7 ASN C C 7 176.539 176.539 174.582 1.957 17635 9650 1 17 . 1 1 7 7 ASN CA C 7 53.158 53.158 52.161 0.997 17635 9651 1 17 . 1 1 7 7 ASN CB C 7 38.859 38.859 40.035 -1.176 17635 9652 1 17 . 1 1 7 7 ASN H H 7 7.734 7.734 7.514 0.220 17635 9653 1 17 . 1 1 8 8 ASN N N 8 119.436 119.436 117.642 1.794 17635 9654 1 17 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.819 0.049 17635 9655 1 17 . 1 1 8 8 ASN C C 8 175.327 175.327 175.056 0.271 17635 9656 1 17 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.138 -0.934 17635 9657 1 17 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.238 -0.743 17635 9658 1 17 . 1 1 8 8 ASN H H 8 8.350 8.350 8.876 -0.526 17635 9659 1 17 . 1 1 9 9 THR N N 9 118.650 118.650 115.785 2.865 17635 9660 1 17 . 1 1 9 9 THR HA H 9 5.557 5.557 4.667 0.890 17635 9661 1 17 . 1 1 9 9 THR C C 9 177.117 177.117 173.986 3.131 17635 9662 1 17 . 1 1 9 9 THR CA C 9 62.314 62.314 63.344 -1.030 17635 9663 1 17 . 1 1 9 9 THR CB C 9 71.225 71.225 69.934 1.291 17635 9664 1 17 . 1 1 9 9 THR H H 9 8.428 8.428 7.570 0.858 17635 9665 1 17 . 1 1 10 10 ILE N N 10 118.556 118.556 117.472 1.084 17635 9666 1 17 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.010 0.155 17635 9667 1 17 . 1 1 10 10 ILE C C 10 176.837 176.837 174.136 2.701 17635 9668 1 17 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.521 0.777 17635 9669 1 17 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.822 -1.942 17635 9670 1 17 . 1 1 10 10 ILE H H 10 8.770 8.770 8.820 -0.050 17635 9671 1 17 . 1 1 11 11 PHE N N 11 123.798 123.798 120.113 3.685 17635 9672 1 17 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.740 0.680 17635 9673 1 17 . 1 1 11 11 PHE C C 11 177.066 177.066 174.466 2.600 17635 9674 1 17 . 1 1 11 11 PHE CA C 11 55.362 55.362 57.108 -1.746 17635 9675 1 17 . 1 1 11 11 PHE CB C 11 41.868 41.868 42.039 -0.171 17635 9676 1 17 . 1 1 11 11 PHE H H 11 9.548 9.548 8.026 1.522 17635 9677 1 17 . 1 1 12 12 VAL N N 12 127.993 127.993 125.440 2.553 17635 9678 1 17 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.617 0.341 17635 9679 1 17 . 1 1 12 12 VAL C C 12 176.965 176.965 174.730 2.235 17635 9680 1 17 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.423 -1.588 17635 9681 1 17 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.462 2.338 17635 9682 1 17 . 1 1 12 12 VAL H H 12 8.940 8.940 8.845 0.095 17635 9683 1 17 . 1 1 13 13 GLN N N 13 122.289 122.289 127.348 -5.059 17635 9684 1 17 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.576 0.203 17635 9685 1 17 . 1 1 13 13 GLN C C 13 175.631 175.631 175.975 -0.344 17635 9686 1 17 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.605 -0.495 17635 9687 1 17 . 1 1 13 13 GLN CB C 13 34.132 34.132 31.646 2.486 17635 9688 1 17 . 1 1 13 13 GLN H H 13 8.747 8.747 8.136 0.611 17635 9689 1 17 . 1 1 14 14 GLY N N 14 109.212 109.212 111.176 -1.964 17635 9690 1 17 . 1 1 14 14 GLY C C 14 175.436 175.436 174.060 1.376 17635 9691 1 17 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.228 0.202 17635 9692 1 17 . 1 1 14 14 GLY H H 14 8.236 8.236 8.757 -0.521 17635 9693 1 17 . 1 1 15 15 LEU N N 15 117.824 117.824 121.391 -3.567 17635 9694 1 17 . 1 1 15 15 LEU HA H 15 3.706 3.706 3.352 0.354 17635 9695 1 17 . 1 1 15 15 LEU C C 15 174.111 174.111 177.473 -3.362 17635 9696 1 17 . 1 1 15 15 LEU CA C 15 55.718 55.718 56.633 -0.915 17635 9697 1 17 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.338 1.095 17635 9698 1 17 . 1 1 15 15 LEU H H 15 8.442 8.442 8.298 0.144 17635 9699 1 17 . 1 1 16 16 GLY N N 16 105.063 105.063 105.055 0.008 17635 9700 1 17 . 1 1 16 16 GLY C C 16 177.771 177.771 173.906 3.865 17635 9701 1 17 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.403 -0.309 17635 9702 1 17 . 1 1 16 16 GLY H H 16 8.006 8.006 7.580 0.426 17635 9703 1 17 . 1 1 17 17 GLU N N 17 113.781 113.781 118.170 -4.389 17635 9704 1 17 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.697 0.422 17635 9705 1 17 . 1 1 17 17 GLU C C 17 173.937 173.937 175.729 -1.792 17635 9706 1 17 . 1 1 17 17 GLU CA C 17 57.281 57.281 57.108 0.173 17635 9707 1 17 . 1 1 17 17 GLU CB C 17 30.436 30.436 28.867 1.569 17635 9708 1 17 . 1 1 17 17 GLU H H 17 8.134 8.134 8.615 -0.481 17635 9709 1 17 . 1 1 18 18 ASN N N 18 116.660 116.660 113.716 2.944 17635 9710 1 17 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.720 0.221 17635 9711 1 17 . 1 1 18 18 ASN C C 18 175.900 175.900 174.345 1.555 17635 9712 1 17 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.373 0.105 17635 9713 1 17 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.067 -0.582 17635 9714 1 17 . 1 1 18 18 ASN H H 18 8.407 8.407 8.035 0.372 17635 9715 1 17 . 1 1 19 19 VAL N N 19 118.323 118.323 122.142 -3.819 17635 9716 1 17 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.813 0.339 17635 9717 1 17 . 1 1 19 19 VAL C C 19 177.655 177.655 174.961 2.694 17635 9718 1 17 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.206 -1.329 17635 9719 1 17 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.035 2.478 17635 9720 1 17 . 1 1 19 19 VAL H H 19 6.855 6.855 7.939 -1.084 17635 9721 1 17 . 1 1 20 20 THR N N 20 111.636 111.636 116.841 -5.205 17635 9722 1 17 . 1 1 20 20 THR HA H 20 4.719 4.719 4.683 0.036 17635 9723 1 17 . 1 1 20 20 THR C C 20 175.266 175.266 174.667 0.599 17635 9724 1 17 . 1 1 20 20 THR CA C 20 58.698 58.698 59.438 -0.740 17635 9725 1 17 . 1 1 20 20 THR CB C 20 72.948 72.948 72.309 0.639 17635 9726 1 17 . 1 1 20 20 THR H H 20 7.328 7.328 8.053 -0.725 17635 9727 1 17 . 1 1 21 21 ILE N N 21 122.147 122.147 123.081 -0.934 17635 9728 1 17 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.734 -0.216 17635 9729 1 17 . 1 1 21 21 ILE C C 21 173.198 173.198 177.577 -4.379 17635 9730 1 17 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.315 1.457 17635 9731 1 17 . 1 1 21 21 ILE CB C 21 37.583 37.583 36.511 1.072 17635 9732 1 17 . 1 1 21 21 ILE H H 21 9.074 9.074 8.902 0.172 17635 9733 1 17 . 1 1 22 22 GLU N N 22 118.154 118.154 120.459 -2.305 17635 9734 1 17 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.158 -0.172 17635 9735 1 17 . 1 1 22 22 GLU C C 22 171.799 171.799 178.980 -7.181 17635 9736 1 17 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.410 1.203 17635 9737 1 17 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.309 0.482 17635 9738 1 17 . 1 1 22 22 GLU H H 22 8.814 8.814 8.640 0.174 17635 9739 1 17 . 1 1 23 23 SER N N 23 115.921 115.921 114.030 1.891 17635 9740 1 17 . 1 1 23 23 SER HA H 23 4.384 4.384 4.305 0.079 17635 9741 1 17 . 1 1 23 23 SER C C 23 172.447 172.447 176.473 -4.026 17635 9742 1 17 . 1 1 23 23 SER CA C 23 61.239 61.239 61.247 -0.008 17635 9743 1 17 . 1 1 23 23 SER CB C 23 62.838 62.838 62.800 0.039 17635 9744 1 17 . 1 1 23 23 SER H H 23 8.236 8.236 8.134 0.102 17635 9745 1 17 . 1 1 24 24 VAL N N 24 124.867 124.867 121.108 3.759 17635 9746 1 17 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.170 -0.422 17635 9747 1 17 . 1 1 24 24 VAL C C 24 173.016 173.016 177.704 -4.688 17635 9748 1 17 . 1 1 24 24 VAL CA C 24 67.254 67.254 65.172 2.082 17635 9749 1 17 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.247 0.286 17635 9750 1 17 . 1 1 24 24 VAL H H 24 7.973 7.973 7.985 -0.012 17635 9751 1 17 . 1 1 25 25 ALA N N 25 123.198 123.198 122.027 1.171 17635 9752 1 17 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.080 -0.181 17635 9753 1 17 . 1 1 25 25 ALA C C 25 171.061 171.061 178.831 -7.770 17635 9754 1 17 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.975 0.720 17635 9755 1 17 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.315 -0.577 17635 9756 1 17 . 1 1 25 25 ALA H H 25 8.695 8.695 8.501 0.194 17635 9757 1 17 . 1 1 26 26 ASP N N 26 115.503 115.503 118.335 -2.832 17635 9758 1 17 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.531 -0.208 17635 9759 1 17 . 1 1 26 26 ASP C C 26 173.108 173.108 178.107 -4.999 17635 9760 1 17 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.626 0.697 17635 9761 1 17 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.520 -0.468 17635 9762 1 17 . 1 1 26 26 ASP H H 26 8.312 8.312 8.267 0.045 17635 9763 1 17 . 1 1 27 27 TYR N N 27 119.224 119.224 119.275 -0.051 17635 9764 1 17 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.542 -0.342 17635 9765 1 17 . 1 1 27 27 TYR C C 27 172.908 172.908 175.841 -2.933 17635 9766 1 17 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.423 2.593 17635 9767 1 17 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.126 0.806 17635 9768 1 17 . 1 1 27 27 TYR H H 27 7.533 7.533 7.831 -0.298 17635 9769 1 17 . 1 1 28 28 PHE N N 28 112.595 112.595 119.978 -7.383 17635 9770 1 17 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.083 0.247 17635 9771 1 17 . 1 1 28 28 PHE C C 28 173.082 173.082 174.639 -1.557 17635 9772 1 17 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.388 6.396 17635 9773 1 17 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.656 1.347 17635 9774 1 17 . 1 1 28 28 PHE H H 28 7.974 7.974 8.097 -0.123 17635 9775 1 17 . 1 1 29 29 LYS N N 29 118.820 118.820 117.687 1.133 17635 9776 1 17 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.812 0.105 17635 9777 1 17 . 1 1 29 29 LYS C C 29 173.682 173.682 176.430 -2.748 17635 9778 1 17 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.241 3.039 17635 9779 1 17 . 1 1 29 29 LYS CB C 29 31.291 31.291 32.041 -0.750 17635 9780 1 17 . 1 1 29 29 LYS H H 29 8.325 8.325 7.710 0.615 17635 9781 1 17 . 1 1 30 30 GLN N N 30 116.232 116.232 119.179 -2.947 17635 9782 1 17 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.233 -0.098 17635 9783 1 17 . 1 1 30 30 GLN C C 30 173.790 173.790 176.871 -3.081 17635 9784 1 17 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.158 0.388 17635 9785 1 17 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.591 1.307 17635 9786 1 17 . 1 1 30 30 GLN H H 30 7.518 7.518 8.064 -0.546 17635 9787 1 17 . 1 1 31 31 ILE N N 31 116.489 116.489 118.240 -1.751 17635 9788 1 17 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.840 0.399 17635 9789 1 17 . 1 1 31 31 ILE C C 31 175.599 175.599 174.960 0.639 17635 9790 1 17 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.294 -3.073 17635 9791 1 17 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.234 2.100 17635 9792 1 17 . 1 1 31 31 ILE H H 31 7.809 7.809 8.092 -0.283 17635 9793 1 17 . 1 1 32 32 GLY N N 32 107.416 107.416 105.046 2.370 17635 9794 1 17 . 1 1 32 32 GLY C C 32 180.182 180.182 172.236 7.946 17635 9795 1 17 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.306 0.688 17635 9796 1 17 . 1 1 32 32 GLY H H 32 7.344 7.344 7.582 -0.238 17635 9797 1 17 . 1 1 33 33 ILE N N 33 117.784 117.784 121.020 -3.236 17635 9798 1 17 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.475 -0.386 17635 9799 1 17 . 1 1 33 33 ILE C C 33 173.301 173.301 175.145 -1.844 17635 9800 1 17 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.602 1.039 17635 9801 1 17 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.094 -0.435 17635 9802 1 17 . 1 1 33 33 ILE H H 33 8.173 8.173 8.300 -0.127 17635 9803 1 17 . 1 1 34 34 ILE N N 34 131.781 131.781 128.847 2.934 17635 9804 1 17 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.266 -0.479 17635 9805 1 17 . 1 1 34 34 ILE C C 34 174.663 174.663 176.587 -1.924 17635 9806 1 17 . 1 1 34 34 ILE CA C 34 61.370 61.370 61.278 0.092 17635 9807 1 17 . 1 1 34 34 ILE CB C 34 37.995 37.995 37.995 -0.000 17635 9808 1 17 . 1 1 34 34 ILE H H 34 8.687 8.687 8.907 -0.220 17635 9809 1 17 . 1 1 35 35 LYS N N 35 130.372 130.372 130.093 0.279 17635 9810 1 17 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.279 -0.195 17635 9811 1 17 . 1 1 35 35 LYS C C 35 175.376 175.376 176.709 -1.333 17635 9812 1 17 . 1 1 35 35 LYS CA C 35 57.473 57.473 57.120 0.353 17635 9813 1 17 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.372 2.292 17635 9814 1 17 . 1 1 35 35 LYS H H 35 8.680 8.680 8.476 0.204 17635 9815 1 17 . 1 1 36 36 THR N N 36 118.312 118.312 120.477 -2.165 17635 9816 1 17 . 1 1 36 36 THR HA H 36 4.415 4.415 4.334 0.081 17635 9817 1 17 . 1 1 36 36 THR C C 36 176.394 176.394 174.840 1.554 17635 9818 1 17 . 1 1 36 36 THR CA C 36 61.340 61.340 62.565 -1.225 17635 9819 1 17 . 1 1 36 36 THR CB C 36 70.809 70.809 69.430 1.379 17635 9820 1 17 . 1 1 36 36 THR H H 36 8.456 8.456 8.565 -0.109 17635 9821 1 17 . 1 1 37 37 ASN N N 37 124.092 124.092 121.273 2.819 17635 9822 1 17 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.773 -0.243 17635 9823 1 17 . 1 1 37 37 ASN C C 37 174.235 174.235 175.453 -1.218 17635 9824 1 17 . 1 1 37 37 ASN CA C 37 53.064 53.064 52.370 0.694 17635 9825 1 17 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.464 -0.537 17635 9826 1 17 . 1 1 37 37 ASN H H 37 8.794 8.794 8.935 -0.141 17635 9827 1 17 . 1 1 38 38 LYS N N 38 127.969 127.969 121.213 6.756 17635 9828 1 17 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.224 -0.220 17635 9829 1 17 . 1 1 38 38 LYS C C 38 172.702 172.702 176.516 -3.814 17635 9830 1 17 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.572 -0.114 17635 9831 1 17 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.073 0.094 17635 9832 1 17 . 1 1 38 38 LYS H H 38 8.962 8.962 8.603 0.359 17635 9833 1 17 . 1 1 39 39 LYS N N 39 117.413 117.413 117.817 -0.404 17635 9834 1 17 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.327 -0.069 17635 9835 1 17 . 1 1 39 39 LYS C C 39 172.261 172.261 176.999 -4.738 17635 9836 1 17 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.629 0.690 17635 9837 1 17 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.587 0.210 17635 9838 1 17 . 1 1 39 39 LYS H H 39 8.314 8.314 8.065 0.249 17635 9839 1 17 . 1 1 40 40 THR N N 40 105.547 105.547 109.960 -4.413 17635 9840 1 17 . 1 1 40 40 THR HA H 40 4.465 4.465 4.522 -0.057 17635 9841 1 17 . 1 1 40 40 THR C C 40 174.021 174.021 175.578 -1.557 17635 9842 1 17 . 1 1 40 40 THR CA C 40 61.260 61.260 62.254 -0.994 17635 9843 1 17 . 1 1 40 40 THR CB C 40 70.997 70.997 70.466 0.531 17635 9844 1 17 . 1 1 40 40 THR H H 40 7.422 7.422 7.714 -0.292 17635 9845 1 17 . 1 1 41 41 GLY N N 41 111.631 111.631 111.496 0.135 17635 9846 1 17 . 1 1 41 41 GLY C C 41 176.727 176.727 173.964 2.763 17635 9847 1 17 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.573 0.157 17635 9848 1 17 . 1 1 41 41 GLY H H 41 8.644 8.644 8.217 0.427 17635 9849 1 17 . 1 1 42 42 GLN N N 42 118.894 118.894 119.736 -0.842 17635 9850 1 17 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.897 -0.228 17635 9851 1 17 . 1 1 42 42 GLN C C 42 177.178 177.178 173.399 3.779 17635 9852 1 17 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.752 0.829 17635 9853 1 17 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.896 -0.666 17635 9854 1 17 . 1 1 42 42 GLN H H 42 7.662 7.662 8.631 -0.969 17635 9855 1 17 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.509 0.086 17635 9856 1 17 . 1 1 43 43 PRO C C 43 172.629 172.629 176.272 -3.643 17635 9857 1 17 . 1 1 43 43 PRO CA C 43 62.822 62.822 64.291 -1.469 17635 9858 1 17 . 1 1 43 43 PRO CB C 43 32.696 32.696 31.904 0.792 17635 9859 1 17 . 1 1 44 44 MET N N 44 124.162 124.162 121.924 2.238 17635 9860 1 17 . 1 1 44 44 MET HA H 44 4.432 4.432 4.532 -0.100 17635 9861 1 17 . 1 1 44 44 MET C C 44 176.474 176.474 175.267 1.207 17635 9862 1 17 . 1 1 44 44 MET CA C 44 55.419 55.419 55.256 0.163 17635 9863 1 17 . 1 1 44 44 MET CB C 44 30.555 30.555 34.286 -3.731 17635 9864 1 17 . 1 1 44 44 MET H H 44 8.874 8.874 8.525 0.349 17635 9865 1 17 . 1 1 45 45 ILE N N 45 126.237 126.237 123.649 2.588 17635 9866 1 17 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.266 0.536 17635 9867 1 17 . 1 1 45 45 ILE C C 45 176.415 176.415 174.113 2.302 17635 9868 1 17 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.240 -1.024 17635 9869 1 17 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.386 -0.160 17635 9870 1 17 . 1 1 45 45 ILE H H 45 7.730 7.730 8.372 -0.642 17635 9871 1 17 . 1 1 46 46 ASN N N 46 124.735 124.735 124.321 0.414 17635 9872 1 17 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.010 -0.069 17635 9873 1 17 . 1 1 46 46 ASN C C 46 176.836 176.836 173.618 3.218 17635 9874 1 17 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.169 -0.607 17635 9875 1 17 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.606 -0.136 17635 9876 1 17 . 1 1 46 46 ASN H H 46 8.384 8.384 8.532 -0.148 17635 9877 1 17 . 1 1 47 47 LEU N N 47 122.487 122.487 121.796 0.691 17635 9878 1 17 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.649 0.066 17635 9879 1 17 . 1 1 47 47 LEU C C 47 174.190 174.190 176.406 -2.216 17635 9880 1 17 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.093 -0.761 17635 9881 1 17 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.624 -2.347 17635 9882 1 17 . 1 1 47 47 LEU H H 47 8.594 8.594 8.520 0.074 17635 9883 1 17 . 1 1 48 48 TYR N N 48 121.842 121.842 123.300 -1.458 17635 9884 1 17 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.816 -0.049 17635 9885 1 17 . 1 1 48 48 TYR C C 48 173.649 173.649 175.285 -1.636 17635 9886 1 17 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.666 1.228 17635 9887 1 17 . 1 1 48 48 TYR CB C 48 39.199 39.199 37.869 1.330 17635 9888 1 17 . 1 1 48 48 TYR H H 48 7.666 7.666 8.673 -1.007 17635 9889 1 17 . 1 1 49 49 THR N N 49 116.554 116.554 114.134 2.420 17635 9890 1 17 . 1 1 49 49 THR HA H 49 4.806 4.806 4.439 0.367 17635 9891 1 17 . 1 1 49 49 THR C C 49 176.654 176.654 174.181 2.473 17635 9892 1 17 . 1 1 49 49 THR CA C 49 60.693 60.693 59.679 1.014 17635 9893 1 17 . 1 1 49 49 THR CB C 49 71.437 71.437 70.165 1.272 17635 9894 1 17 . 1 1 49 49 THR H H 49 8.965 8.965 7.983 0.982 17635 9895 1 17 . 1 1 50 50 ASP N N 50 123.826 123.826 121.902 1.924 17635 9896 1 17 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.732 -0.108 17635 9897 1 17 . 1 1 50 50 ASP C C 50 173.380 173.380 176.114 -2.734 17635 9898 1 17 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.112 -0.024 17635 9899 1 17 . 1 1 50 50 ASP CB C 50 42.867 42.867 40.371 2.496 17635 9900 1 17 . 1 1 50 50 ASP H H 50 8.939 8.939 8.526 0.413 17635 9901 1 17 . 1 1 51 51 ARG N N 51 127.794 127.794 126.601 1.193 17635 9902 1 17 . 1 1 51 51 ARG HA H 51 4.045 4.045 3.872 0.173 17635 9903 1 17 . 1 1 51 51 ARG C C 51 173.101 173.101 175.458 -2.357 17635 9904 1 17 . 1 1 51 51 ARG CA C 51 58.562 58.562 58.463 0.099 17635 9905 1 17 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.386 0.781 17635 9906 1 17 . 1 1 51 51 ARG H H 51 8.958 8.958 8.616 0.342 17635 9907 1 17 . 1 1 52 52 GLU N N 52 117.542 117.542 117.318 0.224 17635 9908 1 17 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.345 -0.067 17635 9909 1 17 . 1 1 52 52 GLU C C 52 172.201 172.201 175.984 -3.783 17635 9910 1 17 . 1 1 52 52 GLU CA C 52 58.524 58.524 56.528 1.996 17635 9911 1 17 . 1 1 52 52 GLU CB C 52 30.278 30.278 30.278 0.000 17635 9912 1 17 . 1 1 52 52 GLU H H 52 8.561 8.561 8.382 0.179 17635 9913 1 17 . 1 1 53 53 THR N N 53 107.065 107.065 114.604 -7.539 17635 9914 1 17 . 1 1 53 53 THR HA H 53 4.436 4.436 4.461 -0.025 17635 9915 1 17 . 1 1 53 53 THR C C 53 173.851 173.851 175.195 -1.344 17635 9916 1 17 . 1 1 53 53 THR CA C 53 61.944 61.944 63.205 -1.261 17635 9917 1 17 . 1 1 53 53 THR CB C 53 71.197 71.197 70.035 1.161 17635 9918 1 17 . 1 1 53 53 THR H H 53 8.087 8.087 7.961 0.126 17635 9919 1 17 . 1 1 54 54 GLY N N 54 111.295 111.295 110.504 0.791 17635 9920 1 17 . 1 1 54 54 GLY C C 54 176.747 176.747 173.652 3.095 17635 9921 1 17 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.120 0.583 17635 9922 1 17 . 1 1 54 54 GLY H H 54 8.423 8.423 8.195 0.228 17635 9923 1 17 . 1 1 55 55 LYS N N 55 119.673 119.673 119.920 -0.247 17635 9924 1 17 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.424 -0.071 17635 9925 1 17 . 1 1 55 55 LYS C C 55 173.854 173.854 175.649 -1.795 17635 9926 1 17 . 1 1 55 55 LYS CA C 55 55.842 55.842 55.803 0.039 17635 9927 1 17 . 1 1 55 55 LYS CB C 55 33.821 33.821 34.332 -0.511 17635 9928 1 17 . 1 1 55 55 LYS H H 55 7.767 7.767 8.163 -0.396 17635 9929 1 17 . 1 1 56 56 LEU N N 56 122.426 122.426 117.573 4.853 17635 9930 1 17 . 1 1 56 56 LEU HA H 56 4.356 4.356 3.993 0.363 17635 9931 1 17 . 1 1 56 56 LEU C C 56 172.534 172.534 176.729 -4.195 17635 9932 1 17 . 1 1 56 56 LEU CA C 56 56.255 56.255 56.025 0.230 17635 9933 1 17 . 1 1 56 56 LEU CB C 56 41.654 41.654 41.885 -0.231 17635 9934 1 17 . 1 1 56 56 LEU H H 56 8.768 8.768 7.837 0.931 17635 9935 1 17 . 1 1 57 57 LYS N N 57 118.264 118.264 120.501 -2.237 17635 9936 1 17 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.465 -0.177 17635 9937 1 17 . 1 1 57 57 LYS C C 57 173.648 173.648 176.921 -3.273 17635 9938 1 17 . 1 1 57 57 LYS CA C 57 56.264 56.264 55.430 0.834 17635 9939 1 17 . 1 1 57 57 LYS CB C 57 34.062 34.062 33.098 0.964 17635 9940 1 17 . 1 1 57 57 LYS H H 57 8.012 8.012 8.614 -0.602 17635 9941 1 17 . 1 1 58 58 GLY N N 58 108.514 108.514 108.607 -0.093 17635 9942 1 17 . 1 1 58 58 GLY C C 58 177.876 177.876 172.852 5.024 17635 9943 1 17 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.483 0.881 17635 9944 1 17 . 1 1 58 58 GLY H H 58 8.334 8.334 8.221 0.113 17635 9945 1 17 . 1 1 59 59 GLU N N 59 116.119 116.119 116.134 -0.015 17635 9946 1 17 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.083 0.438 17635 9947 1 17 . 1 1 59 59 GLU C C 59 173.860 173.860 173.667 0.193 17635 9948 1 17 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.156 -1.131 17635 9949 1 17 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.401 0.903 17635 9950 1 17 . 1 1 59 59 GLU H H 59 7.202 7.202 7.743 -0.541 17635 9951 1 17 . 1 1 60 60 ALA N N 60 123.607 123.607 124.695 -1.088 17635 9952 1 17 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.764 0.843 17635 9953 1 17 . 1 1 60 60 ALA C C 60 173.923 173.923 174.852 -0.929 17635 9954 1 17 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.569 -0.626 17635 9955 1 17 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.188 0.871 17635 9956 1 17 . 1 1 60 60 ALA H H 60 8.930 8.930 9.172 -0.242 17635 9957 1 17 . 1 1 61 61 THR N N 61 108.384 108.384 113.768 -5.384 17635 9958 1 17 . 1 1 61 61 THR HA H 61 5.743 5.743 4.285 1.458 17635 9959 1 17 . 1 1 61 61 THR C C 61 176.172 176.172 173.383 2.789 17635 9960 1 17 . 1 1 61 61 THR CA C 61 59.625 59.625 59.696 -0.071 17635 9961 1 17 . 1 1 61 61 THR CB C 61 71.224 71.224 69.454 1.770 17635 9962 1 17 . 1 1 61 61 THR H H 61 8.452 8.452 8.461 -0.009 17635 9963 1 17 . 1 1 62 62 VAL N N 62 120.200 120.200 125.135 -4.935 17635 9964 1 17 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.010 0.234 17635 9965 1 17 . 1 1 62 62 VAL C C 62 175.994 175.994 174.492 1.502 17635 9966 1 17 . 1 1 62 62 VAL CA C 62 61.426 61.426 60.668 0.758 17635 9967 1 17 . 1 1 62 62 VAL CB C 62 34.685 34.685 33.771 0.914 17635 9968 1 17 . 1 1 62 62 VAL H H 62 8.071 8.071 8.109 -0.038 17635 9969 1 17 . 1 1 63 63 SER N N 63 121.689 121.689 122.002 -0.313 17635 9970 1 17 . 1 1 63 63 SER HA H 63 5.261 5.261 4.762 0.499 17635 9971 1 17 . 1 1 63 63 SER C C 63 177.943 177.943 173.498 4.445 17635 9972 1 17 . 1 1 63 63 SER CA C 63 57.662 57.662 56.811 0.851 17635 9973 1 17 . 1 1 63 63 SER CB C 63 64.427 64.427 63.949 0.478 17635 9974 1 17 . 1 1 63 63 SER H H 63 7.695 7.695 8.201 -0.506 17635 9975 1 17 . 1 1 64 64 PHE N N 64 122.640 122.640 124.579 -1.939 17635 9976 1 17 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.841 0.013 17635 9977 1 17 . 1 1 64 64 PHE C C 64 174.605 174.605 176.090 -1.485 17635 9978 1 17 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.801 0.403 17635 9979 1 17 . 1 1 64 64 PHE CB C 64 41.976 41.976 41.403 0.573 17635 9980 1 17 . 1 1 64 64 PHE H H 64 9.025 9.025 8.110 0.915 17635 9981 1 17 . 1 1 65 65 ASP N N 65 119.943 119.943 120.784 -0.841 17635 9982 1 17 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.638 -0.203 17635 9983 1 17 . 1 1 65 65 ASP C C 65 174.396 174.396 175.981 -1.585 17635 9984 1 17 . 1 1 65 65 ASP CA C 65 57.442 57.442 56.137 1.305 17635 9985 1 17 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.180 -0.146 17635 9986 1 17 . 1 1 65 65 ASP H H 65 8.512 8.512 9.174 -0.662 17635 9987 1 17 . 1 1 66 66 ASP N N 66 116.125 116.125 119.387 -3.262 17635 9988 1 17 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.110 0.289 17635 9989 1 17 . 1 1 66 66 ASP C C 66 175.936 175.936 174.869 1.067 17635 9990 1 17 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.599 -0.806 17635 9991 1 17 . 1 1 66 66 ASP CB C 66 42.919 42.919 43.455 -0.536 17635 9992 1 17 . 1 1 66 66 ASP H H 66 8.323 8.323 8.047 0.276 17635 9993 1 17 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.398 0.052 17635 9994 1 17 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.676 0.248 17635 9995 1 17 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.272 -0.442 17635 9996 1 17 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.305 0.114 17635 9997 1 17 . 1 1 68 68 PRO C C 68 171.345 171.345 179.037 -7.692 17635 9998 1 17 . 1 1 68 68 PRO CA C 68 66.235 66.235 65.962 0.273 17635 9999 1 17 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.968 0.029 17635 10000 1 17 . 1 1 69 69 SER N N 69 114.544 114.544 114.716 -0.172 17635 10001 1 17 . 1 1 69 69 SER HA H 69 4.036 4.036 3.831 0.205 17635 10002 1 17 . 1 1 69 69 SER C C 69 176.535 176.535 176.151 0.384 17635 10003 1 17 . 1 1 69 69 SER CA C 69 61.837 61.837 61.606 0.231 17635 10004 1 17 . 1 1 69 69 SER CB C 69 62.773 62.773 62.199 0.574 17635 10005 1 17 . 1 1 69 69 SER H H 69 8.004 8.004 8.349 -0.345 17635 10006 1 17 . 1 1 70 70 ALA N N 70 122.649 122.649 124.410 -1.761 17635 10007 1 17 . 1 1 70 70 ALA HA H 70 3.593 3.593 4.258 -0.665 17635 10008 1 17 . 1 1 70 70 ALA C C 70 172.686 172.686 179.541 -6.855 17635 10009 1 17 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.611 -0.575 17635 10010 1 17 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.331 -0.467 17635 10011 1 17 . 1 1 70 70 ALA H H 70 7.383 7.383 7.777 -0.394 17635 10012 1 17 . 1 1 71 71 LYS N N 71 116.308 116.308 119.052 -2.744 17635 10013 1 17 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.441 0.334 17635 10014 1 17 . 1 1 71 71 LYS C C 71 172.333 172.333 178.615 -6.282 17635 10015 1 17 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.186 0.816 17635 10016 1 17 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.167 0.275 17635 10017 1 17 . 1 1 71 71 LYS H H 71 7.159 7.159 7.380 -0.221 17635 10018 1 17 . 1 1 72 72 ALA N N 72 119.806 119.806 120.698 -0.892 17635 10019 1 17 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.023 0.143 17635 10020 1 17 . 1 1 72 72 ALA C C 72 170.530 170.530 179.797 -9.267 17635 10021 1 17 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.921 -0.206 17635 10022 1 17 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.021 -0.201 17635 10023 1 17 . 1 1 72 72 ALA H H 72 7.924 7.924 8.377 -0.453 17635 10024 1 17 . 1 1 73 73 ALA N N 73 120.524 120.524 121.432 -0.908 17635 10025 1 17 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.182 0.097 17635 10026 1 17 . 1 1 73 73 ALA C C 73 171.039 171.039 179.641 -8.602 17635 10027 1 17 . 1 1 73 73 ALA CA C 73 55.379 55.379 55.099 0.280 17635 10028 1 17 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.950 0.181 17635 10029 1 17 . 1 1 73 73 ALA H H 73 8.104 8.104 7.808 0.296 17635 10030 1 17 . 1 1 74 74 ILE N N 74 119.875 119.875 118.224 1.651 17635 10031 1 17 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.819 -0.405 17635 10032 1 17 . 1 1 74 74 ILE C C 74 172.435 172.435 177.646 -5.211 17635 10033 1 17 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.493 0.351 17635 10034 1 17 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.670 1.073 17635 10035 1 17 . 1 1 74 74 ILE H H 74 7.574 7.574 7.925 -0.351 17635 10036 1 17 . 1 1 75 75 ASP N N 75 117.867 117.867 118.062 -0.195 17635 10037 1 17 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.400 -0.089 17635 10038 1 17 . 1 1 75 75 ASP C C 75 172.054 172.054 176.521 -4.467 17635 10039 1 17 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.705 0.456 17635 10040 1 17 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.712 -1.181 17635 10041 1 17 . 1 1 75 75 ASP H H 75 7.937 7.937 8.050 -0.113 17635 10042 1 17 . 1 1 76 76 TRP N N 76 117.313 117.313 120.857 -3.544 17635 10043 1 17 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.296 0.060 17635 10044 1 17 . 1 1 76 76 TRP C C 76 173.272 173.272 176.682 -3.410 17635 10045 1 17 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.910 0.552 17635 10046 1 17 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.509 1.268 17635 10047 1 17 . 1 1 76 76 TRP H H 76 8.475 8.475 7.592 0.883 17635 10048 1 17 . 1 1 77 77 PHE N N 77 112.019 112.019 116.441 -4.422 17635 10049 1 17 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.528 0.120 17635 10050 1 17 . 1 1 77 77 PHE C C 77 173.747 173.747 175.698 -1.951 17635 10051 1 17 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.061 -0.140 17635 10052 1 17 . 1 1 77 77 PHE CB C 77 40.730 40.730 39.017 1.713 17635 10053 1 17 . 1 1 77 77 PHE H H 77 8.488 8.488 7.817 0.671 17635 10054 1 17 . 1 1 78 78 ASP N N 78 118.408 118.408 118.507 -0.099 17635 10055 1 17 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.597 -0.133 17635 10056 1 17 . 1 1 78 78 ASP C C 78 172.542 172.542 176.352 -3.810 17635 10057 1 17 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.203 3.487 17635 10058 1 17 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.531 2.355 17635 10059 1 17 . 1 1 78 78 ASP H H 78 7.978 7.978 8.650 -0.672 17635 10060 1 17 . 1 1 79 79 GLY N N 79 115.548 115.548 102.619 12.929 17635 10061 1 17 . 1 1 79 79 GLY C C 79 175.680 175.680 173.502 2.178 17635 10062 1 17 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.048 1.024 17635 10063 1 17 . 1 1 79 79 GLY H H 79 8.615 8.615 8.457 0.158 17635 10064 1 17 . 1 1 80 80 LYS N N 80 120.271 120.271 118.862 1.409 17635 10065 1 17 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.485 -0.023 17635 10066 1 17 . 1 1 80 80 LYS C C 80 175.853 175.853 174.881 0.972 17635 10067 1 17 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.916 0.234 17635 10068 1 17 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.194 -1.768 17635 10069 1 17 . 1 1 80 80 LYS H H 80 8.013 8.013 7.915 0.098 17635 10070 1 17 . 1 1 81 81 GLU N N 81 115.765 115.765 119.731 -3.966 17635 10071 1 17 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.257 -0.559 17635 10072 1 17 . 1 1 81 81 GLU C C 81 173.263 173.263 175.269 -2.006 17635 10073 1 17 . 1 1 81 81 GLU CA C 81 55.924 55.924 54.986 0.938 17635 10074 1 17 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.819 0.223 17635 10075 1 17 . 1 1 81 81 GLU H H 81 8.201 8.201 8.466 -0.265 17635 10076 1 17 . 1 1 82 82 PHE N N 82 127.080 127.080 128.099 -1.019 17635 10077 1 17 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.625 -0.129 17635 10078 1 17 . 1 1 82 82 PHE C C 82 175.349 175.349 175.222 0.127 17635 10079 1 17 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.300 0.416 17635 10080 1 17 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.334 2.660 17635 10081 1 17 . 1 1 82 82 PHE H H 82 9.162 9.162 9.228 -0.066 17635 10082 1 17 . 1 1 83 83 SER N N 83 125.136 125.136 119.694 5.442 17635 10083 1 17 . 1 1 83 83 SER HA H 83 3.803 3.803 4.229 -0.426 17635 10084 1 17 . 1 1 83 83 SER C C 83 175.543 175.543 174.690 0.853 17635 10085 1 17 . 1 1 83 83 SER CA C 83 58.371 58.371 58.929 -0.558 17635 10086 1 17 . 1 1 83 83 SER CB C 83 62.519 62.519 63.150 -0.631 17635 10087 1 17 . 1 1 83 83 SER H H 83 9.193 9.193 9.009 0.184 17635 10088 1 17 . 1 1 84 84 GLY N N 84 103.581 103.581 104.491 -0.910 17635 10089 1 17 . 1 1 84 84 GLY C C 84 177.188 177.188 173.112 4.076 17635 10090 1 17 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.941 0.112 17635 10091 1 17 . 1 1 84 84 GLY H H 84 8.446 8.446 8.265 0.181 17635 10092 1 17 . 1 1 85 85 ASN N N 85 119.051 119.051 117.116 1.935 17635 10093 1 17 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.229 0.105 17635 10094 1 17 . 1 1 85 85 ASN C C 85 178.020 178.020 172.891 5.129 17635 10095 1 17 . 1 1 85 85 ASN CA C 85 50.471 50.471 50.913 -0.441 17635 10096 1 17 . 1 1 85 85 ASN CB C 85 41.117 41.117 40.288 0.829 17635 10097 1 17 . 1 1 85 85 ASN H H 85 7.762 7.762 7.529 0.233 17635 10098 1 17 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.217 -0.550 17635 10099 1 17 . 1 1 86 86 PRO C C 86 173.474 173.474 176.847 -3.373 17635 10100 1 17 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.759 -0.049 17635 10101 1 17 . 1 1 86 86 PRO CB C 86 31.870 31.870 31.607 0.263 17635 10102 1 17 . 1 1 87 87 ILE N N 87 117.270 117.270 119.736 -2.466 17635 10103 1 17 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.483 -0.337 17635 10104 1 17 . 1 1 87 87 ILE C C 87 174.495 174.495 175.255 -0.760 17635 10105 1 17 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.679 0.812 17635 10106 1 17 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.144 -0.472 17635 10107 1 17 . 1 1 87 87 ILE H H 87 8.469 8.469 8.172 0.297 17635 10108 1 17 . 1 1 88 88 LYS N N 88 122.271 122.271 120.860 1.411 17635 10109 1 17 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.756 0.436 17635 10110 1 17 . 1 1 88 88 LYS C C 88 174.393 174.393 175.165 -0.772 17635 10111 1 17 . 1 1 88 88 LYS CA C 88 54.138 54.138 56.122 -1.984 17635 10112 1 17 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.696 0.353 17635 10113 1 17 . 1 1 88 88 LYS H H 88 8.353 8.353 8.177 0.176 17635 10114 1 17 . 1 1 89 89 VAL N N 89 125.661 125.661 125.206 0.455 17635 10115 1 17 . 1 1 89 89 VAL HA H 89 4.963 4.963 5.037 -0.074 17635 10116 1 17 . 1 1 89 89 VAL C C 89 177.160 177.160 176.472 0.688 17635 10117 1 17 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.075 -0.714 17635 10118 1 17 . 1 1 89 89 VAL CB C 89 34.770 34.770 33.136 1.634 17635 10119 1 17 . 1 1 89 89 VAL H H 89 9.414 9.414 8.553 0.861 17635 10120 1 17 . 1 1 90 90 SER N N 90 119.538 119.538 122.696 -3.158 17635 10121 1 17 . 1 1 90 90 SER HA H 90 4.710 4.710 4.764 -0.054 17635 10122 1 17 . 1 1 90 90 SER C C 90 176.533 176.533 174.617 1.916 17635 10123 1 17 . 1 1 90 90 SER CA C 90 56.936 56.936 56.417 0.519 17635 10124 1 17 . 1 1 90 90 SER CB C 90 66.470 66.470 65.499 0.971 17635 10125 1 17 . 1 1 90 90 SER H H 90 8.945 8.945 8.489 0.456 17635 10126 1 17 . 1 1 91 91 PHE N N 91 120.115 120.115 123.610 -3.495 17635 10127 1 17 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.581 0.092 17635 10128 1 17 . 1 1 91 91 PHE C C 91 173.349 173.349 175.060 -1.711 17635 10129 1 17 . 1 1 91 91 PHE CA C 91 61.155 61.155 55.543 5.612 17635 10130 1 17 . 1 1 91 91 PHE CB C 91 39.503 39.503 37.407 2.096 17635 10131 1 17 . 1 1 91 91 PHE H H 91 8.919 8.919 8.603 0.316 17635 10132 1 17 . 1 1 92 92 ALA N N 92 124.386 124.386 121.703 2.683 17635 10133 1 17 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.374 -0.018 17635 10134 1 17 . 1 1 92 92 ALA C C 92 172.984 172.984 176.645 -3.661 17635 10135 1 17 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.666 -0.568 17635 10136 1 17 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.946 0.460 17635 10137 1 17 . 1 1 92 92 ALA H H 92 8.563 8.563 7.484 1.079 17635 10138 1 17 . 1 1 93 93 THR N N 93 116.073 116.073 115.250 0.823 17635 10139 1 17 . 1 1 93 93 THR HA H 93 4.208 4.208 4.204 0.004 17635 10140 1 17 . 1 1 93 93 THR C C 93 176.032 176.032 174.545 1.487 17635 10141 1 17 . 1 1 93 93 THR CA C 93 62.255 62.255 62.206 0.049 17635 10142 1 17 . 1 1 93 93 THR CB C 93 69.708 69.708 69.340 0.368 17635 10143 1 17 . 1 1 93 93 THR H H 93 8.312 8.312 8.088 0.224 17635 10144 1 17 . 1 1 94 94 ARG N N 94 124.359 124.359 121.949 2.410 17635 10145 1 17 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.486 -0.149 17635 10146 1 17 . 1 1 94 94 ARG C C 94 174.426 174.426 175.963 -1.537 17635 10147 1 17 . 1 1 94 94 ARG CA C 94 56.055 56.055 55.903 0.152 17635 10148 1 17 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.944 -0.033 17635 10149 1 17 . 1 1 94 94 ARG H H 94 8.493 8.493 8.217 0.276 17635 10150 1 17 . 1 1 95 95 ARG N N 95 122.515 122.515 119.337 3.178 17635 10151 1 17 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.514 -0.286 17635 10152 1 17 . 1 1 95 95 ARG C C 95 174.306 174.306 175.544 -1.238 17635 10153 1 17 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.747 -0.605 17635 10154 1 17 . 1 1 95 95 ARG CB C 95 30.966 30.966 31.064 -0.098 17635 10155 1 17 . 1 1 95 95 ARG H H 95 8.343 8.343 8.898 -0.555 17635 10156 1 17 . 1 1 96 96 ALA N N 96 125.127 125.127 123.779 1.348 17635 10157 1 17 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.069 0.140 17635 10158 1 17 . 1 1 96 96 ALA C C 96 173.226 173.226 176.956 -3.730 17635 10159 1 17 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.227 0.543 17635 10160 1 17 . 1 1 96 96 ALA CB C 96 19.193 19.193 18.761 0.432 17635 10161 1 17 . 1 1 96 96 ALA H H 96 8.402 8.402 7.787 0.615 17635 10162 1 17 . 1 1 97 97 ASP N N 97 118.483 118.483 120.737 -2.254 17635 10163 1 17 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.385 0.113 17635 10164 1 17 . 1 1 97 97 ASP C C 97 174.302 174.302 175.054 -0.752 17635 10165 1 17 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.916 -0.825 17635 10166 1 17 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.950 -0.043 17635 10167 1 17 . 1 1 97 97 ASP H H 97 8.206 8.206 8.520 -0.314 17635 10168 1 17 . 1 1 98 98 PHE N N 98 120.321 120.321 120.520 -0.199 17635 10169 1 17 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.028 0.462 17635 10170 1 17 . 1 1 98 98 PHE C C 98 174.878 174.878 176.287 -1.409 17635 10171 1 17 . 1 1 98 98 PHE CA C 98 58.160 58.160 60.002 -1.842 17635 10172 1 17 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.494 0.809 17635 10173 1 17 . 1 1 98 98 PHE H H 98 7.990 7.990 8.567 -0.577 17635 10174 1 17 . 1 1 99 99 ASN N N 99 120.016 120.016 116.121 3.895 17635 10175 1 17 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.405 0.204 17635 10176 1 17 . 1 1 99 99 ASN C C 99 175.348 175.348 175.992 -0.644 17635 10177 1 17 . 1 1 99 99 ASN CA C 99 53.313 53.313 55.647 -2.334 17635 10178 1 17 . 1 1 99 99 ASN CB C 99 38.727 38.727 37.872 0.855 17635 10179 1 17 . 1 1 99 99 ASN H H 99 8.336 8.336 8.905 -0.569 17635 10180 1 17 . 1 1 100 100 ARG N N 100 121.374 121.374 121.326 0.048 17635 10181 1 17 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.571 -0.298 17635 10182 1 17 . 1 1 100 100 ARG C C 100 173.627 173.627 176.506 -2.879 17635 10183 1 17 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.965 0.527 17635 10184 1 17 . 1 1 100 100 ARG CB C 100 30.519 30.519 31.616 -1.097 17635 10185 1 17 . 1 1 100 100 ARG H H 100 8.181 8.181 8.775 -0.594 17635 10186 1 17 . 1 1 101 101 GLY N N 101 109.586 109.586 107.813 1.773 17635 10187 1 17 . 1 1 101 101 GLY C C 101 175.739 175.739 174.811 0.928 17635 10188 1 17 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.659 0.721 17635 10189 1 17 . 1 1 101 101 GLY H H 101 8.413 8.413 8.100 0.313 17635 10190 1 17 . 1 1 102 102 GLY N N 102 108.692 108.692 108.579 0.113 17635 10191 1 17 . 1 1 102 102 GLY C C 102 176.286 176.286 175.278 1.008 17635 10192 1 17 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.840 0.498 17635 10193 1 17 . 1 1 102 102 GLY H H 102 8.281 8.281 8.382 -0.101 17635 10194 1 17 . 1 1 103 103 GLY N N 103 108.844 108.844 107.743 1.101 17635 10195 1 17 . 1 1 103 103 GLY C C 103 175.798 175.798 174.592 1.206 17635 10196 1 17 . 1 1 103 103 GLY CA C 103 45.346 45.346 45.060 0.286 17635 10197 1 17 . 1 1 103 103 GLY H H 103 8.364 8.364 8.502 -0.138 17635 10198 1 17 . 1 1 104 104 ASN N N 104 118.527 118.527 114.700 3.827 17635 10199 1 17 . 1 1 104 104 ASN HA H 104 4.718 4.718 5.279 -0.561 17635 10200 1 17 . 1 1 104 104 ASN C C 104 174.547 174.547 175.364 -0.817 17635 10201 1 17 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.624 -0.415 17635 10202 1 17 . 1 1 104 104 ASN CB C 104 38.879 38.879 40.788 -1.909 17635 10203 1 17 . 1 1 104 104 ASN H H 104 8.438 8.438 8.930 -0.492 17635 10204 1 17 . 1 1 105 105 GLY N N 105 109.166 109.166 107.781 1.385 17635 10205 1 17 . 1 1 105 105 GLY C C 105 176.074 176.074 173.522 2.552 17635 10206 1 17 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.939 0.663 17635 10207 1 17 . 1 1 105 105 GLY H H 105 8.477 8.477 8.224 0.253 17635 10208 1 17 . 1 1 106 106 ARG N N 106 120.341 120.341 121.426 -1.085 17635 10209 1 17 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.283 0.068 17635 10210 1 17 . 1 1 106 106 ARG C C 106 173.491 173.491 176.235 -2.744 17635 10211 1 17 . 1 1 106 106 ARG CA C 106 56.227 56.227 57.307 -1.080 17635 10212 1 17 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.398 0.231 17635 10213 1 17 . 1 1 106 106 ARG H H 106 8.244 8.244 8.150 0.094 17635 10214 1 17 . 1 1 107 107 GLY N N 107 109.856 109.856 111.587 -1.731 17635 10215 1 17 . 1 1 107 107 GLY C C 107 175.834 175.834 173.355 2.479 17635 10216 1 17 . 1 1 107 107 GLY CA C 107 45.441 45.441 45.141 0.300 17635 10217 1 17 . 1 1 107 107 GLY H H 107 8.522 8.522 8.653 -0.131 17635 10218 1 18 . 1 1 2 2 GLN N N 2 121.692 121.692 119.195 2.497 17635 10219 1 18 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.552 -0.286 17635 10220 1 18 . 1 1 2 2 GLN C C 2 175.248 175.248 175.241 0.007 17635 10221 1 18 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.418 0.578 17635 10222 1 18 . 1 1 2 2 GLN CB C 2 29.639 29.639 30.461 -0.822 17635 10223 1 18 . 1 1 2 2 GLN H H 2 8.621 8.621 8.014 0.607 17635 10224 1 18 . 1 1 3 3 ASP N N 3 121.801 121.801 120.359 1.442 17635 10225 1 18 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.670 -0.102 17635 10226 1 18 . 1 1 3 3 ASP C C 3 174.336 174.336 176.253 -1.917 17635 10227 1 18 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.226 -0.164 17635 10228 1 18 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.592 -0.521 17635 10229 1 18 . 1 1 3 3 ASP H H 3 8.436 8.436 8.651 -0.215 17635 10230 1 18 . 1 1 4 4 ASN N N 4 120.292 120.292 114.430 5.862 17635 10231 1 18 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.370 0.267 17635 10232 1 18 . 1 1 4 4 ASN C C 4 174.415 174.415 173.916 0.499 17635 10233 1 18 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.786 0.075 17635 10234 1 18 . 1 1 4 4 ASN CB C 4 38.534 38.534 37.944 0.590 17635 10235 1 18 . 1 1 4 4 ASN H H 4 8.528 8.528 8.628 -0.100 17635 10236 1 18 . 1 1 5 5 SER N N 5 117.091 117.091 112.897 4.194 17635 10237 1 18 . 1 1 5 5 SER HA H 5 4.163 4.163 4.150 0.013 17635 10238 1 18 . 1 1 5 5 SER C C 5 176.370 176.370 173.681 2.689 17635 10239 1 18 . 1 1 5 5 SER CA C 5 60.846 60.846 57.801 3.045 17635 10240 1 18 . 1 1 5 5 SER CB C 5 63.136 63.136 63.484 -0.348 17635 10241 1 18 . 1 1 5 5 SER H H 5 8.470 8.470 7.929 0.541 17635 10242 1 18 . 1 1 6 6 ASP N N 6 119.436 119.436 120.560 -1.124 17635 10243 1 18 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.761 -0.066 17635 10244 1 18 . 1 1 6 6 ASP C C 6 175.048 175.048 175.470 -0.422 17635 10245 1 18 . 1 1 6 6 ASP CA C 6 53.094 53.094 54.130 -1.036 17635 10246 1 18 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.294 0.641 17635 10247 1 18 . 1 1 6 6 ASP H H 6 8.218 8.218 8.143 0.075 17635 10248 1 18 . 1 1 7 7 ASN N N 7 119.696 119.696 117.695 2.001 17635 10249 1 18 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.857 -0.229 17635 10250 1 18 . 1 1 7 7 ASN C C 7 176.539 176.539 175.490 1.049 17635 10251 1 18 . 1 1 7 7 ASN CA C 7 53.158 53.158 51.675 1.484 17635 10252 1 18 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.100 0.759 17635 10253 1 18 . 1 1 7 7 ASN H H 7 7.734 7.734 7.823 -0.089 17635 10254 1 18 . 1 1 8 8 ASN N N 8 119.436 119.436 117.948 1.488 17635 10255 1 18 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.542 0.326 17635 10256 1 18 . 1 1 8 8 ASN C C 8 175.327 175.327 174.878 0.449 17635 10257 1 18 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.514 -1.310 17635 10258 1 18 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.447 0.048 17635 10259 1 18 . 1 1 8 8 ASN H H 8 8.350 8.350 8.448 -0.098 17635 10260 1 18 . 1 1 9 9 THR N N 9 118.650 118.650 113.782 4.868 17635 10261 1 18 . 1 1 9 9 THR HA H 9 5.557 5.557 4.660 0.897 17635 10262 1 18 . 1 1 9 9 THR C C 9 177.117 177.117 174.083 3.034 17635 10263 1 18 . 1 1 9 9 THR CA C 9 62.314 62.314 62.150 0.164 17635 10264 1 18 . 1 1 9 9 THR CB C 9 71.225 71.225 69.991 1.234 17635 10265 1 18 . 1 1 9 9 THR H H 9 8.428 8.428 7.258 1.170 17635 10266 1 18 . 1 1 10 10 ILE N N 10 118.556 118.556 121.315 -2.759 17635 10267 1 18 . 1 1 10 10 ILE HA H 10 5.165 5.165 5.353 -0.188 17635 10268 1 18 . 1 1 10 10 ILE C C 10 176.837 176.837 173.950 2.887 17635 10269 1 18 . 1 1 10 10 ILE CA C 10 59.298 59.298 57.940 1.358 17635 10270 1 18 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.822 -1.942 17635 10271 1 18 . 1 1 10 10 ILE H H 10 8.770 8.770 8.678 0.092 17635 10272 1 18 . 1 1 11 11 PHE N N 11 123.798 123.798 118.692 5.106 17635 10273 1 18 . 1 1 11 11 PHE HA H 11 5.420 5.420 5.283 0.137 17635 10274 1 18 . 1 1 11 11 PHE C C 11 177.066 177.066 174.115 2.951 17635 10275 1 18 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.462 -0.100 17635 10276 1 18 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.116 0.752 17635 10277 1 18 . 1 1 11 11 PHE H H 11 9.548 9.548 8.256 1.292 17635 10278 1 18 . 1 1 12 12 VAL N N 12 127.993 127.993 124.168 3.825 17635 10279 1 18 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.459 0.499 17635 10280 1 18 . 1 1 12 12 VAL C C 12 176.965 176.965 175.068 1.897 17635 10281 1 18 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.376 -1.540 17635 10282 1 18 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.138 2.662 17635 10283 1 18 . 1 1 12 12 VAL H H 12 8.940 8.940 9.257 -0.317 17635 10284 1 18 . 1 1 13 13 GLN N N 13 122.289 122.289 127.417 -5.128 17635 10285 1 18 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.722 0.057 17635 10286 1 18 . 1 1 13 13 GLN C C 13 175.631 175.631 175.835 -0.204 17635 10287 1 18 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.903 -0.793 17635 10288 1 18 . 1 1 13 13 GLN CB C 13 34.132 34.132 31.709 2.423 17635 10289 1 18 . 1 1 13 13 GLN H H 13 8.747 8.747 8.114 0.633 17635 10290 1 18 . 1 1 14 14 GLY N N 14 109.212 109.212 113.107 -3.895 17635 10291 1 18 . 1 1 14 14 GLY C C 14 175.436 175.436 173.508 1.928 17635 10292 1 18 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.352 0.078 17635 10293 1 18 . 1 1 14 14 GLY H H 14 8.236 8.236 8.432 -0.196 17635 10294 1 18 . 1 1 15 15 LEU N N 15 117.824 117.824 119.889 -2.065 17635 10295 1 18 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.361 -0.655 17635 10296 1 18 . 1 1 15 15 LEU C C 15 174.111 174.111 177.615 -3.504 17635 10297 1 18 . 1 1 15 15 LEU CA C 15 55.718 55.718 56.187 -0.469 17635 10298 1 18 . 1 1 15 15 LEU CB C 15 42.433 42.433 42.034 0.399 17635 10299 1 18 . 1 1 15 15 LEU H H 15 8.442 8.442 7.923 0.519 17635 10300 1 18 . 1 1 16 16 GLY N N 16 105.063 105.063 105.567 -0.504 17635 10301 1 18 . 1 1 16 16 GLY C C 16 177.771 177.771 173.994 3.777 17635 10302 1 18 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.836 -0.742 17635 10303 1 18 . 1 1 16 16 GLY H H 16 8.006 8.006 7.980 0.026 17635 10304 1 18 . 1 1 17 17 GLU N N 17 113.781 113.781 120.735 -6.954 17635 10305 1 18 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.449 -0.330 17635 10306 1 18 . 1 1 17 17 GLU C C 17 173.937 173.937 175.378 -1.441 17635 10307 1 18 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.358 0.923 17635 10308 1 18 . 1 1 17 17 GLU CB C 17 30.436 30.436 30.279 0.157 17635 10309 1 18 . 1 1 17 17 GLU H H 17 8.134 8.134 8.495 -0.361 17635 10310 1 18 . 1 1 18 18 ASN N N 18 116.660 116.660 117.044 -0.384 17635 10311 1 18 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.579 0.362 17635 10312 1 18 . 1 1 18 18 ASN C C 18 175.900 175.900 174.080 1.820 17635 10313 1 18 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.572 -0.094 17635 10314 1 18 . 1 1 18 18 ASN CB C 18 38.485 38.485 38.725 -0.240 17635 10315 1 18 . 1 1 18 18 ASN H H 18 8.407 8.407 7.906 0.501 17635 10316 1 18 . 1 1 19 19 VAL N N 19 118.323 118.323 122.566 -4.243 17635 10317 1 18 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.850 0.302 17635 10318 1 18 . 1 1 19 19 VAL C C 19 177.655 177.655 175.174 2.481 17635 10319 1 18 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.660 -1.783 17635 10320 1 18 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.398 2.115 17635 10321 1 18 . 1 1 19 19 VAL H H 19 6.855 6.855 7.706 -0.851 17635 10322 1 18 . 1 1 20 20 THR N N 20 111.636 111.636 120.456 -8.820 17635 10323 1 18 . 1 1 20 20 THR HA H 20 4.719 4.719 4.549 0.170 17635 10324 1 18 . 1 1 20 20 THR C C 20 175.266 175.266 174.998 0.268 17635 10325 1 18 . 1 1 20 20 THR CA C 20 58.698 58.698 60.293 -1.595 17635 10326 1 18 . 1 1 20 20 THR CB C 20 72.948 72.948 71.764 1.184 17635 10327 1 18 . 1 1 20 20 THR H H 20 7.328 7.328 7.901 -0.573 17635 10328 1 18 . 1 1 21 21 ILE N N 21 122.147 122.147 124.210 -2.063 17635 10329 1 18 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.922 -0.404 17635 10330 1 18 . 1 1 21 21 ILE C C 21 173.198 173.198 177.752 -4.554 17635 10331 1 18 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.001 1.770 17635 10332 1 18 . 1 1 21 21 ILE CB C 21 37.583 37.583 36.796 0.787 17635 10333 1 18 . 1 1 21 21 ILE H H 21 9.074 9.074 8.560 0.514 17635 10334 1 18 . 1 1 22 22 GLU N N 22 118.154 118.154 120.524 -2.370 17635 10335 1 18 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.122 -0.136 17635 10336 1 18 . 1 1 22 22 GLU C C 22 171.799 171.799 179.101 -7.302 17635 10337 1 18 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.612 1.001 17635 10338 1 18 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.468 0.323 17635 10339 1 18 . 1 1 22 22 GLU H H 22 8.814 8.814 8.739 0.075 17635 10340 1 18 . 1 1 23 23 SER N N 23 115.921 115.921 114.240 1.681 17635 10341 1 18 . 1 1 23 23 SER HA H 23 4.384 4.384 4.302 0.082 17635 10342 1 18 . 1 1 23 23 SER C C 23 172.447 172.447 176.749 -4.302 17635 10343 1 18 . 1 1 23 23 SER CA C 23 61.239 61.239 61.378 -0.139 17635 10344 1 18 . 1 1 23 23 SER CB C 23 62.838 62.838 62.808 0.030 17635 10345 1 18 . 1 1 23 23 SER H H 23 8.236 8.236 8.239 -0.003 17635 10346 1 18 . 1 1 24 24 VAL N N 24 124.867 124.867 121.955 2.912 17635 10347 1 18 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.138 -0.390 17635 10348 1 18 . 1 1 24 24 VAL C C 24 173.016 173.016 177.806 -4.790 17635 10349 1 18 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.337 0.917 17635 10350 1 18 . 1 1 24 24 VAL CB C 24 31.533 31.533 32.065 -0.532 17635 10351 1 18 . 1 1 24 24 VAL H H 24 7.973 7.973 8.008 -0.035 17635 10352 1 18 . 1 1 25 25 ALA N N 25 123.198 123.198 121.740 1.458 17635 10353 1 18 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.146 -0.247 17635 10354 1 18 . 1 1 25 25 ALA C C 25 171.061 171.061 178.732 -7.671 17635 10355 1 18 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.910 0.785 17635 10356 1 18 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.469 -0.731 17635 10357 1 18 . 1 1 25 25 ALA H H 25 8.695 8.695 8.501 0.194 17635 10358 1 18 . 1 1 26 26 ASP N N 26 115.503 115.503 117.974 -2.471 17635 10359 1 18 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.572 -0.249 17635 10360 1 18 . 1 1 26 26 ASP C C 26 173.108 173.108 178.613 -5.505 17635 10361 1 18 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.894 0.429 17635 10362 1 18 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.344 -0.293 17635 10363 1 18 . 1 1 26 26 ASP H H 26 8.312 8.312 8.189 0.123 17635 10364 1 18 . 1 1 27 27 TYR N N 27 119.224 119.224 119.723 -0.499 17635 10365 1 18 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.476 -0.276 17635 10366 1 18 . 1 1 27 27 TYR C C 27 172.908 172.908 176.058 -3.150 17635 10367 1 18 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.506 1.510 17635 10368 1 18 . 1 1 27 27 TYR CB C 27 39.932 39.932 38.682 1.250 17635 10369 1 18 . 1 1 27 27 TYR H H 27 7.533 7.533 7.864 -0.331 17635 10370 1 18 . 1 1 28 28 PHE N N 28 112.595 112.595 117.561 -4.966 17635 10371 1 18 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.022 0.308 17635 10372 1 18 . 1 1 28 28 PHE C C 28 173.082 173.082 174.889 -1.807 17635 10373 1 18 . 1 1 28 28 PHE CA C 28 61.784 61.784 56.295 5.489 17635 10374 1 18 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.611 1.392 17635 10375 1 18 . 1 1 28 28 PHE H H 28 7.974 7.974 7.595 0.379 17635 10376 1 18 . 1 1 29 29 LYS N N 29 118.820 118.820 118.199 0.621 17635 10377 1 18 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.741 0.176 17635 10378 1 18 . 1 1 29 29 LYS C C 29 173.682 173.682 176.423 -2.741 17635 10379 1 18 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.096 2.184 17635 10380 1 18 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.486 -0.195 17635 10381 1 18 . 1 1 29 29 LYS H H 29 8.325 8.325 7.369 0.956 17635 10382 1 18 . 1 1 30 30 GLN N N 30 116.232 116.232 116.865 -0.633 17635 10383 1 18 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.204 -0.069 17635 10384 1 18 . 1 1 30 30 GLN C C 30 173.790 173.790 176.748 -2.958 17635 10385 1 18 . 1 1 30 30 GLN CA C 30 57.546 57.546 56.399 1.147 17635 10386 1 18 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.426 1.472 17635 10387 1 18 . 1 1 30 30 GLN H H 30 7.518 7.518 8.121 -0.603 17635 10388 1 18 . 1 1 31 31 ILE N N 31 116.489 116.489 120.240 -3.751 17635 10389 1 18 . 1 1 31 31 ILE HA H 31 4.239 4.239 3.925 0.314 17635 10390 1 18 . 1 1 31 31 ILE C C 31 175.599 175.599 175.206 0.393 17635 10391 1 18 . 1 1 31 31 ILE CA C 31 58.221 58.221 60.663 -2.442 17635 10392 1 18 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.579 1.755 17635 10393 1 18 . 1 1 31 31 ILE H H 31 7.809 7.809 7.800 0.009 17635 10394 1 18 . 1 1 32 32 GLY N N 32 107.416 107.416 105.091 2.325 17635 10395 1 18 . 1 1 32 32 GLY C C 32 180.182 180.182 171.927 8.255 17635 10396 1 18 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.388 0.606 17635 10397 1 18 . 1 1 32 32 GLY H H 32 7.344 7.344 7.131 0.213 17635 10398 1 18 . 1 1 33 33 ILE N N 33 117.784 117.784 121.285 -3.501 17635 10399 1 18 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.407 -0.318 17635 10400 1 18 . 1 1 33 33 ILE C C 33 173.301 173.301 175.492 -2.191 17635 10401 1 18 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.848 0.793 17635 10402 1 18 . 1 1 33 33 ILE CB C 33 38.659 38.659 38.805 -0.146 17635 10403 1 18 . 1 1 33 33 ILE H H 33 8.173 8.173 8.190 -0.017 17635 10404 1 18 . 1 1 34 34 ILE N N 34 131.781 131.781 127.061 4.720 17635 10405 1 18 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.521 -0.734 17635 10406 1 18 . 1 1 34 34 ILE C C 34 174.663 174.663 175.604 -0.941 17635 10407 1 18 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.442 0.928 17635 10408 1 18 . 1 1 34 34 ILE CB C 34 37.995 37.995 39.091 -1.096 17635 10409 1 18 . 1 1 34 34 ILE H H 34 8.687 8.687 8.613 0.074 17635 10410 1 18 . 1 1 35 35 LYS N N 35 130.372 130.372 128.856 1.516 17635 10411 1 18 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.112 -0.028 17635 10412 1 18 . 1 1 35 35 LYS C C 35 175.376 175.376 176.040 -0.664 17635 10413 1 18 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.871 0.602 17635 10414 1 18 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.973 1.691 17635 10415 1 18 . 1 1 35 35 LYS H H 35 8.680 8.680 8.812 -0.132 17635 10416 1 18 . 1 1 36 36 THR N N 36 118.312 118.312 120.995 -2.683 17635 10417 1 18 . 1 1 36 36 THR HA H 36 4.415 4.415 4.371 0.044 17635 10418 1 18 . 1 1 36 36 THR C C 36 176.394 176.394 175.044 1.350 17635 10419 1 18 . 1 1 36 36 THR CA C 36 61.340 61.340 61.884 -0.544 17635 10420 1 18 . 1 1 36 36 THR CB C 36 70.809 70.809 69.828 0.981 17635 10421 1 18 . 1 1 36 36 THR H H 36 8.456 8.456 7.946 0.510 17635 10422 1 18 . 1 1 37 37 ASN N N 37 124.092 124.092 120.957 3.135 17635 10423 1 18 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.896 -0.366 17635 10424 1 18 . 1 1 37 37 ASN C C 37 174.235 174.235 175.425 -1.190 17635 10425 1 18 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.649 1.415 17635 10426 1 18 . 1 1 37 37 ASN CB C 37 38.927 38.927 40.048 -1.121 17635 10427 1 18 . 1 1 37 37 ASN H H 37 8.794 8.794 9.079 -0.285 17635 10428 1 18 . 1 1 38 38 LYS N N 38 127.969 127.969 118.743 9.226 17635 10429 1 18 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.352 -0.348 17635 10430 1 18 . 1 1 38 38 LYS C C 38 172.702 172.702 176.910 -4.208 17635 10431 1 18 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.325 0.133 17635 10432 1 18 . 1 1 38 38 LYS CB C 38 32.167 32.167 32.310 -0.143 17635 10433 1 18 . 1 1 38 38 LYS H H 38 8.962 8.962 8.389 0.573 17635 10434 1 18 . 1 1 39 39 LYS N N 39 117.413 117.413 119.733 -2.320 17635 10435 1 18 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.367 -0.109 17635 10436 1 18 . 1 1 39 39 LYS C C 39 172.261 172.261 177.462 -5.201 17635 10437 1 18 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.005 0.314 17635 10438 1 18 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.628 0.169 17635 10439 1 18 . 1 1 39 39 LYS H H 39 8.314 8.314 8.047 0.267 17635 10440 1 18 . 1 1 40 40 THR N N 40 105.547 105.547 108.963 -3.416 17635 10441 1 18 . 1 1 40 40 THR HA H 40 4.465 4.465 4.444 0.021 17635 10442 1 18 . 1 1 40 40 THR C C 40 174.021 174.021 175.916 -1.895 17635 10443 1 18 . 1 1 40 40 THR CA C 40 61.260 61.260 61.879 -0.619 17635 10444 1 18 . 1 1 40 40 THR CB C 40 70.997 70.997 70.124 0.873 17635 10445 1 18 . 1 1 40 40 THR H H 40 7.422 7.422 8.004 -0.582 17635 10446 1 18 . 1 1 41 41 GLY N N 41 111.631 111.631 111.004 0.627 17635 10447 1 18 . 1 1 41 41 GLY C C 41 176.727 176.727 173.664 3.063 17635 10448 1 18 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.508 0.222 17635 10449 1 18 . 1 1 41 41 GLY H H 41 8.644 8.644 8.423 0.221 17635 10450 1 18 . 1 1 42 42 GLN N N 42 118.894 118.894 119.129 -0.235 17635 10451 1 18 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.830 -0.161 17635 10452 1 18 . 1 1 42 42 GLN C C 42 177.178 177.178 173.644 3.534 17635 10453 1 18 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.763 0.818 17635 10454 1 18 . 1 1 42 42 GLN CB C 42 29.230 29.230 30.394 -1.164 17635 10455 1 18 . 1 1 42 42 GLN H H 42 7.662 7.662 8.372 -0.710 17635 10456 1 18 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.300 0.295 17635 10457 1 18 . 1 1 43 43 PRO C C 43 172.629 172.629 176.169 -3.540 17635 10458 1 18 . 1 1 43 43 PRO CA C 43 62.822 62.822 64.057 -1.235 17635 10459 1 18 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.104 0.592 17635 10460 1 18 . 1 1 44 44 MET N N 44 124.162 124.162 119.929 4.233 17635 10461 1 18 . 1 1 44 44 MET HA H 44 4.432 4.432 4.680 -0.248 17635 10462 1 18 . 1 1 44 44 MET C C 44 176.474 176.474 174.322 2.152 17635 10463 1 18 . 1 1 44 44 MET CA C 44 55.419 55.419 54.754 0.665 17635 10464 1 18 . 1 1 44 44 MET CB C 44 30.555 30.555 36.289 -5.734 17635 10465 1 18 . 1 1 44 44 MET H H 44 8.874 8.874 8.624 0.250 17635 10466 1 18 . 1 1 45 45 ILE N N 45 126.237 126.237 121.984 4.253 17635 10467 1 18 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.571 0.231 17635 10468 1 18 . 1 1 45 45 ILE C C 45 176.415 176.415 174.469 1.946 17635 10469 1 18 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.277 -1.061 17635 10470 1 18 . 1 1 45 45 ILE CB C 45 42.226 42.226 41.890 0.336 17635 10471 1 18 . 1 1 45 45 ILE H H 45 7.730 7.730 8.421 -0.691 17635 10472 1 18 . 1 1 46 46 ASN N N 46 124.735 124.735 126.003 -1.268 17635 10473 1 18 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.958 -0.017 17635 10474 1 18 . 1 1 46 46 ASN C C 46 176.836 176.836 173.666 3.170 17635 10475 1 18 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.855 -1.294 17635 10476 1 18 . 1 1 46 46 ASN CB C 46 40.470 40.470 39.500 0.970 17635 10477 1 18 . 1 1 46 46 ASN H H 46 8.384 8.384 8.430 -0.046 17635 10478 1 18 . 1 1 47 47 LEU N N 47 122.487 122.487 124.180 -1.693 17635 10479 1 18 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.699 0.016 17635 10480 1 18 . 1 1 47 47 LEU C C 47 174.190 174.190 176.174 -1.984 17635 10481 1 18 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.671 -0.339 17635 10482 1 18 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.375 -2.098 17635 10483 1 18 . 1 1 47 47 LEU H H 47 8.594 8.594 8.261 0.333 17635 10484 1 18 . 1 1 48 48 TYR N N 48 121.842 121.842 121.979 -0.137 17635 10485 1 18 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.852 -0.085 17635 10486 1 18 . 1 1 48 48 TYR C C 48 173.649 173.649 175.277 -1.628 17635 10487 1 18 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.727 1.167 17635 10488 1 18 . 1 1 48 48 TYR CB C 48 39.199 39.199 39.834 -0.635 17635 10489 1 18 . 1 1 48 48 TYR H H 48 7.666 7.666 8.843 -1.177 17635 10490 1 18 . 1 1 49 49 THR N N 49 116.554 116.554 113.881 2.673 17635 10491 1 18 . 1 1 49 49 THR HA H 49 4.806 4.806 4.635 0.171 17635 10492 1 18 . 1 1 49 49 THR C C 49 176.654 176.654 173.392 3.262 17635 10493 1 18 . 1 1 49 49 THR CA C 49 60.693 60.693 60.132 0.561 17635 10494 1 18 . 1 1 49 49 THR CB C 49 71.437 71.437 71.652 -0.215 17635 10495 1 18 . 1 1 49 49 THR H H 49 8.965 8.965 8.602 0.363 17635 10496 1 18 . 1 1 50 50 ASP N N 50 123.826 123.826 123.724 0.102 17635 10497 1 18 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.539 0.085 17635 10498 1 18 . 1 1 50 50 ASP C C 50 173.380 173.380 177.070 -3.690 17635 10499 1 18 . 1 1 50 50 ASP CA C 50 54.088 54.088 55.364 -1.276 17635 10500 1 18 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.374 0.493 17635 10501 1 18 . 1 1 50 50 ASP H H 50 8.939 8.939 8.943 -0.004 17635 10502 1 18 . 1 1 51 51 ARG N N 51 127.794 127.794 125.580 2.214 17635 10503 1 18 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.295 -0.250 17635 10504 1 18 . 1 1 51 51 ARG C C 51 173.101 173.101 176.933 -3.832 17635 10505 1 18 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.790 1.772 17635 10506 1 18 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.390 0.777 17635 10507 1 18 . 1 1 51 51 ARG H H 51 8.958 8.958 8.687 0.271 17635 10508 1 18 . 1 1 52 52 GLU N N 52 117.542 117.542 119.730 -2.188 17635 10509 1 18 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.253 0.025 17635 10510 1 18 . 1 1 52 52 GLU C C 52 172.201 172.201 177.475 -5.274 17635 10511 1 18 . 1 1 52 52 GLU CA C 52 58.524 58.524 58.493 0.031 17635 10512 1 18 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.246 1.032 17635 10513 1 18 . 1 1 52 52 GLU H H 52 8.561 8.561 8.106 0.455 17635 10514 1 18 . 1 1 53 53 THR N N 53 107.065 107.065 110.280 -3.215 17635 10515 1 18 . 1 1 53 53 THR HA H 53 4.436 4.436 4.489 -0.053 17635 10516 1 18 . 1 1 53 53 THR C C 53 173.851 173.851 175.580 -1.729 17635 10517 1 18 . 1 1 53 53 THR CA C 53 61.944 61.944 62.115 -0.171 17635 10518 1 18 . 1 1 53 53 THR CB C 53 71.197 71.197 70.103 1.095 17635 10519 1 18 . 1 1 53 53 THR H H 53 8.087 8.087 7.958 0.129 17635 10520 1 18 . 1 1 54 54 GLY N N 54 111.295 111.295 109.267 2.028 17635 10521 1 18 . 1 1 54 54 GLY C C 54 176.747 176.747 173.684 3.063 17635 10522 1 18 . 1 1 54 54 GLY CA C 54 45.703 45.703 44.958 0.745 17635 10523 1 18 . 1 1 54 54 GLY H H 54 8.423 8.423 7.852 0.571 17635 10524 1 18 . 1 1 55 55 LYS N N 55 119.673 119.673 120.905 -1.232 17635 10525 1 18 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.198 0.155 17635 10526 1 18 . 1 1 55 55 LYS C C 55 173.854 173.854 176.732 -2.878 17635 10527 1 18 . 1 1 55 55 LYS CA C 55 55.842 55.842 55.783 0.059 17635 10528 1 18 . 1 1 55 55 LYS CB C 55 33.821 33.821 32.536 1.285 17635 10529 1 18 . 1 1 55 55 LYS H H 55 7.767 7.767 7.892 -0.125 17635 10530 1 18 . 1 1 56 56 LEU N N 56 122.426 122.426 124.204 -1.778 17635 10531 1 18 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.178 0.178 17635 10532 1 18 . 1 1 56 56 LEU C C 56 172.534 172.534 177.878 -5.344 17635 10533 1 18 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.835 1.420 17635 10534 1 18 . 1 1 56 56 LEU CB C 56 41.654 41.654 40.870 0.784 17635 10535 1 18 . 1 1 56 56 LEU H H 56 8.768 8.768 8.723 0.045 17635 10536 1 18 . 1 1 57 57 LYS N N 57 118.264 118.264 120.847 -2.583 17635 10537 1 18 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.286 0.002 17635 10538 1 18 . 1 1 57 57 LYS C C 57 173.648 173.648 177.679 -4.031 17635 10539 1 18 . 1 1 57 57 LYS CA C 57 56.264 56.264 57.274 -1.010 17635 10540 1 18 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.943 1.119 17635 10541 1 18 . 1 1 57 57 LYS H H 57 8.012 8.012 9.012 -1.000 17635 10542 1 18 . 1 1 58 58 GLY N N 58 108.514 108.514 107.258 1.256 17635 10543 1 18 . 1 1 58 58 GLY C C 58 177.876 177.876 172.696 5.180 17635 10544 1 18 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.091 1.273 17635 10545 1 18 . 1 1 58 58 GLY H H 58 8.334 8.334 8.161 0.173 17635 10546 1 18 . 1 1 59 59 GLU N N 59 116.119 116.119 116.562 -0.443 17635 10547 1 18 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.473 0.048 17635 10548 1 18 . 1 1 59 59 GLU C C 59 173.860 173.860 173.807 0.053 17635 10549 1 18 . 1 1 59 59 GLU CA C 59 53.025 53.025 54.827 -1.802 17635 10550 1 18 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.414 0.890 17635 10551 1 18 . 1 1 59 59 GLU H H 59 7.202 7.202 7.741 -0.539 17635 10552 1 18 . 1 1 60 60 ALA N N 60 123.607 123.607 123.510 0.097 17635 10553 1 18 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.187 0.420 17635 10554 1 18 . 1 1 60 60 ALA C C 60 173.923 173.923 175.097 -1.174 17635 10555 1 18 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.564 -0.621 17635 10556 1 18 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.064 0.994 17635 10557 1 18 . 1 1 60 60 ALA H H 60 8.930 8.930 9.024 -0.094 17635 10558 1 18 . 1 1 61 61 THR N N 61 108.384 108.384 112.369 -3.985 17635 10559 1 18 . 1 1 61 61 THR HA H 61 5.743 5.743 5.033 0.710 17635 10560 1 18 . 1 1 61 61 THR C C 61 176.172 176.172 173.349 2.823 17635 10561 1 18 . 1 1 61 61 THR CA C 61 59.625 59.625 60.599 -0.974 17635 10562 1 18 . 1 1 61 61 THR CB C 61 71.224 71.224 71.453 -0.229 17635 10563 1 18 . 1 1 61 61 THR H H 61 8.452 8.452 8.786 -0.334 17635 10564 1 18 . 1 1 62 62 VAL N N 62 120.200 120.200 125.305 -5.105 17635 10565 1 18 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.126 0.118 17635 10566 1 18 . 1 1 62 62 VAL C C 62 175.994 175.994 174.190 1.804 17635 10567 1 18 . 1 1 62 62 VAL CA C 62 61.426 61.426 60.115 1.311 17635 10568 1 18 . 1 1 62 62 VAL CB C 62 34.685 34.685 33.331 1.354 17635 10569 1 18 . 1 1 62 62 VAL H H 62 8.071 8.071 8.178 -0.107 17635 10570 1 18 . 1 1 63 63 SER N N 63 121.689 121.689 123.569 -1.880 17635 10571 1 18 . 1 1 63 63 SER HA H 63 5.261 5.261 4.686 0.575 17635 10572 1 18 . 1 1 63 63 SER C C 63 177.943 177.943 173.772 4.171 17635 10573 1 18 . 1 1 63 63 SER CA C 63 57.662 57.662 56.660 1.002 17635 10574 1 18 . 1 1 63 63 SER CB C 63 64.427 64.427 64.463 -0.036 17635 10575 1 18 . 1 1 63 63 SER H H 63 7.695 7.695 8.261 -0.566 17635 10576 1 18 . 1 1 64 64 PHE N N 64 122.640 122.640 121.533 1.107 17635 10577 1 18 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.915 -0.061 17635 10578 1 18 . 1 1 64 64 PHE C C 64 174.605 174.605 175.789 -1.184 17635 10579 1 18 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.001 1.203 17635 10580 1 18 . 1 1 64 64 PHE CB C 64 41.976 41.976 42.216 -0.240 17635 10581 1 18 . 1 1 64 64 PHE H H 64 9.025 9.025 8.112 0.913 17635 10582 1 18 . 1 1 65 65 ASP N N 65 119.943 119.943 120.852 -0.909 17635 10583 1 18 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.591 -0.156 17635 10584 1 18 . 1 1 65 65 ASP C C 65 174.396 174.396 175.998 -1.602 17635 10585 1 18 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.808 1.634 17635 10586 1 18 . 1 1 65 65 ASP CB C 65 42.034 42.034 42.436 -0.402 17635 10587 1 18 . 1 1 65 65 ASP H H 65 8.512 8.512 8.682 -0.170 17635 10588 1 18 . 1 1 66 66 ASP N N 66 116.125 116.125 118.406 -2.281 17635 10589 1 18 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.070 0.329 17635 10590 1 18 . 1 1 66 66 ASP C C 66 175.936 175.936 175.083 0.853 17635 10591 1 18 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.044 -0.251 17635 10592 1 18 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.132 0.787 17635 10593 1 18 . 1 1 66 66 ASP H H 66 8.323 8.323 7.819 0.504 17635 10594 1 18 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.369 0.081 17635 10595 1 18 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.214 0.710 17635 10596 1 18 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.356 -0.526 17635 10597 1 18 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.191 0.228 17635 10598 1 18 . 1 1 68 68 PRO C C 68 171.345 171.345 178.743 -7.398 17635 10599 1 18 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.103 0.132 17635 10600 1 18 . 1 1 68 68 PRO CB C 68 30.997 30.997 30.874 0.123 17635 10601 1 18 . 1 1 69 69 SER N N 69 114.544 114.544 114.428 0.116 17635 10602 1 18 . 1 1 69 69 SER HA H 69 4.036 4.036 3.930 0.106 17635 10603 1 18 . 1 1 69 69 SER C C 69 176.535 176.535 176.138 0.397 17635 10604 1 18 . 1 1 69 69 SER CA C 69 61.837 61.837 61.409 0.428 17635 10605 1 18 . 1 1 69 69 SER CB C 69 62.773 62.773 62.371 0.402 17635 10606 1 18 . 1 1 69 69 SER H H 69 8.004 8.004 8.100 -0.096 17635 10607 1 18 . 1 1 70 70 ALA N N 70 122.649 122.649 124.505 -1.856 17635 10608 1 18 . 1 1 70 70 ALA HA H 70 3.593 3.593 4.330 -0.737 17635 10609 1 18 . 1 1 70 70 ALA C C 70 172.686 172.686 179.786 -7.100 17635 10610 1 18 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.704 -0.668 17635 10611 1 18 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.360 -0.496 17635 10612 1 18 . 1 1 70 70 ALA H H 70 7.383 7.383 7.803 -0.420 17635 10613 1 18 . 1 1 71 71 LYS N N 71 116.308 116.308 119.457 -3.149 17635 10614 1 18 . 1 1 71 71 LYS HA H 71 3.775 3.775 4.011 -0.236 17635 10615 1 18 . 1 1 71 71 LYS C C 71 172.333 172.333 178.715 -6.382 17635 10616 1 18 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.610 0.392 17635 10617 1 18 . 1 1 71 71 LYS CB C 71 32.442 32.442 32.290 0.152 17635 10618 1 18 . 1 1 71 71 LYS H H 71 7.159 7.159 7.604 -0.445 17635 10619 1 18 . 1 1 72 72 ALA N N 72 119.806 119.806 120.607 -0.801 17635 10620 1 18 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.036 0.130 17635 10621 1 18 . 1 1 72 72 ALA C C 72 170.530 170.530 179.792 -9.262 17635 10622 1 18 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.919 -0.204 17635 10623 1 18 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.018 -0.198 17635 10624 1 18 . 1 1 72 72 ALA H H 72 7.924 7.924 8.038 -0.114 17635 10625 1 18 . 1 1 73 73 ALA N N 73 120.524 120.524 121.414 -0.890 17635 10626 1 18 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.080 0.199 17635 10627 1 18 . 1 1 73 73 ALA C C 73 171.039 171.039 179.574 -8.535 17635 10628 1 18 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.959 0.420 17635 10629 1 18 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.572 0.559 17635 10630 1 18 . 1 1 73 73 ALA H H 73 8.104 8.104 7.643 0.461 17635 10631 1 18 . 1 1 74 74 ILE N N 74 119.875 119.875 117.959 1.916 17635 10632 1 18 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.952 -0.538 17635 10633 1 18 . 1 1 74 74 ILE C C 74 172.435 172.435 177.429 -4.994 17635 10634 1 18 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.363 0.481 17635 10635 1 18 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.745 0.998 17635 10636 1 18 . 1 1 74 74 ILE H H 74 7.574 7.574 7.898 -0.324 17635 10637 1 18 . 1 1 75 75 ASP N N 75 117.867 117.867 117.763 0.104 17635 10638 1 18 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.388 -0.077 17635 10639 1 18 . 1 1 75 75 ASP C C 75 172.054 172.054 176.600 -4.546 17635 10640 1 18 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.576 0.585 17635 10641 1 18 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.598 -1.067 17635 10642 1 18 . 1 1 75 75 ASP H H 75 7.937 7.937 7.981 -0.044 17635 10643 1 18 . 1 1 76 76 TRP N N 76 117.313 117.313 120.911 -3.598 17635 10644 1 18 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.208 0.148 17635 10645 1 18 . 1 1 76 76 TRP C C 76 173.272 173.272 177.266 -3.994 17635 10646 1 18 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.696 0.766 17635 10647 1 18 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.319 1.458 17635 10648 1 18 . 1 1 76 76 TRP H H 76 8.475 8.475 7.672 0.803 17635 10649 1 18 . 1 1 77 77 PHE N N 77 112.019 112.019 117.359 -5.340 17635 10650 1 18 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.521 0.127 17635 10651 1 18 . 1 1 77 77 PHE C C 77 173.747 173.747 175.947 -2.200 17635 10652 1 18 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.814 -0.893 17635 10653 1 18 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.454 2.276 17635 10654 1 18 . 1 1 77 77 PHE H H 77 8.488 8.488 7.684 0.804 17635 10655 1 18 . 1 1 78 78 ASP N N 78 118.408 118.408 120.192 -1.784 17635 10656 1 18 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.528 -0.064 17635 10657 1 18 . 1 1 78 78 ASP C C 78 172.542 172.542 176.547 -4.005 17635 10658 1 18 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.170 3.520 17635 10659 1 18 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.729 2.157 17635 10660 1 18 . 1 1 78 78 ASP H H 78 7.978 7.978 8.509 -0.531 17635 10661 1 18 . 1 1 79 79 GLY N N 79 115.548 115.548 103.095 12.453 17635 10662 1 18 . 1 1 79 79 GLY C C 79 175.680 175.680 173.648 2.032 17635 10663 1 18 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.960 1.112 17635 10664 1 18 . 1 1 79 79 GLY H H 79 8.615 8.615 8.293 0.322 17635 10665 1 18 . 1 1 80 80 LYS N N 80 120.271 120.271 118.576 1.695 17635 10666 1 18 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.568 -0.106 17635 10667 1 18 . 1 1 80 80 LYS C C 80 175.853 175.853 174.989 0.864 17635 10668 1 18 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.535 0.616 17635 10669 1 18 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.250 -1.824 17635 10670 1 18 . 1 1 80 80 LYS H H 80 8.013 8.013 7.711 0.302 17635 10671 1 18 . 1 1 81 81 GLU N N 81 115.765 115.765 118.456 -2.691 17635 10672 1 18 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.284 -0.586 17635 10673 1 18 . 1 1 81 81 GLU C C 81 173.263 173.263 175.546 -2.283 17635 10674 1 18 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.376 0.548 17635 10675 1 18 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.463 0.579 17635 10676 1 18 . 1 1 81 81 GLU H H 81 8.201 8.201 8.534 -0.333 17635 10677 1 18 . 1 1 82 82 PHE N N 82 127.080 127.080 126.602 0.478 17635 10678 1 18 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.530 -0.034 17635 10679 1 18 . 1 1 82 82 PHE C C 82 175.349 175.349 175.600 -0.251 17635 10680 1 18 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.161 1.555 17635 10681 1 18 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.482 2.512 17635 10682 1 18 . 1 1 82 82 PHE H H 82 9.162 9.162 9.146 0.016 17635 10683 1 18 . 1 1 83 83 SER N N 83 125.136 125.136 121.912 3.224 17635 10684 1 18 . 1 1 83 83 SER HA H 83 3.803 3.803 4.152 -0.349 17635 10685 1 18 . 1 1 83 83 SER C C 83 175.543 175.543 174.813 0.730 17635 10686 1 18 . 1 1 83 83 SER CA C 83 58.371 58.371 59.183 -0.812 17635 10687 1 18 . 1 1 83 83 SER CB C 83 62.519 62.519 62.680 -0.161 17635 10688 1 18 . 1 1 83 83 SER H H 83 9.193 9.193 9.104 0.089 17635 10689 1 18 . 1 1 84 84 GLY N N 84 103.581 103.581 104.874 -1.293 17635 10690 1 18 . 1 1 84 84 GLY C C 84 177.188 177.188 174.087 3.101 17635 10691 1 18 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.775 0.277 17635 10692 1 18 . 1 1 84 84 GLY H H 84 8.446 8.446 8.216 0.230 17635 10693 1 18 . 1 1 85 85 ASN N N 85 119.051 119.051 120.659 -1.608 17635 10694 1 18 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.135 0.199 17635 10695 1 18 . 1 1 85 85 ASN C C 85 178.020 178.020 172.835 5.185 17635 10696 1 18 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.082 -0.611 17635 10697 1 18 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.798 2.319 17635 10698 1 18 . 1 1 85 85 ASN H H 85 7.762 7.762 7.857 -0.095 17635 10699 1 18 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.344 -0.677 17635 10700 1 18 . 1 1 86 86 PRO C C 86 173.474 173.474 175.981 -2.507 17635 10701 1 18 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.480 0.230 17635 10702 1 18 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.814 -0.944 17635 10703 1 18 . 1 1 87 87 ILE N N 87 117.270 117.270 115.884 1.386 17635 10704 1 18 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.386 -0.239 17635 10705 1 18 . 1 1 87 87 ILE C C 87 174.495 174.495 174.230 0.265 17635 10706 1 18 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.681 0.810 17635 10707 1 18 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.794 -1.123 17635 10708 1 18 . 1 1 87 87 ILE H H 87 8.469 8.469 9.049 -0.580 17635 10709 1 18 . 1 1 88 88 LYS N N 88 122.271 122.271 122.029 0.242 17635 10710 1 18 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.793 0.399 17635 10711 1 18 . 1 1 88 88 LYS C C 88 174.393 174.393 175.104 -0.711 17635 10712 1 18 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.803 -0.665 17635 10713 1 18 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.046 1.003 17635 10714 1 18 . 1 1 88 88 LYS H H 88 8.353 8.353 8.175 0.178 17635 10715 1 18 . 1 1 89 89 VAL N N 89 125.661 125.661 126.614 -0.953 17635 10716 1 18 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.550 0.413 17635 10717 1 18 . 1 1 89 89 VAL C C 89 177.160 177.160 175.659 1.501 17635 10718 1 18 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.264 0.097 17635 10719 1 18 . 1 1 89 89 VAL CB C 89 34.770 34.770 30.933 3.837 17635 10720 1 18 . 1 1 89 89 VAL H H 89 9.414 9.414 8.725 0.689 17635 10721 1 18 . 1 1 90 90 SER N N 90 119.538 119.538 122.680 -3.142 17635 10722 1 18 . 1 1 90 90 SER HA H 90 4.710 4.710 4.358 0.352 17635 10723 1 18 . 1 1 90 90 SER C C 90 176.533 176.533 173.180 3.353 17635 10724 1 18 . 1 1 90 90 SER CA C 90 56.936 56.936 56.255 0.681 17635 10725 1 18 . 1 1 90 90 SER CB C 90 66.470 66.470 65.213 1.257 17635 10726 1 18 . 1 1 90 90 SER H H 90 8.945 8.945 7.646 1.299 17635 10727 1 18 . 1 1 91 91 PHE N N 91 120.115 120.115 120.656 -0.541 17635 10728 1 18 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.489 0.184 17635 10729 1 18 . 1 1 91 91 PHE C C 91 173.349 173.349 176.638 -3.289 17635 10730 1 18 . 1 1 91 91 PHE CA C 91 61.155 61.155 57.974 3.181 17635 10731 1 18 . 1 1 91 91 PHE CB C 91 39.503 39.503 38.368 1.135 17635 10732 1 18 . 1 1 91 91 PHE H H 91 8.919 8.919 8.481 0.438 17635 10733 1 18 . 1 1 92 92 ALA N N 92 124.386 124.386 130.753 -6.367 17635 10734 1 18 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.425 -0.069 17635 10735 1 18 . 1 1 92 92 ALA C C 92 172.984 172.984 176.640 -3.656 17635 10736 1 18 . 1 1 92 92 ALA CA C 92 52.098 52.098 53.308 -1.210 17635 10737 1 18 . 1 1 92 92 ALA CB C 92 19.406 19.406 17.526 1.880 17635 10738 1 18 . 1 1 92 92 ALA H H 92 8.563 8.563 8.469 0.094 17635 10739 1 18 . 1 1 93 93 THR N N 93 116.073 116.073 116.665 -0.592 17635 10740 1 18 . 1 1 93 93 THR HA H 93 4.208 4.208 4.363 -0.155 17635 10741 1 18 . 1 1 93 93 THR C C 93 176.032 176.032 172.873 3.159 17635 10742 1 18 . 1 1 93 93 THR CA C 93 62.255 62.255 61.703 0.552 17635 10743 1 18 . 1 1 93 93 THR CB C 93 69.708 69.708 70.672 -0.964 17635 10744 1 18 . 1 1 93 93 THR H H 93 8.312 8.312 8.247 0.065 17635 10745 1 18 . 1 1 94 94 ARG N N 94 124.359 124.359 120.999 3.360 17635 10746 1 18 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.060 0.277 17635 10747 1 18 . 1 1 94 94 ARG C C 94 174.426 174.426 175.307 -0.881 17635 10748 1 18 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.761 -0.706 17635 10749 1 18 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.497 0.414 17635 10750 1 18 . 1 1 94 94 ARG H H 94 8.493 8.493 8.581 -0.088 17635 10751 1 18 . 1 1 95 95 ARG N N 95 122.515 122.515 124.309 -1.794 17635 10752 1 18 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.342 -0.114 17635 10753 1 18 . 1 1 95 95 ARG C C 95 174.306 174.306 176.202 -1.896 17635 10754 1 18 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.517 -0.375 17635 10755 1 18 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.548 1.418 17635 10756 1 18 . 1 1 95 95 ARG H H 95 8.343 8.343 8.576 -0.233 17635 10757 1 18 . 1 1 96 96 ALA N N 96 125.127 125.127 128.139 -3.012 17635 10758 1 18 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.373 -0.164 17635 10759 1 18 . 1 1 96 96 ALA C C 96 173.226 173.226 176.631 -3.405 17635 10760 1 18 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.558 0.212 17635 10761 1 18 . 1 1 96 96 ALA CB C 96 19.193 19.193 18.941 0.252 17635 10762 1 18 . 1 1 96 96 ALA H H 96 8.402 8.402 8.652 -0.250 17635 10763 1 18 . 1 1 97 97 ASP N N 97 118.483 118.483 117.101 1.382 17635 10764 1 18 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.689 -0.191 17635 10765 1 18 . 1 1 97 97 ASP C C 97 174.302 174.302 174.843 -0.541 17635 10766 1 18 . 1 1 97 97 ASP CA C 97 54.091 54.091 53.669 0.422 17635 10767 1 18 . 1 1 97 97 ASP CB C 97 40.907 40.907 42.735 -1.828 17635 10768 1 18 . 1 1 97 97 ASP H H 97 8.206 8.206 7.772 0.434 17635 10769 1 18 . 1 1 98 98 PHE N N 98 120.321 120.321 121.305 -0.984 17635 10770 1 18 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.698 -0.208 17635 10771 1 18 . 1 1 98 98 PHE C C 98 174.878 174.878 175.175 -0.297 17635 10772 1 18 . 1 1 98 98 PHE CA C 98 58.160 58.160 57.673 0.487 17635 10773 1 18 . 1 1 98 98 PHE CB C 98 39.303 39.303 39.304 -0.001 17635 10774 1 18 . 1 1 98 98 PHE H H 98 7.990 7.990 8.506 -0.516 17635 10775 1 18 . 1 1 99 99 ASN N N 99 120.016 120.016 121.679 -1.663 17635 10776 1 18 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.835 -0.226 17635 10777 1 18 . 1 1 99 99 ASN C C 99 175.348 175.348 174.079 1.269 17635 10778 1 18 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.113 0.200 17635 10779 1 18 . 1 1 99 99 ASN CB C 99 38.727 38.727 40.030 -1.303 17635 10780 1 18 . 1 1 99 99 ASN H H 99 8.336 8.336 8.614 -0.278 17635 10781 1 18 . 1 1 100 100 ARG N N 100 121.374 121.374 123.693 -2.319 17635 10782 1 18 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.665 -0.392 17635 10783 1 18 . 1 1 100 100 ARG C C 100 173.627 173.627 178.005 -4.378 17635 10784 1 18 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.718 -0.226 17635 10785 1 18 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.631 -0.112 17635 10786 1 18 . 1 1 100 100 ARG H H 100 8.181 8.181 8.877 -0.696 17635 10787 1 18 . 1 1 101 101 GLY N N 101 109.586 109.586 108.012 1.574 17635 10788 1 18 . 1 1 101 101 GLY C C 101 175.739 175.739 175.290 0.449 17635 10789 1 18 . 1 1 101 101 GLY CA C 101 45.380 45.380 45.113 0.267 17635 10790 1 18 . 1 1 101 101 GLY H H 101 8.413 8.413 8.301 0.112 17635 10791 1 18 . 1 1 102 102 GLY N N 102 108.692 108.692 111.462 -2.770 17635 10792 1 18 . 1 1 102 102 GLY C C 102 176.286 176.286 174.448 1.838 17635 10793 1 18 . 1 1 102 102 GLY CA C 102 45.338 45.338 44.756 0.582 17635 10794 1 18 . 1 1 102 102 GLY H H 102 8.281 8.281 8.110 0.171 17635 10795 1 18 . 1 1 103 103 GLY N N 103 108.844 108.844 107.870 0.974 17635 10796 1 18 . 1 1 103 103 GLY C C 103 175.798 175.798 173.066 2.732 17635 10797 1 18 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.606 0.740 17635 10798 1 18 . 1 1 103 103 GLY H H 103 8.364 8.364 8.146 0.218 17635 10799 1 18 . 1 1 104 104 ASN N N 104 118.527 118.527 122.125 -3.598 17635 10800 1 18 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.760 -0.042 17635 10801 1 18 . 1 1 104 104 ASN C C 104 174.547 174.547 176.383 -1.836 17635 10802 1 18 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.589 0.620 17635 10803 1 18 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.615 0.264 17635 10804 1 18 . 1 1 104 104 ASN H H 104 8.438 8.438 8.518 -0.080 17635 10805 1 18 . 1 1 105 105 GLY N N 105 109.166 109.166 115.587 -6.421 17635 10806 1 18 . 1 1 105 105 GLY C C 105 176.074 176.074 174.398 1.676 17635 10807 1 18 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.877 0.725 17635 10808 1 18 . 1 1 105 105 GLY H H 105 8.477 8.477 8.784 -0.307 17635 10809 1 18 . 1 1 106 106 ARG N N 106 120.341 120.341 122.661 -2.320 17635 10810 1 18 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.215 0.136 17635 10811 1 18 . 1 1 106 106 ARG C C 106 173.491 173.491 176.758 -3.267 17635 10812 1 18 . 1 1 106 106 ARG CA C 106 56.227 56.227 56.763 -0.536 17635 10813 1 18 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.493 0.136 17635 10814 1 18 . 1 1 106 106 ARG H H 106 8.244 8.244 8.182 0.062 17635 10815 1 18 . 1 1 107 107 GLY N N 107 109.856 109.856 110.328 -0.472 17635 10816 1 18 . 1 1 107 107 GLY C C 107 175.834 175.834 174.118 1.716 17635 10817 1 18 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.566 0.875 17635 10818 1 18 . 1 1 107 107 GLY H H 107 8.522 8.522 8.623 -0.101 17635 10819 1 19 . 1 1 2 2 GLN N N 2 121.692 121.692 120.728 0.964 17635 10820 1 19 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.579 -0.313 17635 10821 1 19 . 1 1 2 2 GLN C C 2 175.248 175.248 175.484 -0.236 17635 10822 1 19 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.723 0.273 17635 10823 1 19 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.529 0.110 17635 10824 1 19 . 1 1 2 2 GLN H H 2 8.621 8.621 8.470 0.151 17635 10825 1 19 . 1 1 3 3 ASP N N 3 121.801 121.801 120.876 0.925 17635 10826 1 19 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.634 -0.066 17635 10827 1 19 . 1 1 3 3 ASP C C 3 174.336 174.336 176.548 -2.212 17635 10828 1 19 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.936 -0.874 17635 10829 1 19 . 1 1 3 3 ASP CB C 3 41.071 41.071 41.209 -0.138 17635 10830 1 19 . 1 1 3 3 ASP H H 3 8.436 8.436 8.728 -0.292 17635 10831 1 19 . 1 1 4 4 ASN N N 4 120.292 120.292 116.084 4.208 17635 10832 1 19 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.554 0.083 17635 10833 1 19 . 1 1 4 4 ASN C C 4 174.415 174.415 175.189 -0.774 17635 10834 1 19 . 1 1 4 4 ASN CA C 4 53.861 53.861 52.924 0.937 17635 10835 1 19 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.775 -0.241 17635 10836 1 19 . 1 1 4 4 ASN H H 4 8.528 8.528 8.487 0.041 17635 10837 1 19 . 1 1 5 5 SER N N 5 117.091 117.091 115.134 1.957 17635 10838 1 19 . 1 1 5 5 SER HA H 5 4.163 4.163 4.684 -0.521 17635 10839 1 19 . 1 1 5 5 SER C C 5 176.370 176.370 174.302 2.068 17635 10840 1 19 . 1 1 5 5 SER CA C 5 60.846 60.846 59.351 1.495 17635 10841 1 19 . 1 1 5 5 SER CB C 5 63.136 63.136 63.989 -0.853 17635 10842 1 19 . 1 1 5 5 SER H H 5 8.470 8.470 8.503 -0.033 17635 10843 1 19 . 1 1 6 6 ASP N N 6 119.436 119.436 120.073 -0.637 17635 10844 1 19 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.751 -0.056 17635 10845 1 19 . 1 1 6 6 ASP C C 6 175.048 175.048 175.062 -0.014 17635 10846 1 19 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.443 -0.349 17635 10847 1 19 . 1 1 6 6 ASP CB C 6 40.935 40.935 41.139 -0.204 17635 10848 1 19 . 1 1 6 6 ASP H H 6 8.218 8.218 8.254 -0.036 17635 10849 1 19 . 1 1 7 7 ASN N N 7 119.696 119.696 118.433 1.263 17635 10850 1 19 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.474 0.154 17635 10851 1 19 . 1 1 7 7 ASN C C 7 176.539 176.539 174.816 1.723 17635 10852 1 19 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.217 -0.059 17635 10853 1 19 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.673 0.186 17635 10854 1 19 . 1 1 7 7 ASN H H 7 7.734 7.734 7.429 0.305 17635 10855 1 19 . 1 1 8 8 ASN N N 8 119.436 119.436 118.896 0.540 17635 10856 1 19 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.743 0.125 17635 10857 1 19 . 1 1 8 8 ASN C C 8 175.327 175.327 174.744 0.583 17635 10858 1 19 . 1 1 8 8 ASN CA C 8 53.204 53.204 53.699 -0.495 17635 10859 1 19 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.230 -0.736 17635 10860 1 19 . 1 1 8 8 ASN H H 8 8.350 8.350 8.262 0.088 17635 10861 1 19 . 1 1 9 9 THR N N 9 118.650 118.650 115.921 2.729 17635 10862 1 19 . 1 1 9 9 THR HA H 9 5.557 5.557 4.507 1.050 17635 10863 1 19 . 1 1 9 9 THR C C 9 177.117 177.117 174.300 2.817 17635 10864 1 19 . 1 1 9 9 THR CA C 9 62.314 62.314 63.321 -1.006 17635 10865 1 19 . 1 1 9 9 THR CB C 9 71.225 71.225 68.332 2.893 17635 10866 1 19 . 1 1 9 9 THR H H 9 8.428 8.428 7.383 1.045 17635 10867 1 19 . 1 1 10 10 ILE N N 10 118.556 118.556 120.150 -1.594 17635 10868 1 19 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.685 0.480 17635 10869 1 19 . 1 1 10 10 ILE C C 10 176.837 176.837 174.202 2.635 17635 10870 1 19 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.828 0.470 17635 10871 1 19 . 1 1 10 10 ILE CB C 10 39.880 39.880 40.685 -0.805 17635 10872 1 19 . 1 1 10 10 ILE H H 10 8.770 8.770 8.594 0.176 17635 10873 1 19 . 1 1 11 11 PHE N N 11 123.798 123.798 120.075 3.723 17635 10874 1 19 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.776 0.644 17635 10875 1 19 . 1 1 11 11 PHE C C 11 177.066 177.066 174.999 2.067 17635 10876 1 19 . 1 1 11 11 PHE CA C 11 55.362 55.362 57.197 -1.835 17635 10877 1 19 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.088 0.780 17635 10878 1 19 . 1 1 11 11 PHE H H 11 9.548 9.548 7.985 1.563 17635 10879 1 19 . 1 1 12 12 VAL N N 12 127.993 127.993 126.684 1.309 17635 10880 1 19 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.603 0.355 17635 10881 1 19 . 1 1 12 12 VAL C C 12 176.965 176.965 174.965 2.000 17635 10882 1 19 . 1 1 12 12 VAL CA C 12 59.835 59.835 60.510 -0.675 17635 10883 1 19 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.048 2.752 17635 10884 1 19 . 1 1 12 12 VAL H H 12 8.940 8.940 9.376 -0.436 17635 10885 1 19 . 1 1 13 13 GLN N N 13 122.289 122.289 127.293 -5.004 17635 10886 1 19 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.979 -0.200 17635 10887 1 19 . 1 1 13 13 GLN C C 13 175.631 175.631 176.185 -0.554 17635 10888 1 19 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.172 -0.062 17635 10889 1 19 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.727 3.405 17635 10890 1 19 . 1 1 13 13 GLN H H 13 8.747 8.747 8.327 0.420 17635 10891 1 19 . 1 1 14 14 GLY N N 14 109.212 109.212 112.027 -2.815 17635 10892 1 19 . 1 1 14 14 GLY C C 14 175.436 175.436 172.995 2.441 17635 10893 1 19 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.414 0.016 17635 10894 1 19 . 1 1 14 14 GLY H H 14 8.236 8.236 9.224 -0.988 17635 10895 1 19 . 1 1 15 15 LEU N N 15 117.824 117.824 120.872 -3.048 17635 10896 1 19 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.258 -0.552 17635 10897 1 19 . 1 1 15 15 LEU C C 15 174.111 174.111 178.670 -4.559 17635 10898 1 19 . 1 1 15 15 LEU CA C 15 55.718 55.718 56.030 -0.312 17635 10899 1 19 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.395 1.038 17635 10900 1 19 . 1 1 15 15 LEU H H 15 8.442 8.442 7.827 0.615 17635 10901 1 19 . 1 1 16 16 GLY N N 16 105.063 105.063 106.516 -1.453 17635 10902 1 19 . 1 1 16 16 GLY C C 16 177.771 177.771 174.806 2.965 17635 10903 1 19 . 1 1 16 16 GLY CA C 16 44.094 44.094 46.454 -2.360 17635 10904 1 19 . 1 1 16 16 GLY H H 16 8.006 8.006 8.290 -0.284 17635 10905 1 19 . 1 1 17 17 GLU N N 17 113.781 113.781 121.295 -7.514 17635 10906 1 19 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.449 -0.330 17635 10907 1 19 . 1 1 17 17 GLU C C 17 173.937 173.937 175.797 -1.860 17635 10908 1 19 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.051 1.230 17635 10909 1 19 . 1 1 17 17 GLU CB C 17 30.436 30.436 30.054 0.382 17635 10910 1 19 . 1 1 17 17 GLU H H 17 8.134 8.134 8.030 0.104 17635 10911 1 19 . 1 1 18 18 ASN N N 18 116.660 116.660 114.566 2.094 17635 10912 1 19 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.710 0.231 17635 10913 1 19 . 1 1 18 18 ASN C C 18 175.900 175.900 175.367 0.533 17635 10914 1 19 . 1 1 18 18 ASN CA C 18 52.478 52.478 53.098 -0.620 17635 10915 1 19 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.707 -1.222 17635 10916 1 19 . 1 1 18 18 ASN H H 18 8.407 8.407 7.688 0.719 17635 10917 1 19 . 1 1 19 19 VAL N N 19 118.323 118.323 122.440 -4.117 17635 10918 1 19 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.757 0.395 17635 10919 1 19 . 1 1 19 19 VAL C C 19 177.655 177.655 174.711 2.944 17635 10920 1 19 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.861 -1.984 17635 10921 1 19 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.640 1.873 17635 10922 1 19 . 1 1 19 19 VAL H H 19 6.855 6.855 8.281 -1.426 17635 10923 1 19 . 1 1 20 20 THR N N 20 111.636 111.636 115.357 -3.721 17635 10924 1 19 . 1 1 20 20 THR HA H 20 4.719 4.719 4.584 0.135 17635 10925 1 19 . 1 1 20 20 THR C C 20 175.266 175.266 174.366 0.900 17635 10926 1 19 . 1 1 20 20 THR CA C 20 58.698 58.698 60.357 -1.659 17635 10927 1 19 . 1 1 20 20 THR CB C 20 72.948 72.948 70.970 1.978 17635 10928 1 19 . 1 1 20 20 THR H H 20 7.328 7.328 7.763 -0.435 17635 10929 1 19 . 1 1 21 21 ILE N N 21 122.147 122.147 124.195 -2.048 17635 10930 1 19 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.905 -0.387 17635 10931 1 19 . 1 1 21 21 ILE C C 21 173.198 173.198 177.586 -4.388 17635 10932 1 19 . 1 1 21 21 ILE CA C 21 65.772 65.772 63.423 2.349 17635 10933 1 19 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.305 0.278 17635 10934 1 19 . 1 1 21 21 ILE H H 21 9.074 9.074 8.513 0.561 17635 10935 1 19 . 1 1 22 22 GLU N N 22 118.154 118.154 120.674 -2.520 17635 10936 1 19 . 1 1 22 22 GLU HA H 22 3.986 3.986 3.983 0.003 17635 10937 1 19 . 1 1 22 22 GLU C C 22 171.799 171.799 179.247 -7.448 17635 10938 1 19 . 1 1 22 22 GLU CA C 22 60.613 60.613 60.153 0.460 17635 10939 1 19 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.704 0.087 17635 10940 1 19 . 1 1 22 22 GLU H H 22 8.814 8.814 8.563 0.251 17635 10941 1 19 . 1 1 23 23 SER N N 23 115.921 115.921 116.018 -0.097 17635 10942 1 19 . 1 1 23 23 SER HA H 23 4.384 4.384 4.310 0.074 17635 10943 1 19 . 1 1 23 23 SER C C 23 172.447 172.447 176.805 -4.358 17635 10944 1 19 . 1 1 23 23 SER CA C 23 61.239 61.239 61.533 -0.295 17635 10945 1 19 . 1 1 23 23 SER CB C 23 62.838 62.838 62.911 -0.073 17635 10946 1 19 . 1 1 23 23 SER H H 23 8.236 8.236 8.168 0.068 17635 10947 1 19 . 1 1 24 24 VAL N N 24 124.867 124.867 121.739 3.128 17635 10948 1 19 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.009 -0.261 17635 10949 1 19 . 1 1 24 24 VAL C C 24 173.016 173.016 177.693 -4.677 17635 10950 1 19 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.701 0.553 17635 10951 1 19 . 1 1 24 24 VAL CB C 24 31.533 31.533 32.085 -0.552 17635 10952 1 19 . 1 1 24 24 VAL H H 24 7.973 7.973 7.833 0.140 17635 10953 1 19 . 1 1 25 25 ALA N N 25 123.198 123.198 121.641 1.557 17635 10954 1 19 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.068 -0.169 17635 10955 1 19 . 1 1 25 25 ALA C C 25 171.061 171.061 178.885 -7.824 17635 10956 1 19 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.897 0.798 17635 10957 1 19 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.389 -0.651 17635 10958 1 19 . 1 1 25 25 ALA H H 25 8.695 8.695 8.698 -0.003 17635 10959 1 19 . 1 1 26 26 ASP N N 26 115.503 115.503 118.347 -2.844 17635 10960 1 19 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.533 -0.210 17635 10961 1 19 . 1 1 26 26 ASP C C 26 173.108 173.108 177.688 -4.580 17635 10962 1 19 . 1 1 26 26 ASP CA C 26 57.323 57.323 57.045 0.278 17635 10963 1 19 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.327 -0.275 17635 10964 1 19 . 1 1 26 26 ASP H H 26 8.312 8.312 8.164 0.148 17635 10965 1 19 . 1 1 27 27 TYR N N 27 119.224 119.224 117.711 1.513 17635 10966 1 19 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.606 -0.406 17635 10967 1 19 . 1 1 27 27 TYR C C 27 172.908 172.908 176.128 -3.220 17635 10968 1 19 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.684 2.332 17635 10969 1 19 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.387 0.545 17635 10970 1 19 . 1 1 27 27 TYR H H 27 7.533 7.533 7.876 -0.343 17635 10971 1 19 . 1 1 28 28 PHE N N 28 112.595 112.595 120.352 -7.757 17635 10972 1 19 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.119 0.211 17635 10973 1 19 . 1 1 28 28 PHE C C 28 173.082 173.082 175.029 -1.947 17635 10974 1 19 . 1 1 28 28 PHE CA C 28 61.784 61.784 55.908 5.876 17635 10975 1 19 . 1 1 28 28 PHE CB C 28 40.003 40.003 39.164 0.839 17635 10976 1 19 . 1 1 28 28 PHE H H 28 7.974 7.974 8.397 -0.423 17635 10977 1 19 . 1 1 29 29 LYS N N 29 118.820 118.820 116.886 1.934 17635 10978 1 19 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.582 0.335 17635 10979 1 19 . 1 1 29 29 LYS C C 29 173.682 173.682 176.668 -2.986 17635 10980 1 19 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.788 2.492 17635 10981 1 19 . 1 1 29 29 LYS CB C 29 31.291 31.291 30.851 0.440 17635 10982 1 19 . 1 1 29 29 LYS H H 29 8.325 8.325 7.676 0.649 17635 10983 1 19 . 1 1 30 30 GLN N N 30 116.232 116.232 118.192 -1.960 17635 10984 1 19 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.318 -0.183 17635 10985 1 19 . 1 1 30 30 GLN C C 30 173.790 173.790 177.254 -3.464 17635 10986 1 19 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.645 -0.099 17635 10987 1 19 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.284 0.614 17635 10988 1 19 . 1 1 30 30 GLN H H 30 7.518 7.518 8.236 -0.718 17635 10989 1 19 . 1 1 31 31 ILE N N 31 116.489 116.489 118.227 -1.738 17635 10990 1 19 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.174 0.065 17635 10991 1 19 . 1 1 31 31 ILE C C 31 175.599 175.599 175.577 0.022 17635 10992 1 19 . 1 1 31 31 ILE CA C 31 58.221 58.221 62.076 -3.855 17635 10993 1 19 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.903 1.431 17635 10994 1 19 . 1 1 31 31 ILE H H 31 7.809 7.809 8.080 -0.271 17635 10995 1 19 . 1 1 32 32 GLY N N 32 107.416 107.416 105.370 2.046 17635 10996 1 19 . 1 1 32 32 GLY C C 32 180.182 180.182 171.698 8.484 17635 10997 1 19 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.656 0.339 17635 10998 1 19 . 1 1 32 32 GLY H H 32 7.344 7.344 7.649 -0.305 17635 10999 1 19 . 1 1 33 33 ILE N N 33 117.784 117.784 121.415 -3.631 17635 11000 1 19 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.153 -0.064 17635 11001 1 19 . 1 1 33 33 ILE C C 33 173.301 173.301 174.742 -1.441 17635 11002 1 19 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.409 1.232 17635 11003 1 19 . 1 1 33 33 ILE CB C 33 38.659 38.659 38.409 0.250 17635 11004 1 19 . 1 1 33 33 ILE H H 33 8.173 8.173 8.192 -0.019 17635 11005 1 19 . 1 1 34 34 ILE N N 34 131.781 131.781 128.316 3.465 17635 11006 1 19 . 1 1 34 34 ILE HA H 34 3.787 3.787 3.585 0.202 17635 11007 1 19 . 1 1 34 34 ILE C C 34 174.663 174.663 176.337 -1.674 17635 11008 1 19 . 1 1 34 34 ILE CA C 34 61.370 61.370 61.098 0.272 17635 11009 1 19 . 1 1 34 34 ILE CB C 34 37.995 37.995 37.806 0.189 17635 11010 1 19 . 1 1 34 34 ILE H H 34 8.687 8.687 8.392 0.295 17635 11011 1 19 . 1 1 35 35 LYS N N 35 130.372 130.372 128.034 2.338 17635 11012 1 19 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.149 -0.065 17635 11013 1 19 . 1 1 35 35 LYS C C 35 175.376 175.376 176.516 -1.140 17635 11014 1 19 . 1 1 35 35 LYS CA C 35 57.473 57.473 55.947 1.526 17635 11015 1 19 . 1 1 35 35 LYS CB C 35 33.664 33.664 30.893 2.771 17635 11016 1 19 . 1 1 35 35 LYS H H 35 8.680 8.680 8.563 0.117 17635 11017 1 19 . 1 1 36 36 THR N N 36 118.312 118.312 118.612 -0.300 17635 11018 1 19 . 1 1 36 36 THR HA H 36 4.415 4.415 4.140 0.275 17635 11019 1 19 . 1 1 36 36 THR C C 36 176.394 176.394 174.455 1.939 17635 11020 1 19 . 1 1 36 36 THR CA C 36 61.340 61.340 62.323 -0.983 17635 11021 1 19 . 1 1 36 36 THR CB C 36 70.809 70.809 69.937 0.872 17635 11022 1 19 . 1 1 36 36 THR H H 36 8.456 8.456 8.118 0.338 17635 11023 1 19 . 1 1 37 37 ASN N N 37 124.092 124.092 120.207 3.885 17635 11024 1 19 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.864 -0.334 17635 11025 1 19 . 1 1 37 37 ASN C C 37 174.235 174.235 176.386 -2.151 17635 11026 1 19 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.443 1.621 17635 11027 1 19 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.794 -0.868 17635 11028 1 19 . 1 1 37 37 ASN H H 37 8.794 8.794 8.387 0.407 17635 11029 1 19 . 1 1 38 38 LYS N N 38 127.969 127.969 126.349 1.620 17635 11030 1 19 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.083 -0.079 17635 11031 1 19 . 1 1 38 38 LYS C C 38 172.702 172.702 176.802 -4.100 17635 11032 1 19 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.666 -0.208 17635 11033 1 19 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.062 1.105 17635 11034 1 19 . 1 1 38 38 LYS H H 38 8.962 8.962 8.840 0.122 17635 11035 1 19 . 1 1 39 39 LYS N N 39 117.413 117.413 118.643 -1.230 17635 11036 1 19 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.284 -0.026 17635 11037 1 19 . 1 1 39 39 LYS C C 39 172.261 172.261 177.687 -5.426 17635 11038 1 19 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.993 0.326 17635 11039 1 19 . 1 1 39 39 LYS CB C 39 32.797 32.797 33.371 -0.574 17635 11040 1 19 . 1 1 39 39 LYS H H 39 8.314 8.314 7.676 0.638 17635 11041 1 19 . 1 1 40 40 THR N N 40 105.547 105.547 110.433 -4.886 17635 11042 1 19 . 1 1 40 40 THR HA H 40 4.465 4.465 4.456 0.009 17635 11043 1 19 . 1 1 40 40 THR C C 40 174.021 174.021 174.939 -0.918 17635 11044 1 19 . 1 1 40 40 THR CA C 40 61.260 61.260 62.599 -1.339 17635 11045 1 19 . 1 1 40 40 THR CB C 40 70.997 70.997 70.826 0.171 17635 11046 1 19 . 1 1 40 40 THR H H 40 7.422 7.422 7.745 -0.323 17635 11047 1 19 . 1 1 41 41 GLY N N 41 111.631 111.631 110.984 0.647 17635 11048 1 19 . 1 1 41 41 GLY C C 41 176.727 176.727 173.499 3.228 17635 11049 1 19 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.297 0.433 17635 11050 1 19 . 1 1 41 41 GLY H H 41 8.644 8.644 8.591 0.053 17635 11051 1 19 . 1 1 42 42 GLN N N 42 118.894 118.894 118.536 0.358 17635 11052 1 19 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.800 -0.131 17635 11053 1 19 . 1 1 42 42 GLN C C 42 177.178 177.178 173.585 3.593 17635 11054 1 19 . 1 1 42 42 GLN CA C 42 53.581 53.581 51.939 1.642 17635 11055 1 19 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.178 0.052 17635 11056 1 19 . 1 1 42 42 GLN H H 42 7.662 7.662 7.666 -0.004 17635 11057 1 19 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.091 0.504 17635 11058 1 19 . 1 1 43 43 PRO C C 43 172.629 172.629 175.903 -3.274 17635 11059 1 19 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.667 -0.845 17635 11060 1 19 . 1 1 43 43 PRO CB C 43 32.696 32.696 31.823 0.873 17635 11061 1 19 . 1 1 44 44 MET N N 44 124.162 124.162 123.940 0.222 17635 11062 1 19 . 1 1 44 44 MET HA H 44 4.432 4.432 4.553 -0.121 17635 11063 1 19 . 1 1 44 44 MET C C 44 176.474 176.474 174.790 1.684 17635 11064 1 19 . 1 1 44 44 MET CA C 44 55.419 55.419 55.138 0.281 17635 11065 1 19 . 1 1 44 44 MET CB C 44 30.555 30.555 34.436 -3.881 17635 11066 1 19 . 1 1 44 44 MET H H 44 8.874 8.874 8.561 0.313 17635 11067 1 19 . 1 1 45 45 ILE N N 45 126.237 126.237 121.638 4.599 17635 11068 1 19 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.562 0.240 17635 11069 1 19 . 1 1 45 45 ILE C C 45 176.415 176.415 174.420 1.995 17635 11070 1 19 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.022 -0.806 17635 11071 1 19 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.428 -0.202 17635 11072 1 19 . 1 1 45 45 ILE H H 45 7.730 7.730 8.292 -0.562 17635 11073 1 19 . 1 1 46 46 ASN N N 46 124.735 124.735 124.133 0.602 17635 11074 1 19 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.906 0.035 17635 11075 1 19 . 1 1 46 46 ASN C C 46 176.836 176.836 173.390 3.446 17635 11076 1 19 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.033 -0.472 17635 11077 1 19 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.462 0.008 17635 11078 1 19 . 1 1 46 46 ASN H H 46 8.384 8.384 8.847 -0.463 17635 11079 1 19 . 1 1 47 47 LEU N N 47 122.487 122.487 119.153 3.334 17635 11080 1 19 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.863 -0.148 17635 11081 1 19 . 1 1 47 47 LEU C C 47 174.190 174.190 176.005 -1.815 17635 11082 1 19 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.299 -0.967 17635 11083 1 19 . 1 1 47 47 LEU CB C 47 42.277 42.277 43.873 -1.596 17635 11084 1 19 . 1 1 47 47 LEU H H 47 8.594 8.594 7.928 0.666 17635 11085 1 19 . 1 1 48 48 TYR N N 48 121.842 121.842 124.271 -2.429 17635 11086 1 19 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.717 0.050 17635 11087 1 19 . 1 1 48 48 TYR C C 48 173.649 173.649 175.027 -1.378 17635 11088 1 19 . 1 1 48 48 TYR CA C 48 57.894 57.894 57.526 0.368 17635 11089 1 19 . 1 1 48 48 TYR CB C 48 39.199 39.199 36.837 2.362 17635 11090 1 19 . 1 1 48 48 TYR H H 48 7.666 7.666 8.648 -0.982 17635 11091 1 19 . 1 1 49 49 THR N N 49 116.554 116.554 113.675 2.879 17635 11092 1 19 . 1 1 49 49 THR HA H 49 4.806 4.806 4.513 0.293 17635 11093 1 19 . 1 1 49 49 THR C C 49 176.654 176.654 173.446 3.208 17635 11094 1 19 . 1 1 49 49 THR CA C 49 60.693 60.693 60.126 0.567 17635 11095 1 19 . 1 1 49 49 THR CB C 49 71.437 71.437 71.527 -0.090 17635 11096 1 19 . 1 1 49 49 THR H H 49 8.965 8.965 7.843 1.122 17635 11097 1 19 . 1 1 50 50 ASP N N 50 123.826 123.826 124.812 -0.986 17635 11098 1 19 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.828 -0.204 17635 11099 1 19 . 1 1 50 50 ASP C C 50 173.380 173.380 176.471 -3.091 17635 11100 1 19 . 1 1 50 50 ASP CA C 50 54.088 54.088 53.010 1.079 17635 11101 1 19 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.596 1.271 17635 11102 1 19 . 1 1 50 50 ASP H H 50 8.939 8.939 8.606 0.333 17635 11103 1 19 . 1 1 51 51 ARG N N 51 127.794 127.794 126.289 1.505 17635 11104 1 19 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.322 -0.277 17635 11105 1 19 . 1 1 51 51 ARG C C 51 173.101 173.101 175.958 -2.857 17635 11106 1 19 . 1 1 51 51 ARG CA C 51 58.562 58.562 56.894 1.668 17635 11107 1 19 . 1 1 51 51 ARG CB C 51 30.167 30.167 28.984 1.183 17635 11108 1 19 . 1 1 51 51 ARG H H 51 8.958 8.958 8.712 0.246 17635 11109 1 19 . 1 1 52 52 GLU N N 52 117.542 117.542 118.704 -1.162 17635 11110 1 19 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.280 -0.002 17635 11111 1 19 . 1 1 52 52 GLU C C 52 172.201 172.201 177.360 -5.159 17635 11112 1 19 . 1 1 52 52 GLU CA C 52 58.524 58.524 57.251 1.273 17635 11113 1 19 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.345 0.933 17635 11114 1 19 . 1 1 52 52 GLU H H 52 8.561 8.561 8.186 0.375 17635 11115 1 19 . 1 1 53 53 THR N N 53 107.065 107.065 111.270 -4.205 17635 11116 1 19 . 1 1 53 53 THR HA H 53 4.436 4.436 4.514 -0.078 17635 11117 1 19 . 1 1 53 53 THR C C 53 173.851 173.851 174.738 -0.887 17635 11118 1 19 . 1 1 53 53 THR CA C 53 61.944 61.944 61.696 0.248 17635 11119 1 19 . 1 1 53 53 THR CB C 53 71.197 71.197 69.597 1.600 17635 11120 1 19 . 1 1 53 53 THR H H 53 8.087 8.087 7.644 0.443 17635 11121 1 19 . 1 1 54 54 GLY N N 54 111.295 111.295 111.395 -0.100 17635 11122 1 19 . 1 1 54 54 GLY C C 54 176.747 176.747 174.784 1.963 17635 11123 1 19 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.274 0.429 17635 11124 1 19 . 1 1 54 54 GLY H H 54 8.423 8.423 7.761 0.662 17635 11125 1 19 . 1 1 55 55 LYS N N 55 119.673 119.673 119.842 -0.169 17635 11126 1 19 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.420 -0.067 17635 11127 1 19 . 1 1 55 55 LYS C C 55 173.854 173.854 176.339 -2.485 17635 11128 1 19 . 1 1 55 55 LYS CA C 55 55.842 55.842 54.867 0.975 17635 11129 1 19 . 1 1 55 55 LYS CB C 55 33.821 33.821 32.460 1.361 17635 11130 1 19 . 1 1 55 55 LYS H H 55 7.767 7.767 7.762 0.005 17635 11131 1 19 . 1 1 56 56 LEU N N 56 122.426 122.426 119.754 2.672 17635 11132 1 19 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.050 0.306 17635 11133 1 19 . 1 1 56 56 LEU C C 56 172.534 172.534 177.823 -5.289 17635 11134 1 19 . 1 1 56 56 LEU CA C 56 56.255 56.255 56.308 -0.053 17635 11135 1 19 . 1 1 56 56 LEU CB C 56 41.654 41.654 41.528 0.126 17635 11136 1 19 . 1 1 56 56 LEU H H 56 8.768 8.768 8.003 0.765 17635 11137 1 19 . 1 1 57 57 LYS N N 57 118.264 118.264 120.883 -2.619 17635 11138 1 19 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.476 -0.188 17635 11139 1 19 . 1 1 57 57 LYS C C 57 173.648 173.648 177.419 -3.771 17635 11140 1 19 . 1 1 57 57 LYS CA C 57 56.264 56.264 55.410 0.854 17635 11141 1 19 . 1 1 57 57 LYS CB C 57 34.062 34.062 33.688 0.374 17635 11142 1 19 . 1 1 57 57 LYS H H 57 8.012 8.012 8.542 -0.530 17635 11143 1 19 . 1 1 58 58 GLY N N 58 108.514 108.514 108.546 -0.032 17635 11144 1 19 . 1 1 58 58 GLY C C 58 177.876 177.876 173.024 4.852 17635 11145 1 19 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.209 1.155 17635 11146 1 19 . 1 1 58 58 GLY H H 58 8.334 8.334 8.572 -0.238 17635 11147 1 19 . 1 1 59 59 GLU N N 59 116.119 116.119 119.719 -3.600 17635 11148 1 19 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.273 0.248 17635 11149 1 19 . 1 1 59 59 GLU C C 59 173.860 173.860 174.239 -0.379 17635 11150 1 19 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.431 -2.406 17635 11151 1 19 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.315 0.989 17635 11152 1 19 . 1 1 59 59 GLU H H 59 7.202 7.202 7.969 -0.767 17635 11153 1 19 . 1 1 60 60 ALA N N 60 123.607 123.607 126.747 -3.140 17635 11154 1 19 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.126 0.481 17635 11155 1 19 . 1 1 60 60 ALA C C 60 173.923 173.923 175.126 -1.203 17635 11156 1 19 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.132 -0.189 17635 11157 1 19 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.102 0.957 17635 11158 1 19 . 1 1 60 60 ALA H H 60 8.930 8.930 9.334 -0.404 17635 11159 1 19 . 1 1 61 61 THR N N 61 108.384 108.384 114.999 -6.615 17635 11160 1 19 . 1 1 61 61 THR HA H 61 5.743 5.743 4.685 1.058 17635 11161 1 19 . 1 1 61 61 THR C C 61 176.172 176.172 173.426 2.746 17635 11162 1 19 . 1 1 61 61 THR CA C 61 59.625 59.625 60.378 -0.753 17635 11163 1 19 . 1 1 61 61 THR CB C 61 71.224 71.224 69.138 2.086 17635 11164 1 19 . 1 1 61 61 THR H H 61 8.452 8.452 8.602 -0.150 17635 11165 1 19 . 1 1 62 62 VAL N N 62 120.200 120.200 127.594 -7.394 17635 11166 1 19 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.088 0.156 17635 11167 1 19 . 1 1 62 62 VAL C C 62 175.994 175.994 174.733 1.261 17635 11168 1 19 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.870 -0.444 17635 11169 1 19 . 1 1 62 62 VAL CB C 62 34.685 34.685 32.821 1.864 17635 11170 1 19 . 1 1 62 62 VAL H H 62 8.071 8.071 8.694 -0.623 17635 11171 1 19 . 1 1 63 63 SER N N 63 121.689 121.689 121.352 0.337 17635 11172 1 19 . 1 1 63 63 SER HA H 63 5.261 5.261 4.714 0.547 17635 11173 1 19 . 1 1 63 63 SER C C 63 177.943 177.943 173.600 4.343 17635 11174 1 19 . 1 1 63 63 SER CA C 63 57.662 57.662 56.871 0.791 17635 11175 1 19 . 1 1 63 63 SER CB C 63 64.427 64.427 64.154 0.273 17635 11176 1 19 . 1 1 63 63 SER H H 63 7.695 7.695 8.154 -0.459 17635 11177 1 19 . 1 1 64 64 PHE N N 64 122.640 122.640 126.065 -3.425 17635 11178 1 19 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.743 0.111 17635 11179 1 19 . 1 1 64 64 PHE C C 64 174.605 174.605 175.650 -1.045 17635 11180 1 19 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.216 0.988 17635 11181 1 19 . 1 1 64 64 PHE CB C 64 41.976 41.976 42.667 -0.691 17635 11182 1 19 . 1 1 64 64 PHE H H 64 9.025 9.025 8.501 0.524 17635 11183 1 19 . 1 1 65 65 ASP N N 65 119.943 119.943 121.185 -1.242 17635 11184 1 19 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.502 -0.067 17635 11185 1 19 . 1 1 65 65 ASP C C 65 174.396 174.396 176.316 -1.920 17635 11186 1 19 . 1 1 65 65 ASP CA C 65 57.442 57.442 56.046 1.396 17635 11187 1 19 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.911 0.123 17635 11188 1 19 . 1 1 65 65 ASP H H 65 8.512 8.512 9.071 -0.559 17635 11189 1 19 . 1 1 66 66 ASP N N 66 116.125 116.125 118.804 -2.679 17635 11190 1 19 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.128 0.271 17635 11191 1 19 . 1 1 66 66 ASP C C 66 175.936 175.936 174.691 1.245 17635 11192 1 19 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.532 -0.739 17635 11193 1 19 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.449 0.470 17635 11194 1 19 . 1 1 66 66 ASP H H 66 8.323 8.323 7.961 0.362 17635 11195 1 19 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.320 0.130 17635 11196 1 19 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.581 0.343 17635 11197 1 19 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.345 -0.515 17635 11198 1 19 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.265 0.154 17635 11199 1 19 . 1 1 68 68 PRO C C 68 171.345 171.345 178.944 -7.599 17635 11200 1 19 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.230 0.005 17635 11201 1 19 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.032 -0.035 17635 11202 1 19 . 1 1 69 69 SER N N 69 114.544 114.544 114.461 0.083 17635 11203 1 19 . 1 1 69 69 SER HA H 69 4.036 4.036 4.186 -0.150 17635 11204 1 19 . 1 1 69 69 SER C C 69 176.535 176.535 176.348 0.187 17635 11205 1 19 . 1 1 69 69 SER CA C 69 61.837 61.837 61.910 -0.073 17635 11206 1 19 . 1 1 69 69 SER CB C 69 62.773 62.773 62.897 -0.124 17635 11207 1 19 . 1 1 69 69 SER H H 69 8.004 8.004 8.298 -0.294 17635 11208 1 19 . 1 1 70 70 ALA N N 70 122.649 122.649 124.151 -1.502 17635 11209 1 19 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.527 0.066 17635 11210 1 19 . 1 1 70 70 ALA C C 70 172.686 172.686 179.380 -6.694 17635 11211 1 19 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.310 -0.274 17635 11212 1 19 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.223 -0.359 17635 11213 1 19 . 1 1 70 70 ALA H H 70 7.383 7.383 7.671 -0.288 17635 11214 1 19 . 1 1 71 71 LYS N N 71 116.308 116.308 119.655 -3.347 17635 11215 1 19 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.706 0.069 17635 11216 1 19 . 1 1 71 71 LYS C C 71 172.333 172.333 178.406 -6.073 17635 11217 1 19 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.552 0.450 17635 11218 1 19 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.563 0.879 17635 11219 1 19 . 1 1 71 71 LYS H H 71 7.159 7.159 7.601 -0.442 17635 11220 1 19 . 1 1 72 72 ALA N N 72 119.806 119.806 121.061 -1.255 17635 11221 1 19 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.440 -0.274 17635 11222 1 19 . 1 1 72 72 ALA C C 72 170.530 170.530 179.839 -9.309 17635 11223 1 19 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.736 -0.021 17635 11224 1 19 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.231 -0.411 17635 11225 1 19 . 1 1 72 72 ALA H H 72 7.924 7.924 8.186 -0.262 17635 11226 1 19 . 1 1 73 73 ALA N N 73 120.524 120.524 121.473 -0.949 17635 11227 1 19 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.329 -0.050 17635 11228 1 19 . 1 1 73 73 ALA C C 73 171.039 171.039 180.194 -9.155 17635 11229 1 19 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.867 0.512 17635 11230 1 19 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.667 0.464 17635 11231 1 19 . 1 1 73 73 ALA H H 73 8.104 8.104 7.816 0.288 17635 11232 1 19 . 1 1 74 74 ILE N N 74 119.875 119.875 118.956 0.919 17635 11233 1 19 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.802 -0.388 17635 11234 1 19 . 1 1 74 74 ILE C C 74 172.435 172.435 177.530 -5.095 17635 11235 1 19 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.237 0.607 17635 11236 1 19 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.715 1.028 17635 11237 1 19 . 1 1 74 74 ILE H H 74 7.574 7.574 8.184 -0.610 17635 11238 1 19 . 1 1 75 75 ASP N N 75 117.867 117.867 118.063 -0.196 17635 11239 1 19 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.427 -0.116 17635 11240 1 19 . 1 1 75 75 ASP C C 75 172.054 172.054 176.553 -4.499 17635 11241 1 19 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.492 0.669 17635 11242 1 19 . 1 1 75 75 ASP CB C 75 40.531 40.531 40.923 -0.392 17635 11243 1 19 . 1 1 75 75 ASP H H 75 7.937 7.937 7.865 0.072 17635 11244 1 19 . 1 1 76 76 TRP N N 76 117.313 117.313 120.697 -3.384 17635 11245 1 19 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.548 -0.192 17635 11246 1 19 . 1 1 76 76 TRP C C 76 173.272 173.272 176.935 -3.663 17635 11247 1 19 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.269 1.193 17635 11248 1 19 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.757 1.020 17635 11249 1 19 . 1 1 76 76 TRP H H 76 8.475 8.475 8.043 0.432 17635 11250 1 19 . 1 1 77 77 PHE N N 77 112.019 112.019 118.080 -6.061 17635 11251 1 19 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.163 0.485 17635 11252 1 19 . 1 1 77 77 PHE C C 77 173.747 173.747 176.042 -2.295 17635 11253 1 19 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.382 -0.461 17635 11254 1 19 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.291 2.439 17635 11255 1 19 . 1 1 77 77 PHE H H 77 8.488 8.488 7.763 0.725 17635 11256 1 19 . 1 1 78 78 ASP N N 78 118.408 118.408 118.811 -0.403 17635 11257 1 19 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.529 -0.065 17635 11258 1 19 . 1 1 78 78 ASP C C 78 172.542 172.542 176.438 -3.896 17635 11259 1 19 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.074 3.616 17635 11260 1 19 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.671 2.215 17635 11261 1 19 . 1 1 78 78 ASP H H 78 7.978 7.978 8.466 -0.488 17635 11262 1 19 . 1 1 79 79 GLY N N 79 115.548 115.548 103.978 11.570 17635 11263 1 19 . 1 1 79 79 GLY C C 79 175.680 175.680 173.470 2.210 17635 11264 1 19 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.086 0.986 17635 11265 1 19 . 1 1 79 79 GLY H H 79 8.615 8.615 8.512 0.103 17635 11266 1 19 . 1 1 80 80 LYS N N 80 120.271 120.271 117.940 2.331 17635 11267 1 19 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.506 -0.044 17635 11268 1 19 . 1 1 80 80 LYS C C 80 175.853 175.853 175.077 0.776 17635 11269 1 19 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.685 0.465 17635 11270 1 19 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.164 -1.738 17635 11271 1 19 . 1 1 80 80 LYS H H 80 8.013 8.013 7.930 0.083 17635 11272 1 19 . 1 1 81 81 GLU N N 81 115.765 115.765 118.015 -2.250 17635 11273 1 19 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.002 -0.304 17635 11274 1 19 . 1 1 81 81 GLU C C 81 173.263 173.263 175.607 -2.344 17635 11275 1 19 . 1 1 81 81 GLU CA C 81 55.924 55.924 54.939 0.985 17635 11276 1 19 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.271 0.771 17635 11277 1 19 . 1 1 81 81 GLU H H 81 8.201 8.201 8.500 -0.299 17635 11278 1 19 . 1 1 82 82 PHE N N 82 127.080 127.080 124.811 2.269 17635 11279 1 19 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.313 0.183 17635 11280 1 19 . 1 1 82 82 PHE C C 82 175.349 175.349 175.456 -0.107 17635 11281 1 19 . 1 1 82 82 PHE CA C 82 56.716 56.716 57.665 -0.949 17635 11282 1 19 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.351 2.643 17635 11283 1 19 . 1 1 82 82 PHE H H 82 9.162 9.162 9.112 0.050 17635 11284 1 19 . 1 1 83 83 SER N N 83 125.136 125.136 119.140 5.996 17635 11285 1 19 . 1 1 83 83 SER HA H 83 3.803 3.803 4.054 -0.251 17635 11286 1 19 . 1 1 83 83 SER C C 83 175.543 175.543 174.426 1.117 17635 11287 1 19 . 1 1 83 83 SER CA C 83 58.371 58.371 59.234 -0.863 17635 11288 1 19 . 1 1 83 83 SER CB C 83 62.519 62.519 62.127 0.392 17635 11289 1 19 . 1 1 83 83 SER H H 83 9.193 9.193 8.841 0.352 17635 11290 1 19 . 1 1 84 84 GLY N N 84 103.581 103.581 104.953 -1.372 17635 11291 1 19 . 1 1 84 84 GLY C C 84 177.188 177.188 173.715 3.473 17635 11292 1 19 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.940 0.112 17635 11293 1 19 . 1 1 84 84 GLY H H 84 8.446 8.446 8.062 0.384 17635 11294 1 19 . 1 1 85 85 ASN N N 85 119.051 119.051 121.409 -2.358 17635 11295 1 19 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.150 0.184 17635 11296 1 19 . 1 1 85 85 ASN C C 85 178.020 178.020 172.683 5.337 17635 11297 1 19 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.037 -0.566 17635 11298 1 19 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.686 2.431 17635 11299 1 19 . 1 1 85 85 ASN H H 85 7.762 7.762 8.192 -0.430 17635 11300 1 19 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.582 -0.915 17635 11301 1 19 . 1 1 86 86 PRO C C 86 173.474 173.474 176.395 -2.921 17635 11302 1 19 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.351 0.359 17635 11303 1 19 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.989 -1.119 17635 11304 1 19 . 1 1 87 87 ILE N N 87 117.270 117.270 116.174 1.096 17635 11305 1 19 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.290 -0.144 17635 11306 1 19 . 1 1 87 87 ILE C C 87 174.495 174.495 174.498 -0.003 17635 11307 1 19 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.656 0.835 17635 11308 1 19 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.706 -1.035 17635 11309 1 19 . 1 1 87 87 ILE H H 87 8.469 8.469 9.276 -0.807 17635 11310 1 19 . 1 1 88 88 LYS N N 88 122.271 122.271 120.651 1.620 17635 11311 1 19 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.829 0.363 17635 11312 1 19 . 1 1 88 88 LYS C C 88 174.393 174.393 174.989 -0.596 17635 11313 1 19 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.352 -1.214 17635 11314 1 19 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.410 0.639 17635 11315 1 19 . 1 1 88 88 LYS H H 88 8.353 8.353 8.250 0.103 17635 11316 1 19 . 1 1 89 89 VAL N N 89 125.661 125.661 126.622 -0.961 17635 11317 1 19 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.786 0.177 17635 11318 1 19 . 1 1 89 89 VAL C C 89 177.160 177.160 175.856 1.304 17635 11319 1 19 . 1 1 89 89 VAL CA C 89 61.361 61.361 62.452 -1.091 17635 11320 1 19 . 1 1 89 89 VAL CB C 89 34.770 34.770 33.066 1.704 17635 11321 1 19 . 1 1 89 89 VAL H H 89 9.414 9.414 8.567 0.847 17635 11322 1 19 . 1 1 90 90 SER N N 90 119.538 119.538 120.495 -0.957 17635 11323 1 19 . 1 1 90 90 SER HA H 90 4.710 4.710 4.883 -0.173 17635 11324 1 19 . 1 1 90 90 SER C C 90 176.533 176.533 173.743 2.790 17635 11325 1 19 . 1 1 90 90 SER CA C 90 56.936 56.936 56.220 0.716 17635 11326 1 19 . 1 1 90 90 SER CB C 90 66.470 66.470 65.047 1.423 17635 11327 1 19 . 1 1 90 90 SER H H 90 8.945 8.945 8.253 0.692 17635 11328 1 19 . 1 1 91 91 PHE N N 91 120.115 120.115 122.650 -2.535 17635 11329 1 19 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.711 -0.038 17635 11330 1 19 . 1 1 91 91 PHE C C 91 173.349 173.349 174.463 -1.114 17635 11331 1 19 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.023 5.132 17635 11332 1 19 . 1 1 91 91 PHE CB C 91 39.503 39.503 38.630 0.873 17635 11333 1 19 . 1 1 91 91 PHE H H 91 8.919 8.919 8.682 0.237 17635 11334 1 19 . 1 1 92 92 ALA N N 92 124.386 124.386 123.392 0.994 17635 11335 1 19 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.248 0.108 17635 11336 1 19 . 1 1 92 92 ALA C C 92 172.984 172.984 175.882 -2.898 17635 11337 1 19 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.890 -0.792 17635 11338 1 19 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.477 0.929 17635 11339 1 19 . 1 1 92 92 ALA H H 92 8.563 8.563 7.893 0.670 17635 11340 1 19 . 1 1 93 93 THR N N 93 116.073 116.073 112.268 3.805 17635 11341 1 19 . 1 1 93 93 THR HA H 93 4.208 4.208 4.519 -0.311 17635 11342 1 19 . 1 1 93 93 THR C C 93 176.032 176.032 174.230 1.802 17635 11343 1 19 . 1 1 93 93 THR CA C 93 62.255 62.255 61.010 1.246 17635 11344 1 19 . 1 1 93 93 THR CB C 93 69.708 69.708 70.301 -0.593 17635 11345 1 19 . 1 1 93 93 THR H H 93 8.312 8.312 8.196 0.116 17635 11346 1 19 . 1 1 94 94 ARG N N 94 124.359 124.359 118.569 5.790 17635 11347 1 19 . 1 1 94 94 ARG HA H 94 4.337 4.337 3.993 0.344 17635 11348 1 19 . 1 1 94 94 ARG C C 94 174.426 174.426 175.939 -1.513 17635 11349 1 19 . 1 1 94 94 ARG CA C 94 56.055 56.055 57.024 -0.969 17635 11350 1 19 . 1 1 94 94 ARG CB C 94 30.911 30.911 29.617 1.294 17635 11351 1 19 . 1 1 94 94 ARG H H 94 8.493 8.493 8.533 -0.040 17635 11352 1 19 . 1 1 95 95 ARG N N 95 122.515 122.515 118.612 3.903 17635 11353 1 19 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.531 -0.303 17635 11354 1 19 . 1 1 95 95 ARG C C 95 174.306 174.306 175.815 -1.509 17635 11355 1 19 . 1 1 95 95 ARG CA C 95 56.142 56.142 55.060 1.082 17635 11356 1 19 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.935 1.031 17635 11357 1 19 . 1 1 95 95 ARG H H 95 8.343 8.343 8.401 -0.058 17635 11358 1 19 . 1 1 96 96 ALA N N 96 125.127 125.127 124.184 0.943 17635 11359 1 19 . 1 1 96 96 ALA HA H 96 4.209 4.209 3.928 0.281 17635 11360 1 19 . 1 1 96 96 ALA C C 96 173.226 173.226 177.102 -3.876 17635 11361 1 19 . 1 1 96 96 ALA CA C 96 52.770 52.770 53.512 -0.742 17635 11362 1 19 . 1 1 96 96 ALA CB C 96 19.193 19.193 17.925 1.268 17635 11363 1 19 . 1 1 96 96 ALA H H 96 8.402 8.402 8.839 -0.437 17635 11364 1 19 . 1 1 97 97 ASP N N 97 118.483 118.483 117.116 1.367 17635 11365 1 19 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.292 0.206 17635 11366 1 19 . 1 1 97 97 ASP C C 97 174.302 174.302 174.717 -0.415 17635 11367 1 19 . 1 1 97 97 ASP CA C 97 54.091 54.091 55.239 -1.148 17635 11368 1 19 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.665 0.242 17635 11369 1 19 . 1 1 97 97 ASP H H 97 8.206 8.206 7.943 0.263 17635 11370 1 19 . 1 1 98 98 PHE N N 98 120.321 120.321 117.164 3.157 17635 11371 1 19 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.170 0.320 17635 11372 1 19 . 1 1 98 98 PHE C C 98 174.878 174.878 173.214 1.664 17635 11373 1 19 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.364 -0.204 17635 11374 1 19 . 1 1 98 98 PHE CB C 98 39.303 39.303 36.266 3.037 17635 11375 1 19 . 1 1 98 98 PHE H H 98 7.990 7.990 8.450 -0.460 17635 11376 1 19 . 1 1 99 99 ASN N N 99 120.016 120.016 122.437 -2.421 17635 11377 1 19 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.546 0.063 17635 11378 1 19 . 1 1 99 99 ASN C C 99 175.348 175.348 173.923 1.425 17635 11379 1 19 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.398 -0.085 17635 11380 1 19 . 1 1 99 99 ASN CB C 99 38.727 38.727 39.717 -0.990 17635 11381 1 19 . 1 1 99 99 ASN H H 99 8.336 8.336 8.646 -0.310 17635 11382 1 19 . 1 1 100 100 ARG N N 100 121.374 121.374 124.696 -3.322 17635 11383 1 19 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.673 -0.400 17635 11384 1 19 . 1 1 100 100 ARG C C 100 173.627 173.627 176.738 -3.111 17635 11385 1 19 . 1 1 100 100 ARG CA C 100 56.492 56.492 55.307 1.185 17635 11386 1 19 . 1 1 100 100 ARG CB C 100 30.519 30.519 31.097 -0.578 17635 11387 1 19 . 1 1 100 100 ARG H H 100 8.181 8.181 8.514 -0.333 17635 11388 1 19 . 1 1 101 101 GLY N N 101 109.586 109.586 114.654 -5.068 17635 11389 1 19 . 1 1 101 101 GLY C C 101 175.739 175.739 174.849 0.890 17635 11390 1 19 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.939 0.441 17635 11391 1 19 . 1 1 101 101 GLY H H 101 8.413 8.413 8.833 -0.420 17635 11392 1 19 . 1 1 102 102 GLY N N 102 108.692 108.692 112.154 -3.462 17635 11393 1 19 . 1 1 102 102 GLY C C 102 176.286 176.286 174.555 1.731 17635 11394 1 19 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.389 -0.051 17635 11395 1 19 . 1 1 102 102 GLY H H 102 8.281 8.281 8.249 0.032 17635 11396 1 19 . 1 1 103 103 GLY N N 103 108.844 108.844 107.637 1.207 17635 11397 1 19 . 1 1 103 103 GLY C C 103 175.798 175.798 173.132 2.666 17635 11398 1 19 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.332 1.014 17635 11399 1 19 . 1 1 103 103 GLY H H 103 8.364 8.364 7.853 0.511 17635 11400 1 19 . 1 1 104 104 ASN N N 104 118.527 118.527 117.700 0.827 17635 11401 1 19 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.854 -0.136 17635 11402 1 19 . 1 1 104 104 ASN C C 104 174.547 174.547 175.843 -1.296 17635 11403 1 19 . 1 1 104 104 ASN CA C 104 53.209 53.209 52.938 0.271 17635 11404 1 19 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.041 -0.162 17635 11405 1 19 . 1 1 104 104 ASN H H 104 8.438 8.438 8.684 -0.246 17635 11406 1 19 . 1 1 105 105 GLY N N 105 109.166 109.166 107.776 1.390 17635 11407 1 19 . 1 1 105 105 GLY C C 105 176.074 176.074 172.848 3.226 17635 11408 1 19 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.392 1.210 17635 11409 1 19 . 1 1 105 105 GLY H H 105 8.477 8.477 7.669 0.808 17635 11410 1 19 . 1 1 106 106 ARG N N 106 120.341 120.341 119.598 0.743 17635 11411 1 19 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.786 -0.435 17635 11412 1 19 . 1 1 106 106 ARG C C 106 173.491 173.491 175.239 -1.748 17635 11413 1 19 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.411 0.816 17635 11414 1 19 . 1 1 106 106 ARG CB C 106 30.629 30.629 31.047 -0.418 17635 11415 1 19 . 1 1 106 106 ARG H H 106 8.244 8.244 8.468 -0.224 17635 11416 1 19 . 1 1 107 107 GLY N N 107 109.856 109.856 109.757 0.099 17635 11417 1 19 . 1 1 107 107 GLY C C 107 175.834 175.834 173.951 1.883 17635 11418 1 19 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.499 0.942 17635 11419 1 19 . 1 1 107 107 GLY H H 107 8.522 8.522 8.287 0.235 17635 11420 1 20 . 1 1 2 2 GLN N N 2 121.692 121.692 120.380 1.312 17635 11421 1 20 . 1 1 2 2 GLN HA H 2 4.266 4.266 3.971 0.295 17635 11422 1 20 . 1 1 2 2 GLN C C 2 175.248 175.248 175.341 -0.093 17635 11423 1 20 . 1 1 2 2 GLN CA C 2 55.996 55.996 56.693 -0.697 17635 11424 1 20 . 1 1 2 2 GLN CB C 2 29.639 29.639 28.213 1.426 17635 11425 1 20 . 1 1 2 2 GLN H H 2 8.621 8.621 8.591 0.030 17635 11426 1 20 . 1 1 3 3 ASP N N 3 121.801 121.801 120.911 0.890 17635 11427 1 20 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.491 0.077 17635 11428 1 20 . 1 1 3 3 ASP C C 3 174.336 174.336 176.642 -2.306 17635 11429 1 20 . 1 1 3 3 ASP CA C 3 54.062 54.062 55.659 -1.597 17635 11430 1 20 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.986 0.085 17635 11431 1 20 . 1 1 3 3 ASP H H 3 8.436 8.436 8.730 -0.294 17635 11432 1 20 . 1 1 4 4 ASN N N 4 120.292 120.292 118.320 1.972 17635 11433 1 20 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.798 -0.161 17635 11434 1 20 . 1 1 4 4 ASN C C 4 174.415 174.415 174.979 -0.564 17635 11435 1 20 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.417 0.444 17635 11436 1 20 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.599 -0.065 17635 11437 1 20 . 1 1 4 4 ASN H H 4 8.528 8.528 8.159 0.369 17635 11438 1 20 . 1 1 5 5 SER N N 5 117.091 117.091 118.119 -1.028 17635 11439 1 20 . 1 1 5 5 SER HA H 5 4.163 4.163 4.378 -0.215 17635 11440 1 20 . 1 1 5 5 SER C C 5 176.370 176.370 174.434 1.936 17635 11441 1 20 . 1 1 5 5 SER CA C 5 60.846 60.846 60.619 0.227 17635 11442 1 20 . 1 1 5 5 SER CB C 5 63.136 63.136 63.473 -0.337 17635 11443 1 20 . 1 1 5 5 SER H H 5 8.470 8.470 8.404 0.066 17635 11444 1 20 . 1 1 6 6 ASP N N 6 119.436 119.436 118.401 1.035 17635 11445 1 20 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.693 0.002 17635 11446 1 20 . 1 1 6 6 ASP C C 6 175.048 175.048 174.916 0.132 17635 11447 1 20 . 1 1 6 6 ASP CA C 6 53.094 53.094 53.837 -0.743 17635 11448 1 20 . 1 1 6 6 ASP CB C 6 40.935 40.935 41.566 -0.631 17635 11449 1 20 . 1 1 6 6 ASP H H 6 8.218 8.218 8.373 -0.155 17635 11450 1 20 . 1 1 7 7 ASN N N 7 119.696 119.696 115.817 3.879 17635 11451 1 20 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.413 0.215 17635 11452 1 20 . 1 1 7 7 ASN C C 7 176.539 176.539 175.073 1.466 17635 11453 1 20 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.783 -0.625 17635 11454 1 20 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.490 0.369 17635 11455 1 20 . 1 1 7 7 ASN H H 7 7.734 7.734 8.038 -0.304 17635 11456 1 20 . 1 1 8 8 ASN N N 8 119.436 119.436 116.415 3.021 17635 11457 1 20 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.426 0.442 17635 11458 1 20 . 1 1 8 8 ASN C C 8 175.327 175.327 175.763 -0.436 17635 11459 1 20 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.205 -1.001 17635 11460 1 20 . 1 1 8 8 ASN CB C 8 38.495 38.495 38.474 0.021 17635 11461 1 20 . 1 1 8 8 ASN H H 8 8.350 8.350 8.697 -0.347 17635 11462 1 20 . 1 1 9 9 THR N N 9 118.650 118.650 114.602 4.048 17635 11463 1 20 . 1 1 9 9 THR HA H 9 5.557 5.557 4.590 0.967 17635 11464 1 20 . 1 1 9 9 THR C C 9 177.117 177.117 173.731 3.386 17635 11465 1 20 . 1 1 9 9 THR CA C 9 62.314 62.314 63.692 -1.378 17635 11466 1 20 . 1 1 9 9 THR CB C 9 71.225 71.225 69.880 1.345 17635 11467 1 20 . 1 1 9 9 THR H H 9 8.428 8.428 7.480 0.948 17635 11468 1 20 . 1 1 10 10 ILE N N 10 118.556 118.556 114.498 4.058 17635 11469 1 20 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.680 0.485 17635 11470 1 20 . 1 1 10 10 ILE C C 10 176.837 176.837 173.838 2.999 17635 11471 1 20 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.967 0.331 17635 11472 1 20 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.972 -2.092 17635 11473 1 20 . 1 1 10 10 ILE H H 10 8.770 8.770 8.438 0.332 17635 11474 1 20 . 1 1 11 11 PHE N N 11 123.798 123.798 120.442 3.356 17635 11475 1 20 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.879 0.541 17635 11476 1 20 . 1 1 11 11 PHE C C 11 177.066 177.066 174.226 2.840 17635 11477 1 20 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.677 -0.315 17635 11478 1 20 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.946 -0.078 17635 11479 1 20 . 1 1 11 11 PHE H H 11 9.548 9.548 8.064 1.484 17635 11480 1 20 . 1 1 12 12 VAL N N 12 127.993 127.993 127.372 0.621 17635 11481 1 20 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.565 0.393 17635 11482 1 20 . 1 1 12 12 VAL C C 12 176.965 176.965 174.925 2.040 17635 11483 1 20 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.627 -1.792 17635 11484 1 20 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.525 2.275 17635 11485 1 20 . 1 1 12 12 VAL H H 12 8.940 8.940 9.074 -0.134 17635 11486 1 20 . 1 1 13 13 GLN N N 13 122.289 122.289 127.429 -5.140 17635 11487 1 20 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.912 -0.133 17635 11488 1 20 . 1 1 13 13 GLN C C 13 175.631 175.631 176.234 -0.603 17635 11489 1 20 . 1 1 13 13 GLN CA C 13 54.110 54.110 53.672 0.438 17635 11490 1 20 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.378 3.754 17635 11491 1 20 . 1 1 13 13 GLN H H 13 8.747 8.747 8.259 0.488 17635 11492 1 20 . 1 1 14 14 GLY N N 14 109.212 109.212 112.749 -3.537 17635 11493 1 20 . 1 1 14 14 GLY C C 14 175.436 175.436 173.405 2.031 17635 11494 1 20 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.323 0.107 17635 11495 1 20 . 1 1 14 14 GLY H H 14 8.236 8.236 9.146 -0.910 17635 11496 1 20 . 1 1 15 15 LEU N N 15 117.824 117.824 120.298 -2.474 17635 11497 1 20 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.495 -0.789 17635 11498 1 20 . 1 1 15 15 LEU C C 15 174.111 174.111 176.273 -2.162 17635 11499 1 20 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.508 0.210 17635 11500 1 20 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.878 0.555 17635 11501 1 20 . 1 1 15 15 LEU H H 15 8.442 8.442 7.249 1.193 17635 11502 1 20 . 1 1 16 16 GLY N N 16 105.063 105.063 105.527 -0.464 17635 11503 1 20 . 1 1 16 16 GLY C C 16 177.771 177.771 173.702 4.069 17635 11504 1 20 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.375 -0.281 17635 11505 1 20 . 1 1 16 16 GLY H H 16 8.006 8.006 7.785 0.221 17635 11506 1 20 . 1 1 17 17 GLU N N 17 113.781 113.781 118.974 -5.193 17635 11507 1 20 . 1 1 17 17 GLU HA H 17 4.119 4.119 3.783 0.336 17635 11508 1 20 . 1 1 17 17 GLU C C 17 173.937 173.937 175.245 -1.308 17635 11509 1 20 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.959 0.322 17635 11510 1 20 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.267 1.169 17635 11511 1 20 . 1 1 17 17 GLU H H 17 8.134 8.134 8.533 -0.399 17635 11512 1 20 . 1 1 18 18 ASN N N 18 116.660 116.660 113.862 2.798 17635 11513 1 20 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.570 0.371 17635 11514 1 20 . 1 1 18 18 ASN C C 18 175.900 175.900 173.323 2.577 17635 11515 1 20 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.575 -0.097 17635 11516 1 20 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.102 -0.617 17635 11517 1 20 . 1 1 18 18 ASN H H 18 8.407 8.407 7.778 0.629 17635 11518 1 20 . 1 1 19 19 VAL N N 19 118.323 118.323 122.704 -4.381 17635 11519 1 20 . 1 1 19 19 VAL HA H 19 4.152 4.152 4.089 0.063 17635 11520 1 20 . 1 1 19 19 VAL C C 19 177.655 177.655 175.263 2.392 17635 11521 1 20 . 1 1 19 19 VAL CA C 19 61.877 61.877 62.779 -0.902 17635 11522 1 20 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.813 1.700 17635 11523 1 20 . 1 1 19 19 VAL H H 19 6.855 6.855 7.818 -0.963 17635 11524 1 20 . 1 1 20 20 THR N N 20 111.636 111.636 120.137 -8.501 17635 11525 1 20 . 1 1 20 20 THR HA H 20 4.719 4.719 4.567 0.152 17635 11526 1 20 . 1 1 20 20 THR C C 20 175.266 175.266 174.749 0.517 17635 11527 1 20 . 1 1 20 20 THR CA C 20 58.698 58.698 60.488 -1.790 17635 11528 1 20 . 1 1 20 20 THR CB C 20 72.948 72.948 71.851 1.097 17635 11529 1 20 . 1 1 20 20 THR H H 20 7.328 7.328 7.856 -0.528 17635 11530 1 20 . 1 1 21 21 ILE N N 21 122.147 122.147 124.025 -1.878 17635 11531 1 20 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.843 -0.325 17635 11532 1 20 . 1 1 21 21 ILE C C 21 173.198 173.198 177.881 -4.683 17635 11533 1 20 . 1 1 21 21 ILE CA C 21 65.772 65.772 63.486 2.286 17635 11534 1 20 . 1 1 21 21 ILE CB C 21 37.583 37.583 36.670 0.913 17635 11535 1 20 . 1 1 21 21 ILE H H 21 9.074 9.074 8.664 0.410 17635 11536 1 20 . 1 1 22 22 GLU N N 22 118.154 118.154 120.057 -1.903 17635 11537 1 20 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.051 -0.065 17635 11538 1 20 . 1 1 22 22 GLU C C 22 171.799 171.799 179.161 -7.362 17635 11539 1 20 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.535 1.078 17635 11540 1 20 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.672 0.119 17635 11541 1 20 . 1 1 22 22 GLU H H 22 8.814 8.814 8.749 0.065 17635 11542 1 20 . 1 1 23 23 SER N N 23 115.921 115.921 115.126 0.795 17635 11543 1 20 . 1 1 23 23 SER HA H 23 4.384 4.384 4.341 0.043 17635 11544 1 20 . 1 1 23 23 SER C C 23 172.447 172.447 176.921 -4.474 17635 11545 1 20 . 1 1 23 23 SER CA C 23 61.239 61.239 61.265 -0.026 17635 11546 1 20 . 1 1 23 23 SER CB C 23 62.838 62.838 62.853 -0.015 17635 11547 1 20 . 1 1 23 23 SER H H 23 8.236 8.236 8.173 0.063 17635 11548 1 20 . 1 1 24 24 VAL N N 24 124.867 124.867 121.872 2.995 17635 11549 1 20 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.219 -0.471 17635 11550 1 20 . 1 1 24 24 VAL C C 24 173.016 173.016 177.639 -4.623 17635 11551 1 20 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.462 0.792 17635 11552 1 20 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.994 -0.461 17635 11553 1 20 . 1 1 24 24 VAL H H 24 7.973 7.973 8.155 -0.182 17635 11554 1 20 . 1 1 25 25 ALA N N 25 123.198 123.198 121.330 1.868 17635 11555 1 20 . 1 1 25 25 ALA HA H 25 3.899 3.899 3.964 -0.065 17635 11556 1 20 . 1 1 25 25 ALA C C 25 171.061 171.061 178.623 -7.562 17635 11557 1 20 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.799 0.896 17635 11558 1 20 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.358 -0.620 17635 11559 1 20 . 1 1 25 25 ALA H H 25 8.695 8.695 8.516 0.179 17635 11560 1 20 . 1 1 26 26 ASP N N 26 115.503 115.503 118.563 -3.060 17635 11561 1 20 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.488 -0.165 17635 11562 1 20 . 1 1 26 26 ASP C C 26 173.108 173.108 178.540 -5.432 17635 11563 1 20 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.920 0.403 17635 11564 1 20 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.104 -0.052 17635 11565 1 20 . 1 1 26 26 ASP H H 26 8.312 8.312 7.967 0.345 17635 11566 1 20 . 1 1 27 27 TYR N N 27 119.224 119.224 118.977 0.247 17635 11567 1 20 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.536 -0.336 17635 11568 1 20 . 1 1 27 27 TYR C C 27 172.908 172.908 176.708 -3.800 17635 11569 1 20 . 1 1 27 27 TYR CA C 27 61.016 61.016 59.704 1.312 17635 11570 1 20 . 1 1 27 27 TYR CB C 27 39.932 39.932 38.835 1.097 17635 11571 1 20 . 1 1 27 27 TYR H H 27 7.533 7.533 7.839 -0.306 17635 11572 1 20 . 1 1 28 28 PHE N N 28 112.595 112.595 118.665 -6.070 17635 11573 1 20 . 1 1 28 28 PHE HA H 28 4.330 4.330 3.997 0.333 17635 11574 1 20 . 1 1 28 28 PHE C C 28 173.082 173.082 175.518 -2.436 17635 11575 1 20 . 1 1 28 28 PHE CA C 28 61.784 61.784 57.678 4.106 17635 11576 1 20 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.361 1.642 17635 11577 1 20 . 1 1 28 28 PHE H H 28 7.974 7.974 7.693 0.281 17635 11578 1 20 . 1 1 29 29 LYS N N 29 118.820 118.820 118.151 0.669 17635 11579 1 20 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.744 0.173 17635 11580 1 20 . 1 1 29 29 LYS C C 29 173.682 173.682 176.988 -3.306 17635 11581 1 20 . 1 1 29 29 LYS CA C 29 58.280 58.280 56.546 1.734 17635 11582 1 20 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.822 -0.531 17635 11583 1 20 . 1 1 29 29 LYS H H 29 8.325 8.325 7.474 0.851 17635 11584 1 20 . 1 1 30 30 GLN N N 30 116.232 116.232 117.676 -1.444 17635 11585 1 20 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.301 -0.166 17635 11586 1 20 . 1 1 30 30 GLN C C 30 173.790 173.790 177.420 -3.630 17635 11587 1 20 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.563 -0.017 17635 11588 1 20 . 1 1 30 30 GLN CB C 30 29.898 29.898 29.136 0.762 17635 11589 1 20 . 1 1 30 30 GLN H H 30 7.518 7.518 8.008 -0.490 17635 11590 1 20 . 1 1 31 31 ILE N N 31 116.489 116.489 118.920 -2.431 17635 11591 1 20 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.121 0.118 17635 11592 1 20 . 1 1 31 31 ILE C C 31 175.599 175.599 176.072 -0.473 17635 11593 1 20 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.959 -3.738 17635 11594 1 20 . 1 1 31 31 ILE CB C 31 40.334 40.334 39.024 1.310 17635 11595 1 20 . 1 1 31 31 ILE H H 31 7.809 7.809 8.505 -0.696 17635 11596 1 20 . 1 1 32 32 GLY N N 32 107.416 107.416 105.134 2.282 17635 11597 1 20 . 1 1 32 32 GLY C C 32 180.182 180.182 172.133 8.049 17635 11598 1 20 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.964 0.030 17635 11599 1 20 . 1 1 32 32 GLY H H 32 7.344 7.344 7.563 -0.219 17635 11600 1 20 . 1 1 33 33 ILE N N 33 117.784 117.784 120.901 -3.117 17635 11601 1 20 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.444 -0.355 17635 11602 1 20 . 1 1 33 33 ILE C C 33 173.301 173.301 175.347 -2.046 17635 11603 1 20 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.693 0.948 17635 11604 1 20 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.374 -0.715 17635 11605 1 20 . 1 1 33 33 ILE H H 33 8.173 8.173 7.989 0.184 17635 11606 1 20 . 1 1 34 34 ILE N N 34 131.781 131.781 125.039 6.742 17635 11607 1 20 . 1 1 34 34 ILE HA H 34 3.787 3.787 3.721 0.066 17635 11608 1 20 . 1 1 34 34 ILE C C 34 174.663 174.663 175.229 -0.566 17635 11609 1 20 . 1 1 34 34 ILE CA C 34 61.370 61.370 59.966 1.404 17635 11610 1 20 . 1 1 34 34 ILE CB C 34 37.995 37.995 39.107 -1.112 17635 11611 1 20 . 1 1 34 34 ILE H H 34 8.687 8.687 8.293 0.394 17635 11612 1 20 . 1 1 35 35 LYS N N 35 130.372 130.372 128.164 2.208 17635 11613 1 20 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.043 0.041 17635 11614 1 20 . 1 1 35 35 LYS C C 35 175.376 175.376 176.181 -0.805 17635 11615 1 20 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.560 0.913 17635 11616 1 20 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.357 2.307 17635 11617 1 20 . 1 1 35 35 LYS H H 35 8.680 8.680 8.568 0.112 17635 11618 1 20 . 1 1 36 36 THR N N 36 118.312 118.312 121.177 -2.865 17635 11619 1 20 . 1 1 36 36 THR HA H 36 4.415 4.415 4.225 0.190 17635 11620 1 20 . 1 1 36 36 THR C C 36 176.394 176.394 174.148 2.246 17635 11621 1 20 . 1 1 36 36 THR CA C 36 61.340 61.340 63.191 -1.851 17635 11622 1 20 . 1 1 36 36 THR CB C 36 70.809 70.809 69.594 1.215 17635 11623 1 20 . 1 1 36 36 THR H H 36 8.456 8.456 7.950 0.506 17635 11624 1 20 . 1 1 37 37 ASN N N 37 124.092 124.092 121.844 2.248 17635 11625 1 20 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.858 -0.328 17635 11626 1 20 . 1 1 37 37 ASN C C 37 174.235 174.235 175.713 -1.478 17635 11627 1 20 . 1 1 37 37 ASN CA C 37 53.064 53.064 51.251 1.813 17635 11628 1 20 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.823 -0.896 17635 11629 1 20 . 1 1 37 37 ASN H H 37 8.794 8.794 8.923 -0.129 17635 11630 1 20 . 1 1 38 38 LYS N N 38 127.969 127.969 125.912 2.057 17635 11631 1 20 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.041 -0.037 17635 11632 1 20 . 1 1 38 38 LYS C C 38 172.702 172.702 177.023 -4.321 17635 11633 1 20 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.576 -0.118 17635 11634 1 20 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.391 0.776 17635 11635 1 20 . 1 1 38 38 LYS H H 38 8.962 8.962 8.781 0.181 17635 11636 1 20 . 1 1 39 39 LYS N N 39 117.413 117.413 117.815 -0.402 17635 11637 1 20 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.348 -0.090 17635 11638 1 20 . 1 1 39 39 LYS C C 39 172.261 172.261 177.289 -5.028 17635 11639 1 20 . 1 1 39 39 LYS CA C 39 58.319 58.319 57.438 0.881 17635 11640 1 20 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.378 0.419 17635 11641 1 20 . 1 1 39 39 LYS H H 39 8.314 8.314 7.968 0.346 17635 11642 1 20 . 1 1 40 40 THR N N 40 105.547 105.547 107.109 -1.562 17635 11643 1 20 . 1 1 40 40 THR HA H 40 4.465 4.465 4.482 -0.017 17635 11644 1 20 . 1 1 40 40 THR C C 40 174.021 174.021 176.012 -1.991 17635 11645 1 20 . 1 1 40 40 THR CA C 40 61.260 61.260 62.168 -0.908 17635 11646 1 20 . 1 1 40 40 THR CB C 40 70.997 70.997 71.285 -0.288 17635 11647 1 20 . 1 1 40 40 THR H H 40 7.422 7.422 7.985 -0.563 17635 11648 1 20 . 1 1 41 41 GLY N N 41 111.631 111.631 111.390 0.241 17635 11649 1 20 . 1 1 41 41 GLY C C 41 176.727 176.727 173.728 2.999 17635 11650 1 20 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.276 0.454 17635 11651 1 20 . 1 1 41 41 GLY H H 41 8.644 8.644 8.797 -0.153 17635 11652 1 20 . 1 1 42 42 GLN N N 42 118.894 118.894 117.576 1.318 17635 11653 1 20 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.835 -0.166 17635 11654 1 20 . 1 1 42 42 GLN C C 42 177.178 177.178 173.184 3.994 17635 11655 1 20 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.074 1.508 17635 11656 1 20 . 1 1 42 42 GLN CB C 42 29.230 29.230 28.659 0.571 17635 11657 1 20 . 1 1 42 42 GLN H H 42 7.662 7.662 7.630 0.032 17635 11658 1 20 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.203 0.392 17635 11659 1 20 . 1 1 43 43 PRO C C 43 172.629 172.629 176.190 -3.561 17635 11660 1 20 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.444 -0.622 17635 11661 1 20 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.129 0.567 17635 11662 1 20 . 1 1 44 44 MET N N 44 124.162 124.162 120.793 3.369 17635 11663 1 20 . 1 1 44 44 MET HA H 44 4.432 4.432 4.631 -0.199 17635 11664 1 20 . 1 1 44 44 MET C C 44 176.474 176.474 174.513 1.961 17635 11665 1 20 . 1 1 44 44 MET CA C 44 55.419 55.419 54.675 0.744 17635 11666 1 20 . 1 1 44 44 MET CB C 44 30.555 30.555 35.335 -4.780 17635 11667 1 20 . 1 1 44 44 MET H H 44 8.874 8.874 8.351 0.523 17635 11668 1 20 . 1 1 45 45 ILE N N 45 126.237 126.237 121.915 4.322 17635 11669 1 20 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.433 0.369 17635 11670 1 20 . 1 1 45 45 ILE C C 45 176.415 176.415 174.270 2.145 17635 11671 1 20 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.007 -0.791 17635 11672 1 20 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.746 -0.520 17635 11673 1 20 . 1 1 45 45 ILE H H 45 7.730 7.730 8.397 -0.667 17635 11674 1 20 . 1 1 46 46 ASN N N 46 124.735 124.735 124.531 0.204 17635 11675 1 20 . 1 1 46 46 ASN HA H 46 4.941 4.941 5.128 -0.187 17635 11676 1 20 . 1 1 46 46 ASN C C 46 176.836 176.836 173.418 3.418 17635 11677 1 20 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.049 -0.488 17635 11678 1 20 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.342 0.129 17635 11679 1 20 . 1 1 46 46 ASN H H 46 8.384 8.384 9.076 -0.692 17635 11680 1 20 . 1 1 47 47 LEU N N 47 122.487 122.487 119.670 2.817 17635 11681 1 20 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.637 0.078 17635 11682 1 20 . 1 1 47 47 LEU C C 47 174.190 174.190 176.039 -1.849 17635 11683 1 20 . 1 1 47 47 LEU CA C 47 53.332 53.332 54.256 -0.924 17635 11684 1 20 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.500 -2.223 17635 11685 1 20 . 1 1 47 47 LEU H H 47 8.594 8.594 8.301 0.293 17635 11686 1 20 . 1 1 48 48 TYR N N 48 121.842 121.842 121.664 0.178 17635 11687 1 20 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.975 -0.208 17635 11688 1 20 . 1 1 48 48 TYR C C 48 173.649 173.649 175.217 -1.568 17635 11689 1 20 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.084 1.810 17635 11690 1 20 . 1 1 48 48 TYR CB C 48 39.199 39.199 38.937 0.263 17635 11691 1 20 . 1 1 48 48 TYR H H 48 7.666 7.666 8.631 -0.965 17635 11692 1 20 . 1 1 49 49 THR N N 49 116.554 116.554 114.014 2.540 17635 11693 1 20 . 1 1 49 49 THR HA H 49 4.806 4.806 4.628 0.178 17635 11694 1 20 . 1 1 49 49 THR C C 49 176.654 176.654 173.481 3.173 17635 11695 1 20 . 1 1 49 49 THR CA C 49 60.693 60.693 59.346 1.347 17635 11696 1 20 . 1 1 49 49 THR CB C 49 71.437 71.437 71.606 -0.169 17635 11697 1 20 . 1 1 49 49 THR H H 49 8.965 8.965 8.471 0.494 17635 11698 1 20 . 1 1 50 50 ASP N N 50 123.826 123.826 123.511 0.315 17635 11699 1 20 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.711 -0.087 17635 11700 1 20 . 1 1 50 50 ASP C C 50 173.380 173.380 176.561 -3.181 17635 11701 1 20 . 1 1 50 50 ASP CA C 50 54.088 54.088 53.761 0.327 17635 11702 1 20 . 1 1 50 50 ASP CB C 50 42.867 42.867 42.044 0.823 17635 11703 1 20 . 1 1 50 50 ASP H H 50 8.939 8.939 8.385 0.554 17635 11704 1 20 . 1 1 51 51 ARG N N 51 127.794 127.794 126.948 0.846 17635 11705 1 20 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.321 -0.276 17635 11706 1 20 . 1 1 51 51 ARG C C 51 173.101 173.101 177.058 -3.957 17635 11707 1 20 . 1 1 51 51 ARG CA C 51 58.562 58.562 57.255 1.307 17635 11708 1 20 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.582 0.585 17635 11709 1 20 . 1 1 51 51 ARG H H 51 8.958 8.958 8.704 0.255 17635 11710 1 20 . 1 1 52 52 GLU N N 52 117.542 117.542 119.826 -2.284 17635 11711 1 20 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.117 0.161 17635 11712 1 20 . 1 1 52 52 GLU C C 52 172.201 172.201 177.868 -5.667 17635 11713 1 20 . 1 1 52 52 GLU CA C 52 58.524 58.524 58.486 0.038 17635 11714 1 20 . 1 1 52 52 GLU CB C 52 30.278 30.278 28.988 1.290 17635 11715 1 20 . 1 1 52 52 GLU H H 52 8.561 8.561 8.160 0.401 17635 11716 1 20 . 1 1 53 53 THR N N 53 107.065 107.065 111.098 -4.033 17635 11717 1 20 . 1 1 53 53 THR HA H 53 4.436 4.436 4.424 0.012 17635 11718 1 20 . 1 1 53 53 THR C C 53 173.851 173.851 175.278 -1.427 17635 11719 1 20 . 1 1 53 53 THR CA C 53 61.944 61.944 61.841 0.103 17635 11720 1 20 . 1 1 53 53 THR CB C 53 71.197 71.197 69.652 1.545 17635 11721 1 20 . 1 1 53 53 THR H H 53 8.087 8.087 7.618 0.469 17635 11722 1 20 . 1 1 54 54 GLY N N 54 111.295 111.295 109.111 2.184 17635 11723 1 20 . 1 1 54 54 GLY C C 54 176.747 176.747 174.165 2.582 17635 11724 1 20 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.239 0.464 17635 11725 1 20 . 1 1 54 54 GLY H H 54 8.423 8.423 7.846 0.577 17635 11726 1 20 . 1 1 55 55 LYS N N 55 119.673 119.673 119.100 0.573 17635 11727 1 20 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.425 -0.072 17635 11728 1 20 . 1 1 55 55 LYS C C 55 173.854 173.854 175.719 -1.865 17635 11729 1 20 . 1 1 55 55 LYS CA C 55 55.842 55.842 55.306 0.535 17635 11730 1 20 . 1 1 55 55 LYS CB C 55 33.821 33.821 33.337 0.484 17635 11731 1 20 . 1 1 55 55 LYS H H 55 7.767 7.767 7.847 -0.080 17635 11732 1 20 . 1 1 56 56 LEU N N 56 122.426 122.426 114.005 8.421 17635 11733 1 20 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.980 -0.624 17635 11734 1 20 . 1 1 56 56 LEU C C 56 172.534 172.534 176.832 -4.298 17635 11735 1 20 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.304 1.951 17635 11736 1 20 . 1 1 56 56 LEU CB C 56 41.654 41.654 44.868 -3.214 17635 11737 1 20 . 1 1 56 56 LEU H H 56 8.768 8.768 8.002 0.766 17635 11738 1 20 . 1 1 57 57 LYS N N 57 118.264 118.264 119.883 -1.619 17635 11739 1 20 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.476 -0.188 17635 11740 1 20 . 1 1 57 57 LYS C C 57 173.648 173.648 177.510 -3.862 17635 11741 1 20 . 1 1 57 57 LYS CA C 57 56.264 56.264 55.876 0.388 17635 11742 1 20 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.559 1.504 17635 11743 1 20 . 1 1 57 57 LYS H H 57 8.012 8.012 8.175 -0.163 17635 11744 1 20 . 1 1 58 58 GLY N N 58 108.514 108.514 107.554 0.960 17635 11745 1 20 . 1 1 58 58 GLY C C 58 177.876 177.876 173.255 4.621 17635 11746 1 20 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.636 0.728 17635 11747 1 20 . 1 1 58 58 GLY H H 58 8.334 8.334 8.537 -0.203 17635 11748 1 20 . 1 1 59 59 GLU N N 59 116.119 116.119 119.188 -3.069 17635 11749 1 20 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.338 0.183 17635 11750 1 20 . 1 1 59 59 GLU C C 59 173.860 173.860 173.753 0.107 17635 11751 1 20 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.357 -2.332 17635 11752 1 20 . 1 1 59 59 GLU CB C 59 34.304 34.304 34.262 0.042 17635 11753 1 20 . 1 1 59 59 GLU H H 59 7.202 7.202 7.866 -0.664 17635 11754 1 20 . 1 1 60 60 ALA N N 60 123.607 123.607 126.686 -3.079 17635 11755 1 20 . 1 1 60 60 ALA HA H 60 5.607 5.607 4.914 0.693 17635 11756 1 20 . 1 1 60 60 ALA C C 60 173.923 173.923 175.349 -1.426 17635 11757 1 20 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.722 -0.779 17635 11758 1 20 . 1 1 60 60 ALA CB C 60 24.059 24.059 22.722 1.337 17635 11759 1 20 . 1 1 60 60 ALA H H 60 8.930 8.930 9.167 -0.237 17635 11760 1 20 . 1 1 61 61 THR N N 61 108.384 108.384 116.389 -8.005 17635 11761 1 20 . 1 1 61 61 THR HA H 61 5.743 5.743 4.811 0.932 17635 11762 1 20 . 1 1 61 61 THR C C 61 176.172 176.172 173.984 2.188 17635 11763 1 20 . 1 1 61 61 THR CA C 61 59.625 59.625 60.578 -0.953 17635 11764 1 20 . 1 1 61 61 THR CB C 61 71.224 71.224 69.655 1.569 17635 11765 1 20 . 1 1 61 61 THR H H 61 8.452 8.452 8.515 -0.063 17635 11766 1 20 . 1 1 62 62 VAL N N 62 120.200 120.200 126.112 -5.912 17635 11767 1 20 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.244 -0.000 17635 11768 1 20 . 1 1 62 62 VAL C C 62 175.994 175.994 175.230 0.764 17635 11769 1 20 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.057 0.369 17635 11770 1 20 . 1 1 62 62 VAL CB C 62 34.685 34.685 34.173 0.512 17635 11771 1 20 . 1 1 62 62 VAL H H 62 8.071 8.071 7.970 0.101 17635 11772 1 20 . 1 1 63 63 SER N N 63 121.689 121.689 122.344 -0.655 17635 11773 1 20 . 1 1 63 63 SER HA H 63 5.261 5.261 4.790 0.471 17635 11774 1 20 . 1 1 63 63 SER C C 63 177.943 177.943 173.797 4.146 17635 11775 1 20 . 1 1 63 63 SER CA C 63 57.662 57.662 56.678 0.984 17635 11776 1 20 . 1 1 63 63 SER CB C 63 64.427 64.427 64.132 0.295 17635 11777 1 20 . 1 1 63 63 SER H H 63 7.695 7.695 8.275 -0.580 17635 11778 1 20 . 1 1 64 64 PHE N N 64 122.640 122.640 122.079 0.561 17635 11779 1 20 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.741 0.113 17635 11780 1 20 . 1 1 64 64 PHE C C 64 174.605 174.605 176.244 -1.639 17635 11781 1 20 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.880 0.324 17635 11782 1 20 . 1 1 64 64 PHE CB C 64 41.976 41.976 42.610 -0.634 17635 11783 1 20 . 1 1 64 64 PHE H H 64 9.025 9.025 7.940 1.085 17635 11784 1 20 . 1 1 65 65 ASP N N 65 119.943 119.943 120.691 -0.748 17635 11785 1 20 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.660 -0.225 17635 11786 1 20 . 1 1 65 65 ASP C C 65 174.396 174.396 175.761 -1.365 17635 11787 1 20 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.322 2.120 17635 11788 1 20 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.820 0.214 17635 11789 1 20 . 1 1 65 65 ASP H H 65 8.512 8.512 8.550 -0.038 17635 11790 1 20 . 1 1 66 66 ASP N N 66 116.125 116.125 118.761 -2.636 17635 11791 1 20 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.090 0.309 17635 11792 1 20 . 1 1 66 66 ASP C C 66 175.936 175.936 174.893 1.043 17635 11793 1 20 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.559 -0.766 17635 11794 1 20 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.596 0.323 17635 11795 1 20 . 1 1 66 66 ASP H H 66 8.323 8.323 7.813 0.510 17635 11796 1 20 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.299 0.151 17635 11797 1 20 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.935 -0.011 17635 11798 1 20 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.042 -0.212 17635 11799 1 20 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.274 0.145 17635 11800 1 20 . 1 1 68 68 PRO C C 68 171.345 171.345 179.220 -7.875 17635 11801 1 20 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.124 0.112 17635 11802 1 20 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.051 -0.054 17635 11803 1 20 . 1 1 69 69 SER N N 69 114.544 114.544 114.013 0.531 17635 11804 1 20 . 1 1 69 69 SER HA H 69 4.036 4.036 4.090 -0.054 17635 11805 1 20 . 1 1 69 69 SER C C 69 176.535 176.535 175.951 0.584 17635 11806 1 20 . 1 1 69 69 SER CA C 69 61.837 61.837 61.409 0.428 17635 11807 1 20 . 1 1 69 69 SER CB C 69 62.773 62.773 62.910 -0.137 17635 11808 1 20 . 1 1 69 69 SER H H 69 8.004 8.004 8.274 -0.270 17635 11809 1 20 . 1 1 70 70 ALA N N 70 122.649 122.649 123.491 -0.842 17635 11810 1 20 . 1 1 70 70 ALA HA H 70 3.593 3.593 2.458 1.135 17635 11811 1 20 . 1 1 70 70 ALA C C 70 172.686 172.686 178.846 -6.160 17635 11812 1 20 . 1 1 70 70 ALA CA C 70 55.036 55.036 54.487 0.549 17635 11813 1 20 . 1 1 70 70 ALA CB C 70 17.864 17.864 17.946 -0.082 17635 11814 1 20 . 1 1 70 70 ALA H H 70 7.383 7.383 7.325 0.058 17635 11815 1 20 . 1 1 71 71 LYS N N 71 116.308 116.308 119.505 -3.197 17635 11816 1 20 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.507 0.268 17635 11817 1 20 . 1 1 71 71 LYS C C 71 172.333 172.333 178.460 -6.127 17635 11818 1 20 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.297 0.705 17635 11819 1 20 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.872 0.570 17635 11820 1 20 . 1 1 71 71 LYS H H 71 7.159 7.159 7.388 -0.229 17635 11821 1 20 . 1 1 72 72 ALA N N 72 119.806 119.806 120.780 -0.974 17635 11822 1 20 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.078 0.088 17635 11823 1 20 . 1 1 72 72 ALA C C 72 170.530 170.530 179.660 -9.130 17635 11824 1 20 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.764 -0.049 17635 11825 1 20 . 1 1 72 72 ALA CB C 72 17.820 17.820 17.886 -0.066 17635 11826 1 20 . 1 1 72 72 ALA H H 72 7.924 7.924 8.280 -0.356 17635 11827 1 20 . 1 1 73 73 ALA N N 73 120.524 120.524 120.989 -0.465 17635 11828 1 20 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.146 0.133 17635 11829 1 20 . 1 1 73 73 ALA C C 73 171.039 171.039 179.461 -8.422 17635 11830 1 20 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.978 0.401 17635 11831 1 20 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.903 0.228 17635 11832 1 20 . 1 1 73 73 ALA H H 73 8.104 8.104 7.390 0.714 17635 11833 1 20 . 1 1 74 74 ILE N N 74 119.875 119.875 118.051 1.824 17635 11834 1 20 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.673 -0.259 17635 11835 1 20 . 1 1 74 74 ILE C C 74 172.435 172.435 177.541 -5.106 17635 11836 1 20 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.071 0.773 17635 11837 1 20 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.581 1.162 17635 11838 1 20 . 1 1 74 74 ILE H H 74 7.574 7.574 7.646 -0.072 17635 11839 1 20 . 1 1 75 75 ASP N N 75 117.867 117.867 118.452 -0.585 17635 11840 1 20 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.422 -0.111 17635 11841 1 20 . 1 1 75 75 ASP C C 75 172.054 172.054 176.569 -4.515 17635 11842 1 20 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.736 0.425 17635 11843 1 20 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.326 -0.795 17635 11844 1 20 . 1 1 75 75 ASP H H 75 7.937 7.937 7.841 0.096 17635 11845 1 20 . 1 1 76 76 TRP N N 76 117.313 117.313 119.920 -2.607 17635 11846 1 20 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.522 -0.166 17635 11847 1 20 . 1 1 76 76 TRP C C 76 173.272 173.272 176.422 -3.150 17635 11848 1 20 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.406 1.056 17635 11849 1 20 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.907 0.870 17635 11850 1 20 . 1 1 76 76 TRP H H 76 8.475 8.475 7.573 0.902 17635 11851 1 20 . 1 1 77 77 PHE N N 77 112.019 112.019 116.813 -4.794 17635 11852 1 20 . 1 1 77 77 PHE HA H 77 4.648 4.648 3.970 0.678 17635 11853 1 20 . 1 1 77 77 PHE C C 77 173.747 173.747 176.479 -2.732 17635 11854 1 20 . 1 1 77 77 PHE CA C 77 59.921 59.921 59.672 0.249 17635 11855 1 20 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.239 2.491 17635 11856 1 20 . 1 1 77 77 PHE H H 77 8.488 8.488 7.223 1.265 17635 11857 1 20 . 1 1 78 78 ASP N N 78 118.408 118.408 120.203 -1.795 17635 11858 1 20 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.555 -0.091 17635 11859 1 20 . 1 1 78 78 ASP C C 78 172.542 172.542 176.679 -4.137 17635 11860 1 20 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.178 3.512 17635 11861 1 20 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.368 2.518 17635 11862 1 20 . 1 1 78 78 ASP H H 78 7.978 7.978 8.453 -0.475 17635 11863 1 20 . 1 1 79 79 GLY N N 79 115.548 115.548 103.510 12.038 17635 11864 1 20 . 1 1 79 79 GLY C C 79 175.680 175.680 173.403 2.277 17635 11865 1 20 . 1 1 79 79 GLY CA C 79 46.072 46.072 45.081 0.991 17635 11866 1 20 . 1 1 79 79 GLY H H 79 8.615 8.615 8.440 0.175 17635 11867 1 20 . 1 1 80 80 LYS N N 80 120.271 120.271 117.899 2.372 17635 11868 1 20 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.437 0.025 17635 11869 1 20 . 1 1 80 80 LYS C C 80 175.853 175.853 174.934 0.919 17635 11870 1 20 . 1 1 80 80 LYS CA C 80 55.150 55.150 54.601 0.549 17635 11871 1 20 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.181 -1.755 17635 11872 1 20 . 1 1 80 80 LYS H H 80 8.013 8.013 7.821 0.192 17635 11873 1 20 . 1 1 81 81 GLU N N 81 115.765 115.765 117.867 -2.102 17635 11874 1 20 . 1 1 81 81 GLU HA H 81 4.698 4.698 4.837 -0.139 17635 11875 1 20 . 1 1 81 81 GLU C C 81 173.263 173.263 175.295 -2.032 17635 11876 1 20 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.197 0.727 17635 11877 1 20 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.602 0.440 17635 11878 1 20 . 1 1 81 81 GLU H H 81 8.201 8.201 8.396 -0.195 17635 11879 1 20 . 1 1 82 82 PHE N N 82 127.080 127.080 126.187 0.893 17635 11880 1 20 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.249 0.247 17635 11881 1 20 . 1 1 82 82 PHE C C 82 175.349 175.349 176.032 -0.683 17635 11882 1 20 . 1 1 82 82 PHE CA C 82 56.716 56.716 55.737 0.979 17635 11883 1 20 . 1 1 82 82 PHE CB C 82 41.994 41.994 38.892 3.102 17635 11884 1 20 . 1 1 82 82 PHE H H 82 9.162 9.162 9.005 0.157 17635 11885 1 20 . 1 1 83 83 SER N N 83 125.136 125.136 120.972 4.164 17635 11886 1 20 . 1 1 83 83 SER HA H 83 3.803 3.803 4.143 -0.340 17635 11887 1 20 . 1 1 83 83 SER C C 83 175.543 175.543 174.047 1.496 17635 11888 1 20 . 1 1 83 83 SER CA C 83 58.371 58.371 59.644 -1.273 17635 11889 1 20 . 1 1 83 83 SER CB C 83 62.519 62.519 62.406 0.113 17635 11890 1 20 . 1 1 83 83 SER H H 83 9.193 9.193 8.962 0.231 17635 11891 1 20 . 1 1 84 84 GLY N N 84 103.581 103.581 106.710 -3.129 17635 11892 1 20 . 1 1 84 84 GLY C C 84 177.188 177.188 173.857 3.331 17635 11893 1 20 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.829 0.223 17635 11894 1 20 . 1 1 84 84 GLY H H 84 8.446 8.446 8.186 0.260 17635 11895 1 20 . 1 1 85 85 ASN N N 85 119.051 119.051 121.427 -2.376 17635 11896 1 20 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.160 0.174 17635 11897 1 20 . 1 1 85 85 ASN C C 85 178.020 178.020 172.826 5.194 17635 11898 1 20 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.197 -0.726 17635 11899 1 20 . 1 1 85 85 ASN CB C 85 41.117 41.117 38.578 2.539 17635 11900 1 20 . 1 1 85 85 ASN H H 85 7.762 7.762 8.274 -0.512 17635 11901 1 20 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.279 -0.612 17635 11902 1 20 . 1 1 86 86 PRO C C 86 173.474 173.474 176.119 -2.645 17635 11903 1 20 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.302 0.408 17635 11904 1 20 . 1 1 86 86 PRO CB C 86 31.870 31.870 33.062 -1.192 17635 11905 1 20 . 1 1 87 87 ILE N N 87 117.270 117.270 115.459 1.811 17635 11906 1 20 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.298 -0.152 17635 11907 1 20 . 1 1 87 87 ILE C C 87 174.495 174.495 174.411 0.084 17635 11908 1 20 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.592 0.900 17635 11909 1 20 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.709 -1.038 17635 11910 1 20 . 1 1 87 87 ILE H H 87 8.469 8.469 9.095 -0.626 17635 11911 1 20 . 1 1 88 88 LYS N N 88 122.271 122.271 120.233 2.038 17635 11912 1 20 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.733 0.459 17635 11913 1 20 . 1 1 88 88 LYS C C 88 174.393 174.393 174.800 -0.407 17635 11914 1 20 . 1 1 88 88 LYS CA C 88 54.138 54.138 55.651 -1.512 17635 11915 1 20 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.944 0.105 17635 11916 1 20 . 1 1 88 88 LYS H H 88 8.353 8.353 8.182 0.171 17635 11917 1 20 . 1 1 89 89 VAL N N 89 125.661 125.661 126.840 -1.179 17635 11918 1 20 . 1 1 89 89 VAL HA H 89 4.963 4.963 5.012 -0.049 17635 11919 1 20 . 1 1 89 89 VAL C C 89 177.160 177.160 176.298 0.862 17635 11920 1 20 . 1 1 89 89 VAL CA C 89 61.361 61.361 60.978 0.383 17635 11921 1 20 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.417 2.353 17635 11922 1 20 . 1 1 89 89 VAL H H 89 9.414 9.414 8.535 0.879 17635 11923 1 20 . 1 1 90 90 SER N N 90 119.538 119.538 123.286 -3.748 17635 11924 1 20 . 1 1 90 90 SER HA H 90 4.710 4.710 4.699 0.011 17635 11925 1 20 . 1 1 90 90 SER C C 90 176.533 176.533 174.454 2.079 17635 11926 1 20 . 1 1 90 90 SER CA C 90 56.936 56.936 57.194 -0.258 17635 11927 1 20 . 1 1 90 90 SER CB C 90 66.470 66.470 65.631 0.839 17635 11928 1 20 . 1 1 90 90 SER H H 90 8.945 8.945 8.314 0.631 17635 11929 1 20 . 1 1 91 91 PHE N N 91 120.115 120.115 122.089 -1.974 17635 11930 1 20 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.548 0.125 17635 11931 1 20 . 1 1 91 91 PHE C C 91 173.349 173.349 175.464 -2.115 17635 11932 1 20 . 1 1 91 91 PHE CA C 91 61.155 61.155 57.227 3.928 17635 11933 1 20 . 1 1 91 91 PHE CB C 91 39.503 39.503 38.264 1.239 17635 11934 1 20 . 1 1 91 91 PHE H H 91 8.919 8.919 8.710 0.209 17635 11935 1 20 . 1 1 92 92 ALA N N 92 124.386 124.386 120.361 4.025 17635 11936 1 20 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.011 0.345 17635 11937 1 20 . 1 1 92 92 ALA C C 92 172.984 172.984 176.078 -3.094 17635 11938 1 20 . 1 1 92 92 ALA CA C 92 52.098 52.098 53.343 -1.245 17635 11939 1 20 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.762 0.644 17635 11940 1 20 . 1 1 92 92 ALA H H 92 8.563 8.563 7.511 1.052 17635 11941 1 20 . 1 1 93 93 THR N N 93 116.073 116.073 113.619 2.454 17635 11942 1 20 . 1 1 93 93 THR HA H 93 4.208 4.208 4.340 -0.132 17635 11943 1 20 . 1 1 93 93 THR C C 93 176.032 176.032 173.750 2.282 17635 11944 1 20 . 1 1 93 93 THR CA C 93 62.255 62.255 61.516 0.739 17635 11945 1 20 . 1 1 93 93 THR CB C 93 69.708 69.708 69.741 -0.033 17635 11946 1 20 . 1 1 93 93 THR H H 93 8.312 8.312 8.138 0.174 17635 11947 1 20 . 1 1 94 94 ARG N N 94 124.359 124.359 121.968 2.391 17635 11948 1 20 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.108 0.229 17635 11949 1 20 . 1 1 94 94 ARG C C 94 174.426 174.426 175.563 -1.137 17635 11950 1 20 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.485 -0.430 17635 11951 1 20 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.260 0.651 17635 11952 1 20 . 1 1 94 94 ARG H H 94 8.493 8.493 8.547 -0.054 17635 11953 1 20 . 1 1 95 95 ARG N N 95 122.515 122.515 123.376 -0.861 17635 11954 1 20 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.275 -0.047 17635 11955 1 20 . 1 1 95 95 ARG C C 95 174.306 174.306 175.585 -1.279 17635 11956 1 20 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.125 0.017 17635 11957 1 20 . 1 1 95 95 ARG CB C 95 30.966 30.966 28.062 2.904 17635 11958 1 20 . 1 1 95 95 ARG H H 95 8.343 8.343 8.591 -0.248 17635 11959 1 20 . 1 1 96 96 ALA N N 96 125.127 125.127 125.126 0.001 17635 11960 1 20 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.454 -0.245 17635 11961 1 20 . 1 1 96 96 ALA C C 96 173.226 173.226 176.364 -3.138 17635 11962 1 20 . 1 1 96 96 ALA CA C 96 52.770 52.770 51.544 1.226 17635 11963 1 20 . 1 1 96 96 ALA CB C 96 19.193 19.193 20.143 -0.950 17635 11964 1 20 . 1 1 96 96 ALA H H 96 8.402 8.402 8.046 0.356 17635 11965 1 20 . 1 1 97 97 ASP N N 97 118.483 118.483 118.715 -0.232 17635 11966 1 20 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.419 0.079 17635 11967 1 20 . 1 1 97 97 ASP C C 97 174.302 174.302 175.154 -0.852 17635 11968 1 20 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.449 -0.358 17635 11969 1 20 . 1 1 97 97 ASP CB C 97 40.907 40.907 40.540 0.367 17635 11970 1 20 . 1 1 97 97 ASP H H 97 8.206 8.206 8.181 0.025 17635 11971 1 20 . 1 1 98 98 PHE N N 98 120.321 120.321 121.504 -1.183 17635 11972 1 20 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.074 0.416 17635 11973 1 20 . 1 1 98 98 PHE C C 98 174.878 174.878 173.860 1.018 17635 11974 1 20 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.161 -0.001 17635 11975 1 20 . 1 1 98 98 PHE CB C 98 39.303 39.303 38.426 0.877 17635 11976 1 20 . 1 1 98 98 PHE H H 98 7.990 7.990 8.388 -0.398 17635 11977 1 20 . 1 1 99 99 ASN N N 99 120.016 120.016 122.248 -2.232 17635 11978 1 20 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.660 -0.051 17635 11979 1 20 . 1 1 99 99 ASN C C 99 175.348 175.348 176.333 -0.985 17635 11980 1 20 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.728 -0.415 17635 11981 1 20 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.568 0.159 17635 11982 1 20 . 1 1 99 99 ASN H H 99 8.336 8.336 8.306 0.030 17635 11983 1 20 . 1 1 100 100 ARG N N 100 121.374 121.374 120.380 0.994 17635 11984 1 20 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.086 0.187 17635 11985 1 20 . 1 1 100 100 ARG C C 100 173.627 173.627 177.002 -3.375 17635 11986 1 20 . 1 1 100 100 ARG CA C 100 56.492 56.492 57.113 -0.621 17635 11987 1 20 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.292 0.227 17635 11988 1 20 . 1 1 100 100 ARG H H 100 8.181 8.181 8.234 -0.053 17635 11989 1 20 . 1 1 101 101 GLY N N 101 109.586 109.586 104.872 4.714 17635 11990 1 20 . 1 1 101 101 GLY C C 101 175.739 175.739 173.997 1.742 17635 11991 1 20 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.291 1.089 17635 11992 1 20 . 1 1 101 101 GLY H H 101 8.413 8.413 7.734 0.679 17635 11993 1 20 . 1 1 102 102 GLY N N 102 108.692 108.692 108.955 -0.263 17635 11994 1 20 . 1 1 102 102 GLY C C 102 176.286 176.286 174.117 2.169 17635 11995 1 20 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.173 0.165 17635 11996 1 20 . 1 1 102 102 GLY H H 102 8.281 8.281 8.286 -0.005 17635 11997 1 20 . 1 1 103 103 GLY N N 103 108.844 108.844 108.137 0.707 17635 11998 1 20 . 1 1 103 103 GLY C C 103 175.798 175.798 172.896 2.902 17635 11999 1 20 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.773 0.573 17635 12000 1 20 . 1 1 103 103 GLY H H 103 8.364 8.364 7.877 0.487 17635 12001 1 20 . 1 1 104 104 ASN N N 104 118.527 118.527 123.095 -4.568 17635 12002 1 20 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.658 0.060 17635 12003 1 20 . 1 1 104 104 ASN C C 104 174.547 174.547 175.959 -1.412 17635 12004 1 20 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.248 -0.039 17635 12005 1 20 . 1 1 104 104 ASN CB C 104 38.879 38.879 38.772 0.107 17635 12006 1 20 . 1 1 104 104 ASN H H 104 8.438 8.438 8.498 -0.060 17635 12007 1 20 . 1 1 105 105 GLY N N 105 109.166 109.166 110.006 -0.840 17635 12008 1 20 . 1 1 105 105 GLY C C 105 176.074 176.074 173.990 2.084 17635 12009 1 20 . 1 1 105 105 GLY CA C 105 45.602 45.602 44.771 0.831 17635 12010 1 20 . 1 1 105 105 GLY H H 105 8.477 8.477 8.560 -0.083 17635 12011 1 20 . 1 1 106 106 ARG N N 106 120.341 120.341 118.764 1.577 17635 12012 1 20 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.535 -0.184 17635 12013 1 20 . 1 1 106 106 ARG C C 106 173.491 173.491 175.402 -1.911 17635 12014 1 20 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.471 0.756 17635 12015 1 20 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.307 0.322 17635 12016 1 20 . 1 1 106 106 ARG H H 106 8.244 8.244 8.217 0.027 17635 12017 1 20 . 1 1 107 107 GLY N N 107 109.856 109.856 113.144 -3.288 17635 12018 1 20 . 1 1 107 107 GLY C C 107 175.834 175.834 174.244 1.590 17635 12019 1 20 . 1 1 107 107 GLY CA C 107 45.441 45.441 45.686 -0.245 17635 12020 1 20 . 1 1 107 107 GLY H H 107 8.522 8.522 8.780 -0.258 17635 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 102 2.992 0.239 2.997 17635 2 1 1 "Average Difference" HA 114 0.344 -0.052 0.342 17635 3 1 1 "Average Difference" C 105 3.333 0.786 3.254 17635 4 1 1 "Average Difference" CA 106 1.336 -0.308 1.306 17635 5 1 1 "Average Difference" CB 93 1.320 -0.337 1.283 17635 6 1 1 "Average Difference" HN 102 0.465 -0.065 0.463 17635 7 1 2 "Average Difference" N 102 3.060 0.143 3.072 17635 8 1 2 "Average Difference" HA 114 0.325 -0.046 0.323 17635 9 1 2 "Average Difference" C 105 3.294 0.814 3.207 17635 10 1 2 "Average Difference" CA 106 1.389 -0.186 1.383 17635 11 1 2 "Average Difference" CB 93 1.230 -0.323 1.193 17635 12 1 2 "Average Difference" HN 102 0.489 -0.076 0.485 17635 13 1 3 "Average Difference" N 102 3.166 0.375 3.159 17635 14 1 3 "Average Difference" HA 114 0.333 -0.054 0.330 17635 15 1 3 "Average Difference" C 105 3.301 0.808 3.216 17635 16 1 3 "Average Difference" CA 106 1.256 -0.166 1.251 17635 17 1 3 "Average Difference" CB 93 1.387 -0.414 1.331 17635 18 1 3 "Average Difference" HN 102 0.487 -0.062 0.485 17635 19 1 4 "Average Difference" N 102 2.891 0.360 2.883 17635 20 1 4 "Average Difference" HA 114 0.313 -0.042 0.311 17635 21 1 4 "Average Difference" C 105 3.305 0.784 3.226 17635 22 1 4 "Average Difference" CA 106 1.203 -0.316 1.167 17635 23 1 4 "Average Difference" CB 93 1.306 -0.356 1.263 17635 24 1 4 "Average Difference" HN 102 0.458 -0.030 0.459 17635 25 1 5 "Average Difference" N 102 3.270 -0.094 3.285 17635 26 1 5 "Average Difference" HA 114 0.309 -0.035 0.308 17635 27 1 5 "Average Difference" C 105 3.315 0.817 3.228 17635 28 1 5 "Average Difference" CA 106 1.303 -0.209 1.292 17635 29 1 5 "Average Difference" CB 93 1.287 -0.441 1.215 17635 30 1 5 "Average Difference" HN 102 0.486 -0.037 0.487 17635 31 1 6 "Average Difference" N 102 3.285 0.191 3.296 17635 32 1 6 "Average Difference" HA 114 0.289 -0.047 0.286 17635 33 1 6 "Average Difference" C 105 3.320 0.820 3.232 17635 34 1 6 "Average Difference" CA 106 1.175 -0.236 1.157 17635 35 1 6 "Average Difference" CB 93 1.361 -0.351 1.322 17635 36 1 6 "Average Difference" HN 102 0.443 -0.080 0.438 17635 37 1 7 "Average Difference" N 102 3.193 0.077 3.208 17635 38 1 7 "Average Difference" HA 114 0.386 -0.020 0.387 17635 39 1 7 "Average Difference" C 105 3.271 0.783 3.191 17635 40 1 7 "Average Difference" CA 106 1.211 -0.345 1.166 17635 41 1 7 "Average Difference" CB 93 1.406 -0.394 1.357 17635 42 1 7 "Average Difference" HN 102 0.488 -0.066 0.486 17635 43 1 8 "Average Difference" N 102 3.353 -0.102 3.368 17635 44 1 8 "Average Difference" HA 114 0.324 -0.050 0.321 17635 45 1 8 "Average Difference" C 105 3.380 0.864 3.284 17635 46 1 8 "Average Difference" CA 106 1.325 -0.157 1.322 17635 47 1 8 "Average Difference" CB 93 1.323 -0.270 1.302 17635 48 1 8 "Average Difference" HN 102 0.455 -0.052 0.455 17635 49 1 9 "Average Difference" N 102 3.267 0.262 3.273 17635 50 1 9 "Average Difference" HA 114 0.327 -0.043 0.326 17635 51 1 9 "Average Difference" C 105 3.359 0.824 3.272 17635 52 1 9 "Average Difference" CA 106 1.242 -0.254 1.221 17635 53 1 9 "Average Difference" CB 93 1.350 -0.342 1.313 17635 54 1 9 "Average Difference" HN 102 0.465 -0.057 0.464 17635 55 1 10 "Average Difference" N 102 3.157 0.197 3.166 17635 56 1 10 "Average Difference" HA 114 0.339 -0.031 0.339 17635 57 1 10 "Average Difference" C 105 3.372 0.711 3.312 17635 58 1 10 "Average Difference" CA 106 1.253 -0.185 1.246 17635 59 1 10 "Average Difference" CB 93 1.333 -0.279 1.311 17635 60 1 10 "Average Difference" HN 102 0.492 -0.026 0.494 17635 61 1 11 "Average Difference" N 102 3.060 0.203 3.069 17635 62 1 11 "Average Difference" HA 114 0.316 -0.080 0.307 17635 63 1 11 "Average Difference" C 105 3.369 0.937 3.252 17635 64 1 11 "Average Difference" CA 106 1.452 -0.293 1.429 17635 65 1 11 "Average Difference" CB 93 1.487 -0.451 1.425 17635 66 1 11 "Average Difference" HN 102 0.437 -0.052 0.437 17635 67 1 12 "Average Difference" N 102 3.080 0.217 3.087 17635 68 1 12 "Average Difference" HA 114 0.327 -0.039 0.326 17635 69 1 12 "Average Difference" C 105 3.387 0.837 3.297 17635 70 1 12 "Average Difference" CA 106 1.317 -0.267 1.296 17635 71 1 12 "Average Difference" CB 93 1.399 -0.329 1.368 17635 72 1 12 "Average Difference" HN 102 0.483 -0.065 0.481 17635 73 1 13 "Average Difference" N 102 3.135 0.268 3.139 17635 74 1 13 "Average Difference" HA 114 0.333 -0.047 0.331 17635 75 1 13 "Average Difference" C 105 3.369 0.779 3.293 17635 76 1 13 "Average Difference" CA 106 1.120 -0.289 1.087 17635 77 1 13 "Average Difference" CB 93 1.310 -0.281 1.286 17635 78 1 13 "Average Difference" HN 102 0.456 -0.042 0.456 17635 79 1 14 "Average Difference" N 102 3.088 0.502 3.062 17635 80 1 14 "Average Difference" HA 114 0.370 -0.056 0.368 17635 81 1 14 "Average Difference" C 105 3.370 0.868 3.272 17635 82 1 14 "Average Difference" CA 106 1.244 -0.231 1.228 17635 83 1 14 "Average Difference" CB 93 1.267 -0.431 1.198 17635 84 1 14 "Average Difference" HN 102 0.424 -0.043 0.424 17635 85 1 15 "Average Difference" N 102 2.886 0.201 2.893 17635 86 1 15 "Average Difference" HA 114 0.371 -0.069 0.366 17635 87 1 15 "Average Difference" C 105 3.330 0.865 3.231 17635 88 1 15 "Average Difference" CA 106 1.422 -0.268 1.403 17635 89 1 15 "Average Difference" CB 93 1.251 -0.429 1.182 17635 90 1 15 "Average Difference" HN 102 0.479 -0.071 0.476 17635 91 1 16 "Average Difference" N 102 3.207 0.074 3.221 17635 92 1 16 "Average Difference" HA 114 0.334 -0.033 0.334 17635 93 1 16 "Average Difference" C 105 3.355 0.893 3.249 17635 94 1 16 "Average Difference" CA 106 1.350 -0.245 1.334 17635 95 1 16 "Average Difference" CB 93 1.335 -0.394 1.282 17635 96 1 16 "Average Difference" HN 102 0.523 -0.020 0.525 17635 97 1 17 "Average Difference" N 102 3.023 0.065 3.037 17635 98 1 17 "Average Difference" HA 114 0.336 -0.060 0.333 17635 99 1 17 "Average Difference" C 105 3.295 0.845 3.200 17635 100 1 17 "Average Difference" CA 106 1.375 -0.199 1.367 17635 101 1 17 "Average Difference" CB 93 1.218 -0.379 1.163 17635 102 1 17 "Average Difference" HN 102 0.471 -0.017 0.473 17635 103 1 18 "Average Difference" N 102 3.286 0.461 3.270 17635 104 1 18 "Average Difference" HA 114 0.304 -0.031 0.304 17635 105 1 18 "Average Difference" C 105 3.457 0.886 3.357 17635 106 1 18 "Average Difference" CA 106 1.189 -0.316 1.152 17635 107 1 18 "Average Difference" CB 93 1.310 -0.343 1.271 17635 108 1 18 "Average Difference" HN 102 0.465 -0.044 0.465 17635 109 1 19 "Average Difference" N 102 3.133 0.314 3.132 17635 110 1 19 "Average Difference" HA 114 0.321 -0.054 0.317 17635 111 1 19 "Average Difference" C 105 3.401 0.839 3.312 17635 112 1 19 "Average Difference" CA 106 1.336 -0.264 1.316 17635 113 1 19 "Average Difference" CB 93 1.290 -0.500 1.196 17635 114 1 19 "Average Difference" HN 102 0.496 -0.032 0.497 17635 115 1 20 "Average Difference" N 102 3.195 0.100 3.210 17635 116 1 20 "Average Difference" HA 114 0.336 -0.081 0.328 17635 117 1 20 "Average Difference" C 105 3.378 0.849 3.286 17635 118 1 20 "Average Difference" CA 106 1.180 -0.247 1.159 17635 119 1 20 "Average Difference" CB 93 1.316 -0.375 1.268 17635 120 1 20 "Average Difference" HN 102 0.498 -0.093 0.492 17635 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 17635 _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 GLN N N 2 121.692 121.692 119.664 2.028 17635 2 1 . 1 1 2 2 GLN HA H 2 4.266 4.266 4.270 -0.004 17635 3 1 . 1 1 2 2 GLN C C 2 175.248 175.248 174.951 0.297 17635 4 1 . 1 1 2 2 GLN CA C 2 55.996 55.996 55.909 0.087 17635 5 1 . 1 1 2 2 GLN CB C 2 29.639 29.639 29.118 0.521 17635 6 1 . 1 1 2 2 GLN H H 2 8.621 8.621 8.279 0.342 17635 7 1 . 1 1 3 3 ASP N N 3 121.801 121.801 120.919 0.882 17635 8 1 . 1 1 3 3 ASP HA H 3 4.568 4.568 4.642 -0.074 17635 9 1 . 1 1 3 3 ASP C C 3 174.336 174.336 175.629 -1.293 17635 10 1 . 1 1 3 3 ASP CA C 3 54.062 54.062 54.232 -0.170 17635 11 1 . 1 1 3 3 ASP CB C 3 41.071 41.071 40.592 0.479 17635 12 1 . 1 1 3 3 ASP H H 3 8.436 8.436 8.543 -0.107 17635 13 1 . 1 1 4 4 ASN N N 4 120.292 120.292 118.839 1.454 17635 14 1 . 1 1 4 4 ASN HA H 4 4.637 4.637 4.686 -0.049 17635 15 1 . 1 1 4 4 ASN C C 4 174.415 174.415 175.024 -0.609 17635 16 1 . 1 1 4 4 ASN CA C 4 53.861 53.861 53.429 0.432 17635 17 1 . 1 1 4 4 ASN CB C 4 38.534 38.534 38.895 -0.361 17635 18 1 . 1 1 4 4 ASN H H 4 8.528 8.528 8.238 0.290 17635 19 1 . 1 1 5 5 SER N N 5 117.091 117.091 116.315 0.776 17635 20 1 . 1 1 5 5 SER HA H 5 4.163 4.163 4.496 -0.333 17635 21 1 . 1 1 5 5 SER C C 5 176.370 176.370 174.293 2.077 17635 22 1 . 1 1 5 5 SER CA C 5 60.846 60.846 59.085 1.761 17635 23 1 . 1 1 5 5 SER CB C 5 63.136 63.136 63.572 -0.436 17635 24 1 . 1 1 5 5 SER H H 5 8.470 8.470 8.421 0.049 17635 25 1 . 1 1 6 6 ASP N N 6 119.436 119.436 119.708 -0.272 17635 26 1 . 1 1 6 6 ASP HA H 6 4.695 4.695 4.605 0.090 17635 27 1 . 1 1 6 6 ASP C C 6 175.048 175.048 175.129 -0.081 17635 28 1 . 1 1 6 6 ASP CA C 6 53.094 53.094 54.179 -1.085 17635 29 1 . 1 1 6 6 ASP CB C 6 40.935 40.935 40.882 0.053 17635 30 1 . 1 1 6 6 ASP H H 6 8.218 8.218 8.217 0.001 17635 31 1 . 1 1 7 7 ASN N N 7 119.696 119.696 117.088 2.608 17635 32 1 . 1 1 7 7 ASN HA H 7 4.628 4.628 4.568 0.060 17635 33 1 . 1 1 7 7 ASN C C 7 176.539 176.539 175.114 1.425 17635 34 1 . 1 1 7 7 ASN CA C 7 53.158 53.158 53.515 -0.357 17635 35 1 . 1 1 7 7 ASN CB C 7 38.859 38.859 38.640 0.219 17635 36 1 . 1 1 7 7 ASN H H 7 7.734 7.734 7.962 -0.228 17635 37 1 . 1 1 8 8 ASN N N 8 119.436 119.436 117.381 2.055 17635 38 1 . 1 1 8 8 ASN HA H 8 4.868 4.868 4.653 0.215 17635 39 1 . 1 1 8 8 ASN C C 8 175.327 175.327 175.083 0.244 17635 40 1 . 1 1 8 8 ASN CA C 8 53.204 53.204 54.290 -1.086 17635 41 1 . 1 1 8 8 ASN CB C 8 38.495 38.495 39.025 -0.530 17635 42 1 . 1 1 8 8 ASN H H 8 8.350 8.350 8.565 -0.215 17635 43 1 . 1 1 9 9 THR N N 9 118.650 118.650 115.599 3.051 17635 44 1 . 1 1 9 9 THR HA H 9 5.557 5.557 4.652 0.905 17635 45 1 . 1 1 9 9 THR C C 9 177.117 177.117 174.254 2.863 17635 46 1 . 1 1 9 9 THR CA C 9 62.314 62.314 63.257 -0.943 17635 47 1 . 1 1 9 9 THR CB C 9 71.225 71.225 69.194 2.031 17635 48 1 . 1 1 9 9 THR H H 9 8.428 8.428 7.569 0.859 17635 49 1 . 1 1 10 10 ILE N N 10 118.556 118.556 120.080 -1.524 17635 50 1 . 1 1 10 10 ILE HA H 10 5.165 5.165 4.993 0.172 17635 51 1 . 1 1 10 10 ILE C C 10 176.837 176.837 174.248 2.589 17635 52 1 . 1 1 10 10 ILE CA C 10 59.298 59.298 58.730 0.568 17635 53 1 . 1 1 10 10 ILE CB C 10 39.880 39.880 41.231 -1.351 17635 54 1 . 1 1 10 10 ILE H H 10 8.770 8.770 8.730 0.040 17635 55 1 . 1 1 11 11 PHE N N 11 123.798 123.798 120.142 3.655 17635 56 1 . 1 1 11 11 PHE HA H 11 5.420 5.420 4.946 0.474 17635 57 1 . 1 1 11 11 PHE C C 11 177.066 177.066 174.534 2.532 17635 58 1 . 1 1 11 11 PHE CA C 11 55.362 55.362 55.871 -0.509 17635 59 1 . 1 1 11 11 PHE CB C 11 41.868 41.868 41.123 0.745 17635 60 1 . 1 1 11 11 PHE H H 11 9.548 9.548 8.202 1.346 17635 61 1 . 1 1 12 12 VAL N N 12 127.993 127.993 125.867 2.126 17635 62 1 . 1 1 12 12 VAL HA H 12 4.958 4.958 4.565 0.393 17635 63 1 . 1 1 12 12 VAL C C 12 176.965 176.965 174.912 2.053 17635 64 1 . 1 1 12 12 VAL CA C 12 59.835 59.835 61.034 -1.199 17635 65 1 . 1 1 12 12 VAL CB C 12 34.800 34.800 32.295 2.505 17635 66 1 . 1 1 12 12 VAL H H 12 8.940 8.940 9.082 -0.142 17635 67 1 . 1 1 13 13 GLN N N 13 122.289 122.289 126.876 -4.587 17635 68 1 . 1 1 13 13 GLN HA H 13 4.779 4.779 4.731 0.048 17635 69 1 . 1 1 13 13 GLN C C 13 175.631 175.631 175.834 -0.203 17635 70 1 . 1 1 13 13 GLN CA C 13 54.110 54.110 54.166 -0.056 17635 71 1 . 1 1 13 13 GLN CB C 13 34.132 34.132 30.997 3.135 17635 72 1 . 1 1 13 13 GLN H H 13 8.747 8.747 8.187 0.560 17635 73 1 . 1 1 14 14 GLY N N 14 109.212 109.212 112.738 -3.526 17635 74 1 . 1 1 14 14 GLY C C 14 175.436 175.436 173.132 2.304 17635 75 1 . 1 1 14 14 GLY CA C 14 45.430 45.430 45.288 0.142 17635 76 1 . 1 1 14 14 GLY H H 14 8.236 8.236 8.764 -0.528 17635 77 1 . 1 1 15 15 LEU N N 15 117.824 117.824 120.907 -3.083 17635 78 1 . 1 1 15 15 LEU HA H 15 3.706 3.706 4.196 -0.490 17635 79 1 . 1 1 15 15 LEU C C 15 174.111 174.111 177.008 -2.897 17635 80 1 . 1 1 15 15 LEU CA C 15 55.718 55.718 55.659 0.059 17635 81 1 . 1 1 15 15 LEU CB C 15 42.433 42.433 41.944 0.488 17635 82 1 . 1 1 15 15 LEU H H 15 8.442 8.442 7.803 0.639 17635 83 1 . 1 1 16 16 GLY N N 16 105.063 105.063 105.817 -0.754 17635 84 1 . 1 1 16 16 GLY C C 16 177.771 177.771 173.949 3.822 17635 85 1 . 1 1 16 16 GLY CA C 16 44.094 44.094 44.977 -0.883 17635 86 1 . 1 1 16 16 GLY H H 16 8.006 8.006 7.881 0.125 17635 87 1 . 1 1 17 17 GLU N N 17 113.781 113.781 119.638 -5.857 17635 88 1 . 1 1 17 17 GLU HA H 17 4.119 4.119 4.143 -0.024 17635 89 1 . 1 1 17 17 GLU C C 17 173.937 173.937 175.453 -1.516 17635 90 1 . 1 1 17 17 GLU CA C 17 57.281 57.281 56.693 0.588 17635 91 1 . 1 1 17 17 GLU CB C 17 30.436 30.436 29.284 1.152 17635 92 1 . 1 1 17 17 GLU H H 17 8.134 8.134 8.482 -0.348 17635 93 1 . 1 1 18 18 ASN N N 18 116.660 116.660 114.895 1.765 17635 94 1 . 1 1 18 18 ASN HA H 18 4.941 4.941 4.623 0.318 17635 95 1 . 1 1 18 18 ASN C C 18 175.900 175.900 174.254 1.646 17635 96 1 . 1 1 18 18 ASN CA C 18 52.478 52.478 52.710 -0.232 17635 97 1 . 1 1 18 18 ASN CB C 18 38.485 38.485 39.247 -0.762 17635 98 1 . 1 1 18 18 ASN H H 18 8.407 8.407 7.869 0.538 17635 99 1 . 1 1 19 19 VAL N N 19 118.323 118.323 122.108 -3.785 17635 100 1 . 1 1 19 19 VAL HA H 19 4.152 4.152 3.775 0.377 17635 101 1 . 1 1 19 19 VAL C C 19 177.655 177.655 174.925 2.730 17635 102 1 . 1 1 19 19 VAL CA C 19 61.877 61.877 63.295 -1.418 17635 103 1 . 1 1 19 19 VAL CB C 19 32.513 32.513 30.354 2.159 17635 104 1 . 1 1 19 19 VAL H H 19 6.855 6.855 7.834 -0.979 17635 105 1 . 1 1 20 20 THR N N 20 111.636 111.636 117.220 -5.584 17635 106 1 . 1 1 20 20 THR HA H 20 4.719 4.719 4.595 0.124 17635 107 1 . 1 1 20 20 THR C C 20 175.266 175.266 174.809 0.457 17635 108 1 . 1 1 20 20 THR CA C 20 58.698 58.698 59.949 -1.251 17635 109 1 . 1 1 20 20 THR CB C 20 72.948 72.948 71.917 1.031 17635 110 1 . 1 1 20 20 THR H H 20 7.328 7.328 7.790 -0.462 17635 111 1 . 1 1 21 21 ILE N N 21 122.147 122.147 123.355 -1.208 17635 112 1 . 1 1 21 21 ILE HA H 21 3.518 3.518 3.753 -0.235 17635 113 1 . 1 1 21 21 ILE C C 21 173.198 173.198 177.585 -4.387 17635 114 1 . 1 1 21 21 ILE CA C 21 65.772 65.772 64.672 1.100 17635 115 1 . 1 1 21 21 ILE CB C 21 37.583 37.583 37.302 0.281 17635 116 1 . 1 1 21 21 ILE H H 21 9.074 9.074 8.720 0.354 17635 117 1 . 1 1 22 22 GLU N N 22 118.154 118.154 120.170 -2.016 17635 118 1 . 1 1 22 22 GLU HA H 22 3.986 3.986 4.068 -0.082 17635 119 1 . 1 1 22 22 GLU C C 22 171.799 171.799 178.687 -6.888 17635 120 1 . 1 1 22 22 GLU CA C 22 60.613 60.613 59.658 0.955 17635 121 1 . 1 1 22 22 GLU CB C 22 28.791 28.791 28.474 0.317 17635 122 1 . 1 1 22 22 GLU H H 22 8.814 8.814 8.607 0.208 17635 123 1 . 1 1 23 23 SER N N 23 115.921 115.921 115.350 0.571 17635 124 1 . 1 1 23 23 SER HA H 23 4.384 4.384 4.347 0.037 17635 125 1 . 1 1 23 23 SER C C 23 172.447 172.447 176.687 -4.240 17635 126 1 . 1 1 23 23 SER CA C 23 61.239 61.239 61.405 -0.166 17635 127 1 . 1 1 23 23 SER CB C 23 62.838 62.838 62.847 -0.009 17635 128 1 . 1 1 23 23 SER H H 23 8.236 8.236 8.128 0.108 17635 129 1 . 1 1 24 24 VAL N N 24 124.867 124.867 122.128 2.739 17635 130 1 . 1 1 24 24 VAL HA H 24 3.748 3.748 4.166 -0.418 17635 131 1 . 1 1 24 24 VAL C C 24 173.016 173.016 177.804 -4.788 17635 132 1 . 1 1 24 24 VAL CA C 24 67.254 67.254 66.181 1.073 17635 133 1 . 1 1 24 24 VAL CB C 24 31.533 31.533 31.629 -0.096 17635 134 1 . 1 1 24 24 VAL H H 24 7.973 7.973 8.135 -0.162 17635 135 1 . 1 1 25 25 ALA N N 25 123.198 123.198 121.589 1.609 17635 136 1 . 1 1 25 25 ALA HA H 25 3.899 3.899 4.060 -0.161 17635 137 1 . 1 1 25 25 ALA C C 25 171.061 171.061 178.711 -7.650 17635 138 1 . 1 1 25 25 ALA CA C 25 55.695 55.695 54.983 0.712 17635 139 1 . 1 1 25 25 ALA CB C 25 17.738 17.738 18.325 -0.587 17635 140 1 . 1 1 25 25 ALA H H 25 8.695 8.695 8.511 0.184 17635 141 1 . 1 1 26 26 ASP N N 26 115.503 115.503 118.242 -2.739 17635 142 1 . 1 1 26 26 ASP HA H 26 4.323 4.323 4.530 -0.207 17635 143 1 . 1 1 26 26 ASP C C 26 173.108 173.108 178.164 -5.056 17635 144 1 . 1 1 26 26 ASP CA C 26 57.323 57.323 56.736 0.587 17635 145 1 . 1 1 26 26 ASP CB C 26 41.052 41.052 41.321 -0.269 17635 146 1 . 1 1 26 26 ASP H H 26 8.312 8.312 8.153 0.159 17635 147 1 . 1 1 27 27 TYR N N 27 119.224 119.224 118.311 0.913 17635 148 1 . 1 1 27 27 TYR HA H 27 4.200 4.200 4.570 -0.370 17635 149 1 . 1 1 27 27 TYR C C 27 172.908 172.908 176.105 -3.197 17635 150 1 . 1 1 27 27 TYR CA C 27 61.016 61.016 58.861 2.155 17635 151 1 . 1 1 27 27 TYR CB C 27 39.932 39.932 39.220 0.712 17635 152 1 . 1 1 27 27 TYR H H 27 7.533 7.533 7.860 -0.327 17635 153 1 . 1 1 28 28 PHE N N 28 112.595 112.595 119.336 -6.741 17635 154 1 . 1 1 28 28 PHE HA H 28 4.330 4.330 4.088 0.242 17635 155 1 . 1 1 28 28 PHE C C 28 173.082 173.082 174.941 -1.859 17635 156 1 . 1 1 28 28 PHE CA C 28 61.784 61.784 56.357 5.427 17635 157 1 . 1 1 28 28 PHE CB C 28 40.003 40.003 38.711 1.292 17635 158 1 . 1 1 28 28 PHE H H 28 7.974 7.974 8.094 -0.120 17635 159 1 . 1 1 29 29 LYS N N 29 118.820 118.820 117.688 1.132 17635 160 1 . 1 1 29 29 LYS HA H 29 4.917 4.917 4.770 0.147 17635 161 1 . 1 1 29 29 LYS C C 29 173.682 173.682 176.622 -2.940 17635 162 1 . 1 1 29 29 LYS CA C 29 58.280 58.280 55.924 2.356 17635 163 1 . 1 1 29 29 LYS CB C 29 31.291 31.291 31.903 -0.612 17635 164 1 . 1 1 29 29 LYS H H 29 8.325 8.325 7.669 0.655 17635 165 1 . 1 1 30 30 GLN N N 30 116.232 116.232 118.254 -2.022 17635 166 1 . 1 1 30 30 GLN HA H 30 4.135 4.135 4.269 -0.134 17635 167 1 . 1 1 30 30 GLN C C 30 173.790 173.790 176.984 -3.194 17635 168 1 . 1 1 30 30 GLN CA C 30 57.546 57.546 57.437 0.109 17635 169 1 . 1 1 30 30 GLN CB C 30 29.898 29.898 28.905 0.993 17635 170 1 . 1 1 30 30 GLN H H 30 7.518 7.518 8.097 -0.579 17635 171 1 . 1 1 31 31 ILE N N 31 116.489 116.489 118.850 -2.361 17635 172 1 . 1 1 31 31 ILE HA H 31 4.239 4.239 4.032 0.207 17635 173 1 . 1 1 31 31 ILE C C 31 175.599 175.599 175.512 0.087 17635 174 1 . 1 1 31 31 ILE CA C 31 58.221 58.221 61.672 -3.451 17635 175 1 . 1 1 31 31 ILE CB C 31 40.334 40.334 38.642 1.692 17635 176 1 . 1 1 31 31 ILE H H 31 7.809 7.809 8.150 -0.341 17635 177 1 . 1 1 32 32 GLY N N 32 107.416 107.416 104.960 2.456 17635 178 1 . 1 1 32 32 GLY C C 32 180.182 180.182 172.149 8.033 17635 179 1 . 1 1 32 32 GLY CA C 32 44.994 44.994 44.562 0.432 17635 180 1 . 1 1 32 32 GLY H H 32 7.344 7.344 7.496 -0.152 17635 181 1 . 1 1 33 33 ILE N N 33 117.784 117.784 120.964 -3.180 17635 182 1 . 1 1 33 33 ILE HA H 33 4.089 4.089 4.414 -0.325 17635 183 1 . 1 1 33 33 ILE C C 33 173.301 173.301 175.264 -1.963 17635 184 1 . 1 1 33 33 ILE CA C 33 61.641 61.641 60.692 0.949 17635 185 1 . 1 1 33 33 ILE CB C 33 38.659 38.659 39.090 -0.431 17635 186 1 . 1 1 33 33 ILE H H 33 8.173 8.173 8.263 -0.090 17635 187 1 . 1 1 34 34 ILE N N 34 131.781 131.781 127.327 4.454 17635 188 1 . 1 1 34 34 ILE HA H 34 3.787 3.787 4.179 -0.392 17635 189 1 . 1 1 34 34 ILE C C 34 174.663 174.663 176.044 -1.381 17635 190 1 . 1 1 34 34 ILE CA C 34 61.370 61.370 60.494 0.876 17635 191 1 . 1 1 34 34 ILE CB C 34 37.995 37.995 38.620 -0.625 17635 192 1 . 1 1 34 34 ILE H H 34 8.687 8.687 8.591 0.096 17635 193 1 . 1 1 35 35 LYS N N 35 130.372 130.372 128.728 1.644 17635 194 1 . 1 1 35 35 LYS HA H 35 4.084 4.084 4.184 -0.100 17635 195 1 . 1 1 35 35 LYS C C 35 175.376 175.376 176.459 -1.083 17635 196 1 . 1 1 35 35 LYS CA C 35 57.473 57.473 56.941 0.532 17635 197 1 . 1 1 35 35 LYS CB C 35 33.664 33.664 31.272 2.392 17635 198 1 . 1 1 35 35 LYS H H 35 8.680 8.680 8.631 0.050 17635 199 1 . 1 1 36 36 THR N N 36 118.312 118.312 120.203 -1.891 17635 200 1 . 1 1 36 36 THR HA H 36 4.415 4.415 4.294 0.121 17635 201 1 . 1 1 36 36 THR C C 36 176.394 176.394 174.353 2.041 17635 202 1 . 1 1 36 36 THR CA C 36 61.340 61.340 62.756 -1.416 17635 203 1 . 1 1 36 36 THR CB C 36 70.809 70.809 69.616 1.193 17635 204 1 . 1 1 36 36 THR H H 36 8.456 8.456 8.157 0.299 17635 205 1 . 1 1 37 37 ASN N N 37 124.092 124.092 121.859 2.233 17635 206 1 . 1 1 37 37 ASN HA H 37 4.530 4.530 4.797 -0.267 17635 207 1 . 1 1 37 37 ASN C C 37 174.235 174.235 175.784 -1.549 17635 208 1 . 1 1 37 37 ASN CA C 37 53.064 53.064 52.271 0.793 17635 209 1 . 1 1 37 37 ASN CB C 37 38.927 38.927 39.897 -0.970 17635 210 1 . 1 1 37 37 ASN H H 37 8.794 8.794 8.826 -0.032 17635 211 1 . 1 1 38 38 LYS N N 38 127.969 127.969 122.487 5.482 17635 212 1 . 1 1 38 38 LYS HA H 38 4.004 4.004 4.215 -0.211 17635 213 1 . 1 1 38 38 LYS C C 38 172.702 172.702 176.817 -4.115 17635 214 1 . 1 1 38 38 LYS CA C 38 58.458 58.458 58.407 0.051 17635 215 1 . 1 1 38 38 LYS CB C 38 32.167 32.167 31.891 0.275 17635 216 1 . 1 1 38 38 LYS H H 38 8.962 8.962 8.665 0.297 17635 217 1 . 1 1 39 39 LYS N N 39 117.413 117.413 118.413 -1.000 17635 218 1 . 1 1 39 39 LYS HA H 39 4.258 4.258 4.299 -0.041 17635 219 1 . 1 1 39 39 LYS C C 39 172.261 172.261 177.422 -5.161 17635 220 1 . 1 1 39 39 LYS CA C 39 58.319 58.319 58.104 0.215 17635 221 1 . 1 1 39 39 LYS CB C 39 32.797 32.797 32.603 0.194 17635 222 1 . 1 1 39 39 LYS H H 39 8.314 8.314 8.123 0.191 17635 223 1 . 1 1 40 40 THR N N 40 105.547 105.547 108.892 -3.345 17635 224 1 . 1 1 40 40 THR HA H 40 4.465 4.465 4.485 -0.020 17635 225 1 . 1 1 40 40 THR C C 40 174.021 174.021 175.687 -1.666 17635 226 1 . 1 1 40 40 THR CA C 40 61.260 61.260 61.837 -0.577 17635 227 1 . 1 1 40 40 THR CB C 40 70.997 70.997 69.954 1.043 17635 228 1 . 1 1 40 40 THR H H 40 7.422 7.422 7.716 -0.294 17635 229 1 . 1 1 41 41 GLY N N 41 111.631 111.631 111.298 0.333 17635 230 1 . 1 1 41 41 GLY C C 41 176.727 176.727 173.618 3.109 17635 231 1 . 1 1 41 41 GLY CA C 41 45.730 45.730 45.452 0.279 17635 232 1 . 1 1 41 41 GLY H H 41 8.644 8.644 8.448 0.196 17635 233 1 . 1 1 42 42 GLN N N 42 118.894 118.894 118.697 0.197 17635 234 1 . 1 1 42 42 GLN HA H 42 4.669 4.669 4.842 -0.173 17635 235 1 . 1 1 42 42 GLN C C 42 177.178 177.178 173.464 3.714 17635 236 1 . 1 1 42 42 GLN CA C 42 53.581 53.581 52.413 1.168 17635 237 1 . 1 1 42 42 GLN CB C 42 29.230 29.230 29.629 -0.399 17635 238 1 . 1 1 42 42 GLN H H 42 7.662 7.662 7.808 -0.146 17635 239 1 . 1 1 43 43 PRO HA H 43 4.595 4.595 4.290 0.305 17635 240 1 . 1 1 43 43 PRO C C 43 172.629 172.629 176.136 -3.507 17635 241 1 . 1 1 43 43 PRO CA C 43 62.822 62.822 63.824 -1.002 17635 242 1 . 1 1 43 43 PRO CB C 43 32.696 32.696 32.094 0.602 17635 243 1 . 1 1 44 44 MET N N 44 124.162 124.162 121.294 2.868 17635 244 1 . 1 1 44 44 MET HA H 44 4.432 4.432 4.647 -0.215 17635 245 1 . 1 1 44 44 MET C C 44 176.474 176.474 174.653 1.821 17635 246 1 . 1 1 44 44 MET CA C 44 55.419 55.419 54.790 0.629 17635 247 1 . 1 1 44 44 MET CB C 44 30.555 30.555 35.152 -4.597 17635 248 1 . 1 1 44 44 MET H H 44 8.874 8.874 8.428 0.446 17635 249 1 . 1 1 45 45 ILE N N 45 126.237 126.237 122.552 3.685 17635 250 1 . 1 1 45 45 ILE HA H 45 4.802 4.802 4.536 0.266 17635 251 1 . 1 1 45 45 ILE C C 45 176.415 176.415 174.327 2.088 17635 252 1 . 1 1 45 45 ILE CA C 45 59.216 59.216 60.009 -0.792 17635 253 1 . 1 1 45 45 ILE CB C 45 42.226 42.226 42.461 -0.235 17635 254 1 . 1 1 45 45 ILE H H 45 7.730 7.730 8.382 -0.652 17635 255 1 . 1 1 46 46 ASN N N 46 124.735 124.735 124.143 0.592 17635 256 1 . 1 1 46 46 ASN HA H 46 4.941 4.941 4.977 -0.036 17635 257 1 . 1 1 46 46 ASN C C 46 176.836 176.836 173.642 3.194 17635 258 1 . 1 1 46 46 ASN CA C 46 51.561 51.561 52.100 -0.539 17635 259 1 . 1 1 46 46 ASN CB C 46 40.470 40.470 40.279 0.191 17635 260 1 . 1 1 46 46 ASN H H 46 8.384 8.384 8.744 -0.360 17635 261 1 . 1 1 47 47 LEU N N 47 122.487 122.487 121.099 1.388 17635 262 1 . 1 1 47 47 LEU HA H 47 4.715 4.715 4.798 -0.083 17635 263 1 . 1 1 47 47 LEU C C 47 174.190 174.190 176.035 -1.845 17635 264 1 . 1 1 47 47 LEU CA C 47 53.332 53.332 53.983 -0.651 17635 265 1 . 1 1 47 47 LEU CB C 47 42.277 42.277 44.417 -2.140 17635 266 1 . 1 1 47 47 LEU H H 47 8.594 8.594 8.241 0.353 17635 267 1 . 1 1 48 48 TYR N N 48 121.842 121.842 122.402 -0.560 17635 268 1 . 1 1 48 48 TYR HA H 48 4.767 4.767 4.790 -0.023 17635 269 1 . 1 1 48 48 TYR C C 48 173.649 173.649 175.212 -1.563 17635 270 1 . 1 1 48 48 TYR CA C 48 57.894 57.894 56.940 0.954 17635 271 1 . 1 1 48 48 TYR CB C 48 39.199 39.199 39.133 0.066 17635 272 1 . 1 1 48 48 TYR H H 48 7.666 7.666 8.718 -1.052 17635 273 1 . 1 1 49 49 THR N N 49 116.554 116.554 114.201 2.353 17635 274 1 . 1 1 49 49 THR HA H 49 4.806 4.806 4.582 0.225 17635 275 1 . 1 1 49 49 THR C C 49 176.654 176.654 173.574 3.080 17635 276 1 . 1 1 49 49 THR CA C 49 60.693 60.693 59.795 0.898 17635 277 1 . 1 1 49 49 THR CB C 49 71.437 71.437 71.132 0.305 17635 278 1 . 1 1 49 49 THR H H 49 8.965 8.965 8.223 0.742 17635 279 1 . 1 1 50 50 ASP N N 50 123.826 123.826 122.737 1.089 17635 280 1 . 1 1 50 50 ASP HA H 50 4.624 4.624 4.678 -0.054 17635 281 1 . 1 1 50 50 ASP C C 50 173.380 173.380 176.449 -3.069 17635 282 1 . 1 1 50 50 ASP CA C 50 54.088 54.088 54.478 -0.390 17635 283 1 . 1 1 50 50 ASP CB C 50 42.867 42.867 41.905 0.962 17635 284 1 . 1 1 50 50 ASP H H 50 8.939 8.939 8.636 0.304 17635 285 1 . 1 1 51 51 ARG N N 51 127.794 127.794 123.845 3.949 17635 286 1 . 1 1 51 51 ARG HA H 51 4.045 4.045 4.250 -0.205 17635 287 1 . 1 1 51 51 ARG C C 51 173.101 173.101 176.332 -3.231 17635 288 1 . 1 1 51 51 ARG CA C 51 58.562 58.562 57.230 1.332 17635 289 1 . 1 1 51 51 ARG CB C 51 30.167 30.167 29.742 0.425 17635 290 1 . 1 1 51 51 ARG H H 51 8.958 8.958 8.591 0.367 17635 291 1 . 1 1 52 52 GLU N N 52 117.542 117.542 118.306 -0.764 17635 292 1 . 1 1 52 52 GLU HA H 52 4.278 4.278 4.339 -0.061 17635 293 1 . 1 1 52 52 GLU C C 52 172.201 172.201 176.925 -4.724 17635 294 1 . 1 1 52 52 GLU CA C 52 58.524 58.524 57.474 1.050 17635 295 1 . 1 1 52 52 GLU CB C 52 30.278 30.278 29.838 0.439 17635 296 1 . 1 1 52 52 GLU H H 52 8.561 8.561 8.238 0.323 17635 297 1 . 1 1 53 53 THR N N 53 107.065 107.065 111.560 -4.495 17635 298 1 . 1 1 53 53 THR HA H 53 4.436 4.436 4.413 0.023 17635 299 1 . 1 1 53 53 THR C C 53 173.851 173.851 175.233 -1.382 17635 300 1 . 1 1 53 53 THR CA C 53 61.944 61.944 62.494 -0.550 17635 301 1 . 1 1 53 53 THR CB C 53 71.197 71.197 69.752 1.445 17635 302 1 . 1 1 53 53 THR H H 53 8.087 8.087 7.945 0.143 17635 303 1 . 1 1 54 54 GLY N N 54 111.295 111.295 109.806 1.489 17635 304 1 . 1 1 54 54 GLY C C 54 176.747 176.747 174.268 2.479 17635 305 1 . 1 1 54 54 GLY CA C 54 45.703 45.703 45.129 0.574 17635 306 1 . 1 1 54 54 GLY H H 54 8.423 8.423 7.935 0.488 17635 307 1 . 1 1 55 55 LYS N N 55 119.673 119.673 120.380 -0.707 17635 308 1 . 1 1 55 55 LYS HA H 55 4.353 4.353 4.424 -0.071 17635 309 1 . 1 1 55 55 LYS C C 55 173.854 173.854 176.002 -2.148 17635 310 1 . 1 1 55 55 LYS CA C 55 55.842 55.842 55.776 0.066 17635 311 1 . 1 1 55 55 LYS CB C 55 33.821 33.821 33.528 0.293 17635 312 1 . 1 1 55 55 LYS H H 55 7.767 7.767 7.871 -0.104 17635 313 1 . 1 1 56 56 LEU N N 56 122.426 122.426 119.612 2.814 17635 314 1 . 1 1 56 56 LEU HA H 56 4.356 4.356 4.424 -0.068 17635 315 1 . 1 1 56 56 LEU C C 56 172.534 172.534 176.694 -4.160 17635 316 1 . 1 1 56 56 LEU CA C 56 56.255 56.255 54.481 1.774 17635 317 1 . 1 1 56 56 LEU CB C 56 41.654 41.654 42.628 -0.974 17635 318 1 . 1 1 56 56 LEU H H 56 8.768 8.768 8.279 0.489 17635 319 1 . 1 1 57 57 LYS N N 57 118.264 118.264 120.823 -2.559 17635 320 1 . 1 1 57 57 LYS HA H 57 4.288 4.288 4.334 -0.046 17635 321 1 . 1 1 57 57 LYS C C 57 173.648 173.648 177.171 -3.523 17635 322 1 . 1 1 57 57 LYS CA C 57 56.264 56.264 56.537 -0.273 17635 323 1 . 1 1 57 57 LYS CB C 57 34.062 34.062 32.889 1.173 17635 324 1 . 1 1 57 57 LYS H H 57 8.012 8.012 8.429 -0.417 17635 325 1 . 1 1 58 58 GLY N N 58 108.514 108.514 108.128 0.386 17635 326 1 . 1 1 58 58 GLY C C 58 177.876 177.876 172.810 5.066 17635 327 1 . 1 1 58 58 GLY CA C 58 46.364 46.364 45.342 1.022 17635 328 1 . 1 1 58 58 GLY H H 58 8.334 8.334 8.274 0.060 17635 329 1 . 1 1 59 59 GLU N N 59 116.119 116.119 118.622 -2.504 17635 330 1 . 1 1 59 59 GLU HA H 59 5.521 5.521 5.127 0.394 17635 331 1 . 1 1 59 59 GLU C C 59 173.860 173.860 173.799 0.061 17635 332 1 . 1 1 59 59 GLU CA C 59 53.025 53.025 55.021 -1.996 17635 333 1 . 1 1 59 59 GLU CB C 59 34.304 34.304 33.438 0.866 17635 334 1 . 1 1 59 59 GLU H H 59 7.202 7.202 7.763 -0.561 17635 335 1 . 1 1 60 60 ALA N N 60 123.607 123.607 124.938 -1.331 17635 336 1 . 1 1 60 60 ALA HA H 60 5.607 5.607 5.043 0.564 17635 337 1 . 1 1 60 60 ALA C C 60 173.923 173.923 175.165 -1.242 17635 338 1 . 1 1 60 60 ALA CA C 60 50.943 50.943 51.357 -0.414 17635 339 1 . 1 1 60 60 ALA CB C 60 24.059 24.059 23.030 1.029 17635 340 1 . 1 1 60 60 ALA H H 60 8.930 8.930 9.089 -0.159 17635 341 1 . 1 1 61 61 THR N N 61 108.384 108.384 114.373 -5.989 17635 342 1 . 1 1 61 61 THR HA H 61 5.743 5.743 4.808 0.935 17635 343 1 . 1 1 61 61 THR C C 61 176.172 176.172 173.775 2.397 17635 344 1 . 1 1 61 61 THR CA C 61 59.625 59.625 60.280 -0.655 17635 345 1 . 1 1 61 61 THR CB C 61 71.224 71.224 69.881 1.343 17635 346 1 . 1 1 61 61 THR H H 61 8.452 8.452 8.640 -0.188 17635 347 1 . 1 1 62 62 VAL N N 62 120.200 120.200 126.501 -6.301 17635 348 1 . 1 1 62 62 VAL HA H 62 4.244 4.244 4.091 0.153 17635 349 1 . 1 1 62 62 VAL C C 62 175.994 175.994 174.713 1.281 17635 350 1 . 1 1 62 62 VAL CA C 62 61.426 61.426 61.200 0.226 17635 351 1 . 1 1 62 62 VAL CB C 62 34.685 34.685 33.270 1.415 17635 352 1 . 1 1 62 62 VAL H H 62 8.071 8.071 8.317 -0.246 17635 353 1 . 1 1 63 63 SER N N 63 121.689 121.689 122.529 -0.840 17635 354 1 . 1 1 63 63 SER HA H 63 5.261 5.261 4.659 0.602 17635 355 1 . 1 1 63 63 SER C C 63 177.943 177.943 173.443 4.500 17635 356 1 . 1 1 63 63 SER CA C 63 57.662 57.662 57.544 0.118 17635 357 1 . 1 1 63 63 SER CB C 63 64.427 64.427 64.183 0.244 17635 358 1 . 1 1 63 63 SER H H 63 7.695 7.695 8.132 -0.437 17635 359 1 . 1 1 64 64 PHE N N 64 122.640 122.640 122.751 -0.111 17635 360 1 . 1 1 64 64 PHE HA H 64 4.854 4.854 4.876 -0.022 17635 361 1 . 1 1 64 64 PHE C C 64 174.605 174.605 175.779 -1.174 17635 362 1 . 1 1 64 64 PHE CA C 64 58.204 58.204 57.422 0.782 17635 363 1 . 1 1 64 64 PHE CB C 64 41.976 41.976 42.297 -0.321 17635 364 1 . 1 1 64 64 PHE H H 64 9.025 9.025 8.433 0.592 17635 365 1 . 1 1 65 65 ASP N N 65 119.943 119.943 121.522 -1.579 17635 366 1 . 1 1 65 65 ASP HA H 65 4.435 4.435 4.599 -0.164 17635 367 1 . 1 1 65 65 ASP C C 65 174.396 174.396 175.920 -1.524 17635 368 1 . 1 1 65 65 ASP CA C 65 57.442 57.442 55.838 1.604 17635 369 1 . 1 1 65 65 ASP CB C 65 42.034 42.034 41.856 0.178 17635 370 1 . 1 1 65 65 ASP H H 65 8.512 8.512 8.951 -0.439 17635 371 1 . 1 1 66 66 ASP N N 66 116.125 116.125 118.408 -2.283 17635 372 1 . 1 1 66 66 ASP HA H 66 5.399 5.399 5.068 0.331 17635 373 1 . 1 1 66 66 ASP C C 66 175.936 175.936 174.812 1.124 17635 374 1 . 1 1 66 66 ASP CA C 66 50.793 50.793 51.454 -0.661 17635 375 1 . 1 1 66 66 ASP CB C 66 42.919 42.919 42.429 0.490 17635 376 1 . 1 1 66 66 ASP H H 66 8.323 8.323 7.857 0.466 17635 377 1 . 1 1 67 67 PRO HA H 67 4.450 4.450 4.415 0.035 17635 378 1 . 1 1 67 67 PRO CA C 67 66.924 66.924 66.463 0.461 17635 379 1 . 1 1 67 67 PRO CB C 67 29.830 29.830 30.403 -0.573 17635 380 1 . 1 1 68 68 PRO HA H 68 4.419 4.419 4.268 0.151 17635 381 1 . 1 1 68 68 PRO C C 68 171.345 171.345 178.962 -7.617 17635 382 1 . 1 1 68 68 PRO CA C 68 66.235 66.235 66.012 0.223 17635 383 1 . 1 1 68 68 PRO CB C 68 30.997 30.997 31.014 -0.017 17635 384 1 . 1 1 69 69 SER N N 69 114.544 114.544 114.362 0.182 17635 385 1 . 1 1 69 69 SER HA H 69 4.036 4.036 3.969 0.067 17635 386 1 . 1 1 69 69 SER C C 69 176.535 176.535 176.017 0.518 17635 387 1 . 1 1 69 69 SER CA C 69 61.837 61.837 61.419 0.418 17635 388 1 . 1 1 69 69 SER CB C 69 62.773 62.773 62.523 0.250 17635 389 1 . 1 1 69 69 SER H H 69 8.004 8.004 8.069 -0.065 17635 390 1 . 1 1 70 70 ALA N N 70 122.649 122.649 124.076 -1.427 17635 391 1 . 1 1 70 70 ALA HA H 70 3.593 3.593 3.729 -0.136 17635 392 1 . 1 1 70 70 ALA C C 70 172.686 172.686 179.341 -6.655 17635 393 1 . 1 1 70 70 ALA CA C 70 55.036 55.036 55.283 -0.247 17635 394 1 . 1 1 70 70 ALA CB C 70 17.864 17.864 18.232 -0.368 17635 395 1 . 1 1 70 70 ALA H H 70 7.383 7.383 7.576 -0.193 17635 396 1 . 1 1 71 71 LYS N N 71 116.308 116.308 119.574 -3.266 17635 397 1 . 1 1 71 71 LYS HA H 71 3.775 3.775 3.812 -0.037 17635 398 1 . 1 1 71 71 LYS C C 71 172.333 172.333 178.562 -6.229 17635 399 1 . 1 1 71 71 LYS CA C 71 59.002 59.002 58.369 0.633 17635 400 1 . 1 1 71 71 LYS CB C 71 32.442 32.442 31.973 0.469 17635 401 1 . 1 1 71 71 LYS H H 71 7.159 7.159 7.493 -0.334 17635 402 1 . 1 1 72 72 ALA N N 72 119.806 119.806 120.777 -0.971 17635 403 1 . 1 1 72 72 ALA HA H 72 4.166 4.166 4.067 0.099 17635 404 1 . 1 1 72 72 ALA C C 72 170.530 170.530 179.702 -9.172 17635 405 1 . 1 1 72 72 ALA CA C 72 54.715 54.715 54.866 -0.151 17635 406 1 . 1 1 72 72 ALA CB C 72 17.820 17.820 18.004 -0.184 17635 407 1 . 1 1 72 72 ALA H H 72 7.924 7.924 8.112 -0.188 17635 408 1 . 1 1 73 73 ALA N N 73 120.524 120.524 121.188 -0.664 17635 409 1 . 1 1 73 73 ALA HA H 73 4.279 4.279 4.066 0.213 17635 410 1 . 1 1 73 73 ALA C C 73 171.039 171.039 179.557 -8.518 17635 411 1 . 1 1 73 73 ALA CA C 73 55.379 55.379 54.935 0.444 17635 412 1 . 1 1 73 73 ALA CB C 73 19.131 19.131 18.669 0.462 17635 413 1 . 1 1 73 73 ALA H H 73 8.104 8.104 7.630 0.475 17635 414 1 . 1 1 74 74 ILE N N 74 119.875 119.875 118.166 1.709 17635 415 1 . 1 1 74 74 ILE HA H 74 3.414 3.414 3.791 -0.377 17635 416 1 . 1 1 74 74 ILE C C 74 172.435 172.435 177.671 -5.236 17635 417 1 . 1 1 74 74 ILE CA C 74 65.844 65.844 65.169 0.675 17635 418 1 . 1 1 74 74 ILE CB C 74 38.743 38.743 37.700 1.043 17635 419 1 . 1 1 74 74 ILE H H 74 7.574 7.574 7.857 -0.283 17635 420 1 . 1 1 75 75 ASP N N 75 117.867 117.867 118.178 -0.311 17635 421 1 . 1 1 75 75 ASP HA H 75 4.311 4.311 4.432 -0.121 17635 422 1 . 1 1 75 75 ASP C C 75 172.054 172.054 176.644 -4.590 17635 423 1 . 1 1 75 75 ASP CA C 75 57.161 57.161 56.768 0.393 17635 424 1 . 1 1 75 75 ASP CB C 75 40.531 40.531 41.292 -0.761 17635 425 1 . 1 1 75 75 ASP H H 75 7.937 7.937 8.024 -0.087 17635 426 1 . 1 1 76 76 TRP N N 76 117.313 117.313 120.436 -3.123 17635 427 1 . 1 1 76 76 TRP HA H 76 4.356 4.356 4.439 -0.083 17635 428 1 . 1 1 76 76 TRP C C 76 173.272 173.272 176.824 -3.552 17635 429 1 . 1 1 76 76 TRP CA C 76 59.462 59.462 58.498 0.964 17635 430 1 . 1 1 76 76 TRP CB C 76 30.777 30.777 29.649 1.128 17635 431 1 . 1 1 76 76 TRP H H 76 8.475 8.475 7.595 0.880 17635 432 1 . 1 1 77 77 PHE N N 77 112.019 112.019 117.154 -5.135 17635 433 1 . 1 1 77 77 PHE HA H 77 4.648 4.648 4.203 0.445 17635 434 1 . 1 1 77 77 PHE C C 77 173.747 173.747 176.045 -2.298 17635 435 1 . 1 1 77 77 PHE CA C 77 59.921 59.921 60.163 -0.242 17635 436 1 . 1 1 77 77 PHE CB C 77 40.730 40.730 38.445 2.285 17635 437 1 . 1 1 77 77 PHE H H 77 8.488 8.488 7.507 0.981 17635 438 1 . 1 1 78 78 ASP N N 78 118.408 118.408 119.658 -1.250 17635 439 1 . 1 1 78 78 ASP HA H 78 4.464 4.464 4.526 -0.062 17635 440 1 . 1 1 78 78 ASP C C 78 172.542 172.542 176.460 -3.918 17635 441 1 . 1 1 78 78 ASP CA C 78 58.690 58.690 55.110 3.580 17635 442 1 . 1 1 78 78 ASP CB C 78 41.886 41.886 39.817 2.069 17635 443 1 . 1 1 78 78 ASP H H 78 7.978 7.978 8.498 -0.520 17635 444 1 . 1 1 79 79 GLY N N 79 115.548 115.548 104.410 11.138 17635 445 1 . 1 1 79 79 GLY C C 79 175.680 175.680 173.649 2.031 17635 446 1 . 1 1 79 79 GLY CA C 79 46.072 46.072 44.981 1.091 17635 447 1 . 1 1 79 79 GLY H H 79 8.615 8.615 8.439 0.176 17635 448 1 . 1 1 80 80 LYS N N 80 120.271 120.271 119.149 1.122 17635 449 1 . 1 1 80 80 LYS HA H 80 4.462 4.462 4.524 -0.062 17635 450 1 . 1 1 80 80 LYS C C 80 175.853 175.853 175.204 0.649 17635 451 1 . 1 1 80 80 LYS CA C 80 55.150 55.150 55.034 0.116 17635 452 1 . 1 1 80 80 LYS CB C 80 32.426 32.426 34.002 -1.576 17635 453 1 . 1 1 80 80 LYS H H 80 8.013 8.013 7.970 0.043 17635 454 1 . 1 1 81 81 GLU N N 81 115.765 115.765 118.382 -2.617 17635 455 1 . 1 1 81 81 GLU HA H 81 4.698 4.698 5.140 -0.442 17635 456 1 . 1 1 81 81 GLU C C 81 173.263 173.263 175.689 -2.426 17635 457 1 . 1 1 81 81 GLU CA C 81 55.924 55.924 55.171 0.753 17635 458 1 . 1 1 81 81 GLU CB C 81 32.042 32.042 31.581 0.461 17635 459 1 . 1 1 81 81 GLU H H 81 8.201 8.201 8.457 -0.256 17635 460 1 . 1 1 82 82 PHE N N 82 127.080 127.080 125.537 1.543 17635 461 1 . 1 1 82 82 PHE HA H 82 4.496 4.496 4.467 0.029 17635 462 1 . 1 1 82 82 PHE C C 82 175.349 175.349 175.561 -0.212 17635 463 1 . 1 1 82 82 PHE CA C 82 56.716 56.716 56.209 0.507 17635 464 1 . 1 1 82 82 PHE CB C 82 41.994 41.994 39.711 2.283 17635 465 1 . 1 1 82 82 PHE H H 82 9.162 9.162 9.092 0.070 17635 466 1 . 1 1 83 83 SER N N 83 125.136 125.136 120.497 4.639 17635 467 1 . 1 1 83 83 SER HA H 83 3.803 3.803 4.148 -0.345 17635 468 1 . 1 1 83 83 SER C C 83 175.543 175.543 174.550 0.993 17635 469 1 . 1 1 83 83 SER CA C 83 58.371 58.371 59.303 -0.932 17635 470 1 . 1 1 83 83 SER CB C 83 62.519 62.519 62.527 -0.008 17635 471 1 . 1 1 83 83 SER H H 83 9.193 9.193 9.098 0.095 17635 472 1 . 1 1 84 84 GLY N N 84 103.581 103.581 105.425 -1.844 17635 473 1 . 1 1 84 84 GLY C C 84 177.188 177.188 173.658 3.530 17635 474 1 . 1 1 84 84 GLY CA C 84 45.052 45.052 44.870 0.182 17635 475 1 . 1 1 84 84 GLY H H 84 8.446 8.446 8.209 0.237 17635 476 1 . 1 1 85 85 ASN N N 85 119.051 119.051 120.112 -1.061 17635 477 1 . 1 1 85 85 ASN HA H 85 5.334 5.334 5.179 0.155 17635 478 1 . 1 1 85 85 ASN C C 85 178.020 178.020 172.723 5.297 17635 479 1 . 1 1 85 85 ASN CA C 85 50.471 50.471 51.067 -0.596 17635 480 1 . 1 1 85 85 ASN CB C 85 41.117 41.117 39.216 1.901 17635 481 1 . 1 1 85 85 ASN H H 85 7.762 7.762 8.051 -0.289 17635 482 1 . 1 1 86 86 PRO HA H 86 4.667 4.667 5.397 -0.730 17635 483 1 . 1 1 86 86 PRO C C 86 173.474 173.474 176.301 -2.827 17635 484 1 . 1 1 86 86 PRO CA C 86 62.710 62.710 62.376 0.334 17635 485 1 . 1 1 86 86 PRO CB C 86 31.870 31.870 32.777 -0.907 17635 486 1 . 1 1 87 87 ILE N N 87 117.270 117.270 116.324 0.946 17635 487 1 . 1 1 87 87 ILE HA H 87 5.146 5.146 5.374 -0.228 17635 488 1 . 1 1 87 87 ILE C C 87 174.495 174.495 174.509 -0.014 17635 489 1 . 1 1 87 87 ILE CA C 87 59.491 59.491 58.594 0.897 17635 490 1 . 1 1 87 87 ILE CB C 87 41.671 41.671 42.689 -1.018 17635 491 1 . 1 1 87 87 ILE H H 87 8.469 8.469 8.855 -0.386 17635 492 1 . 1 1 88 88 LYS N N 88 122.271 122.271 121.165 1.106 17635 493 1 . 1 1 88 88 LYS HA H 88 5.192 5.192 4.750 0.442 17635 494 1 . 1 1 88 88 LYS C C 88 174.393 174.393 175.075 -0.682 17635 495 1 . 1 1 88 88 LYS CA C 88 54.138 54.138 54.905 -0.767 17635 496 1 . 1 1 88 88 LYS CB C 88 35.049 35.049 34.373 0.676 17635 497 1 . 1 1 88 88 LYS H H 88 8.353 8.353 8.249 0.104 17635 498 1 . 1 1 89 89 VAL N N 89 125.661 125.661 125.741 -0.080 17635 499 1 . 1 1 89 89 VAL HA H 89 4.963 4.963 4.818 0.145 17635 500 1 . 1 1 89 89 VAL C C 89 177.160 177.160 176.012 1.148 17635 501 1 . 1 1 89 89 VAL CA C 89 61.361 61.361 61.792 -0.431 17635 502 1 . 1 1 89 89 VAL CB C 89 34.770 34.770 32.605 2.165 17635 503 1 . 1 1 89 89 VAL H H 89 9.414 9.414 8.583 0.831 17635 504 1 . 1 1 90 90 SER N N 90 119.538 119.538 121.401 -1.863 17635 505 1 . 1 1 90 90 SER HA H 90 4.710 4.710 4.730 -0.020 17635 506 1 . 1 1 90 90 SER C C 90 176.533 176.533 173.826 2.707 17635 507 1 . 1 1 90 90 SER CA C 90 56.936 56.936 56.718 0.218 17635 508 1 . 1 1 90 90 SER CB C 90 66.470 66.470 65.682 0.788 17635 509 1 . 1 1 90 90 SER H H 90 8.945 8.945 8.236 0.709 17635 510 1 . 1 1 91 91 PHE N N 91 120.115 120.115 121.876 -1.761 17635 511 1 . 1 1 91 91 PHE HA H 91 4.673 4.673 4.589 0.084 17635 512 1 . 1 1 91 91 PHE C C 91 173.349 173.349 175.406 -2.057 17635 513 1 . 1 1 91 91 PHE CA C 91 61.155 61.155 56.608 4.547 17635 514 1 . 1 1 91 91 PHE CB C 91 39.503 39.503 38.110 1.393 17635 515 1 . 1 1 91 91 PHE H H 91 8.919 8.919 8.647 0.271 17635 516 1 . 1 1 92 92 ALA N N 92 124.386 124.386 124.551 -0.165 17635 517 1 . 1 1 92 92 ALA HA H 92 4.356 4.356 4.008 0.348 17635 518 1 . 1 1 92 92 ALA C C 92 172.984 172.984 176.473 -3.489 17635 519 1 . 1 1 92 92 ALA CA C 92 52.098 52.098 52.584 -0.486 17635 520 1 . 1 1 92 92 ALA CB C 92 19.406 19.406 18.322 1.084 17635 521 1 . 1 1 92 92 ALA H H 92 8.563 8.563 7.939 0.624 17635 522 1 . 1 1 93 93 THR N N 93 116.073 116.073 113.531 2.542 17635 523 1 . 1 1 93 93 THR HA H 93 4.208 4.208 4.162 0.046 17635 524 1 . 1 1 93 93 THR C C 93 176.032 176.032 174.379 1.653 17635 525 1 . 1 1 93 93 THR CA C 93 62.255 62.255 62.115 0.140 17635 526 1 . 1 1 93 93 THR CB C 93 69.708 69.708 69.827 -0.119 17635 527 1 . 1 1 93 93 THR H H 93 8.312 8.312 7.894 0.418 17635 528 1 . 1 1 94 94 ARG N N 94 124.359 124.359 121.996 2.363 17635 529 1 . 1 1 94 94 ARG HA H 94 4.337 4.337 4.254 0.083 17635 530 1 . 1 1 94 94 ARG C C 94 174.426 174.426 175.816 -1.390 17635 531 1 . 1 1 94 94 ARG CA C 94 56.055 56.055 56.626 -0.571 17635 532 1 . 1 1 94 94 ARG CB C 94 30.911 30.911 30.483 0.428 17635 533 1 . 1 1 94 94 ARG H H 94 8.493 8.493 8.548 -0.055 17635 534 1 . 1 1 95 95 ARG N N 95 122.515 122.515 120.700 1.815 17635 535 1 . 1 1 95 95 ARG HA H 95 4.228 4.228 4.312 -0.084 17635 536 1 . 1 1 95 95 ARG C C 95 174.306 174.306 175.358 -1.052 17635 537 1 . 1 1 95 95 ARG CA C 95 56.142 56.142 56.134 0.008 17635 538 1 . 1 1 95 95 ARG CB C 95 30.966 30.966 29.510 1.456 17635 539 1 . 1 1 95 95 ARG H H 95 8.343 8.343 8.416 -0.073 17635 540 1 . 1 1 96 96 ALA N N 96 125.127 125.127 124.529 0.598 17635 541 1 . 1 1 96 96 ALA HA H 96 4.209 4.209 4.273 -0.064 17635 542 1 . 1 1 96 96 ALA C C 96 173.226 173.226 176.826 -3.600 17635 543 1 . 1 1 96 96 ALA CA C 96 52.770 52.770 52.198 0.572 17635 544 1 . 1 1 96 96 ALA CB C 96 19.193 19.193 19.148 0.045 17635 545 1 . 1 1 96 96 ALA H H 96 8.402 8.402 8.215 0.187 17635 546 1 . 1 1 97 97 ASP N N 97 118.483 118.483 120.266 -1.784 17635 547 1 . 1 1 97 97 ASP HA H 97 4.498 4.498 4.570 -0.072 17635 548 1 . 1 1 97 97 ASP C C 97 174.302 174.302 175.595 -1.293 17635 549 1 . 1 1 97 97 ASP CA C 97 54.091 54.091 54.672 -0.581 17635 550 1 . 1 1 97 97 ASP CB C 97 40.907 40.907 41.224 -0.317 17635 551 1 . 1 1 97 97 ASP H H 97 8.206 8.206 8.346 -0.140 17635 552 1 . 1 1 98 98 PHE N N 98 120.321 120.321 119.865 0.456 17635 553 1 . 1 1 98 98 PHE HA H 98 4.490 4.490 4.430 0.060 17635 554 1 . 1 1 98 98 PHE C C 98 174.878 174.878 174.834 0.044 17635 555 1 . 1 1 98 98 PHE CA C 98 58.160 58.160 58.145 0.015 17635 556 1 . 1 1 98 98 PHE CB C 98 39.303 39.303 39.056 0.247 17635 557 1 . 1 1 98 98 PHE H H 98 7.990 7.990 8.228 -0.238 17635 558 1 . 1 1 99 99 ASN N N 99 120.016 120.016 119.748 0.268 17635 559 1 . 1 1 99 99 ASN HA H 99 4.609 4.609 4.655 -0.046 17635 560 1 . 1 1 99 99 ASN C C 99 175.348 175.348 174.712 0.636 17635 561 1 . 1 1 99 99 ASN CA C 99 53.313 53.313 53.545 -0.232 17635 562 1 . 1 1 99 99 ASN CB C 99 38.727 38.727 38.991 -0.264 17635 563 1 . 1 1 99 99 ASN H H 99 8.336 8.336 8.436 -0.100 17635 564 1 . 1 1 100 100 ARG N N 100 121.374 121.374 120.976 0.398 17635 565 1 . 1 1 100 100 ARG HA H 100 4.273 4.273 4.361 -0.088 17635 566 1 . 1 1 100 100 ARG C C 100 173.627 173.627 176.086 -2.459 17635 567 1 . 1 1 100 100 ARG CA C 100 56.492 56.492 56.324 0.168 17635 568 1 . 1 1 100 100 ARG CB C 100 30.519 30.519 30.704 -0.185 17635 569 1 . 1 1 100 100 ARG H H 100 8.181 8.181 8.376 -0.195 17635 570 1 . 1 1 101 101 GLY N N 101 109.586 109.586 109.375 0.211 17635 571 1 . 1 1 101 101 GLY C C 101 175.739 175.739 174.143 1.596 17635 572 1 . 1 1 101 101 GLY CA C 101 45.380 45.380 44.813 0.567 17635 573 1 . 1 1 101 101 GLY H H 101 8.413 8.413 8.377 0.036 17635 574 1 . 1 1 102 102 GLY N N 102 108.692 108.692 108.994 -0.302 17635 575 1 . 1 1 102 102 GLY C C 102 176.286 176.286 174.598 1.688 17635 576 1 . 1 1 102 102 GLY CA C 102 45.338 45.338 45.060 0.278 17635 577 1 . 1 1 102 102 GLY H H 102 8.281 8.281 8.247 0.035 17635 578 1 . 1 1 103 103 GLY N N 103 108.844 108.844 108.901 -0.057 17635 579 1 . 1 1 103 103 GLY C C 103 175.798 175.798 174.004 1.794 17635 580 1 . 1 1 103 103 GLY CA C 103 45.346 45.346 44.907 0.439 17635 581 1 . 1 1 103 103 GLY H H 103 8.364 8.364 8.275 0.089 17635 582 1 . 1 1 104 104 ASN N N 104 118.527 118.527 119.158 -0.631 17635 583 1 . 1 1 104 104 ASN HA H 104 4.718 4.718 4.715 0.003 17635 584 1 . 1 1 104 104 ASN C C 104 174.547 174.547 175.674 -1.127 17635 585 1 . 1 1 104 104 ASN CA C 104 53.209 53.209 53.266 -0.057 17635 586 1 . 1 1 104 104 ASN CB C 104 38.879 38.879 39.044 -0.165 17635 587 1 . 1 1 104 104 ASN H H 104 8.438 8.438 8.483 -0.045 17635 588 1 . 1 1 105 105 GLY N N 105 109.166 109.166 109.381 -0.215 17635 589 1 . 1 1 105 105 GLY C C 105 176.074 176.074 174.011 2.063 17635 590 1 . 1 1 105 105 GLY CA C 105 45.602 45.602 45.076 0.526 17635 591 1 . 1 1 105 105 GLY H H 105 8.477 8.477 8.355 0.122 17635 592 1 . 1 1 106 106 ARG N N 106 120.341 120.341 121.609 -1.268 17635 593 1 . 1 1 106 106 ARG HA H 106 4.351 4.351 4.495 -0.144 17635 594 1 . 1 1 106 106 ARG C C 106 173.491 173.491 176.555 -3.064 17635 595 1 . 1 1 106 106 ARG CA C 106 56.227 56.227 55.900 0.327 17635 596 1 . 1 1 106 106 ARG CB C 106 30.629 30.629 30.962 -0.333 17635 597 1 . 1 1 106 106 ARG H H 106 8.244 8.244 8.174 0.070 17635 598 1 . 1 1 107 107 GLY N N 107 109.856 109.856 111.044 -1.188 17635 599 1 . 1 1 107 107 GLY C C 107 175.834 175.834 174.197 1.637 17635 600 1 . 1 1 107 107 GLY CA C 107 45.441 45.441 44.933 0.508 17635 601 1 . 1 1 107 107 GLY H H 107 8.522 8.522 8.771 -0.249 17635 stop_ save_