data_19193 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19193 _Entry.PDB_ID 2M7K 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 19193 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 5 5 LEU N N 5 120.669 120.669 117.303 3.366 19193 2 1 1 . 1 1 5 5 LEU HA H 5 4.210 4.210 4.081 0.129 19193 3 1 1 . 1 1 5 5 LEU CA C 5 58.825 58.825 56.940 1.885 19193 4 1 1 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.246 1.019 19193 5 1 1 . 1 1 5 5 LEU H H 5 7.998 7.998 7.980 0.018 19193 6 1 1 . 1 1 6 6 PHE N N 6 117.996 117.996 119.809 -1.813 19193 7 1 1 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.688 0.172 19193 8 1 1 . 1 1 6 6 PHE C C 6 175.520 175.520 176.786 -1.266 19193 9 1 1 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.145 2.068 19193 10 1 1 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.456 0.562 19193 11 1 1 . 1 1 6 6 PHE H H 6 7.276 7.276 7.999 -0.723 19193 12 1 1 . 1 1 7 7 LYS N N 7 114.616 114.616 117.186 -2.570 19193 13 1 1 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.869 0.092 19193 14 1 1 . 1 1 7 7 LYS C C 7 175.105 175.105 177.962 -2.857 19193 15 1 1 . 1 1 7 7 LYS CA C 7 58.770 58.770 57.741 1.029 19193 16 1 1 . 1 1 7 7 LYS CB C 7 32.237 32.237 31.880 0.357 19193 17 1 1 . 1 1 7 7 LYS H H 7 7.523 7.523 7.522 0.001 19193 18 1 1 . 1 1 8 8 GLU N N 8 117.996 117.996 118.400 -0.404 19193 19 1 1 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.022 -0.162 19193 20 1 1 . 1 1 8 8 GLU C C 8 174.994 174.994 178.331 -3.337 19193 21 1 1 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.639 -0.380 19193 22 1 1 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.981 -0.678 19193 23 1 1 . 1 1 8 8 GLU H H 8 7.276 7.276 7.698 -0.422 19193 24 1 1 . 1 1 9 9 ILE N N 9 117.880 117.880 116.190 1.690 19193 25 1 1 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.727 -0.285 19193 26 1 1 . 1 1 9 9 ILE C C 9 177.620 177.620 176.690 0.930 19193 27 1 1 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.214 1.197 19193 28 1 1 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.974 0.737 19193 29 1 1 . 1 1 9 9 ILE H H 9 7.166 7.166 7.449 -0.283 19193 30 1 1 . 1 1 10 10 ASP N N 10 119.154 119.154 121.591 -2.437 19193 31 1 1 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.437 -0.585 19193 32 1 1 . 1 1 10 10 ASP C C 10 174.446 174.446 176.917 -2.471 19193 33 1 1 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.341 -0.954 19193 34 1 1 . 1 1 10 10 ASP CB C 10 38.297 38.297 38.776 -0.479 19193 35 1 1 . 1 1 10 10 ASP H H 10 7.629 7.629 7.422 0.207 19193 36 1 1 . 1 1 11 11 VAL N N 11 124.080 124.080 123.006 1.074 19193 37 1 1 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.748 0.062 19193 38 1 1 . 1 1 11 11 VAL C C 11 174.883 174.883 176.684 -1.801 19193 39 1 1 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.594 0.294 19193 40 1 1 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.247 0.673 19193 41 1 1 . 1 1 11 11 VAL H H 11 7.956 7.956 7.879 0.077 19193 42 1 1 . 1 1 12 12 ASN N N 12 114.490 114.490 116.294 -1.804 19193 43 1 1 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.628 0.132 19193 44 1 1 . 1 1 12 12 ASN C C 12 173.671 173.671 176.630 -2.959 19193 45 1 1 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.644 -1.026 19193 46 1 1 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.132 -0.560 19193 47 1 1 . 1 1 12 12 ASN H H 12 7.630 7.630 7.832 -0.202 19193 48 1 1 . 1 1 13 13 GLY N N 13 109.255 109.255 108.781 0.474 19193 49 1 1 . 1 1 13 13 GLY C C 13 172.031 172.031 174.779 -2.748 19193 50 1 1 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.564 0.434 19193 51 1 1 . 1 1 13 13 GLY H H 13 7.643 7.643 7.943 -0.300 19193 52 1 1 . 1 1 14 14 ASP N N 14 118.441 118.441 119.001 -0.560 19193 53 1 1 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.636 -0.106 19193 54 1 1 . 1 1 14 14 ASP C C 14 174.877 174.877 177.470 -2.593 19193 55 1 1 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.073 -0.200 19193 56 1 1 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.399 -1.370 19193 57 1 1 . 1 1 14 14 ASP H H 14 7.956 7.956 7.757 0.199 19193 58 1 1 . 1 1 15 15 GLY N N 15 118.441 118.441 107.555 10.886 19193 59 1 1 . 1 1 15 15 GLY C C 15 169.627 169.627 173.215 -3.588 19193 60 1 1 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.792 0.081 19193 61 1 1 . 1 1 15 15 GLY H H 15 10.286 10.286 8.766 1.520 19193 62 1 1 . 1 1 16 16 ALA N N 16 122.512 122.512 121.370 1.142 19193 63 1 1 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.526 -0.596 19193 64 1 1 . 1 1 16 16 ALA C C 16 172.696 172.696 175.992 -3.296 19193 65 1 1 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.938 -1.059 19193 66 1 1 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.444 -0.306 19193 67 1 1 . 1 1 16 16 ALA H H 16 7.883 7.883 7.889 -0.006 19193 68 1 1 . 1 1 17 17 VAL N N 17 124.615 124.615 124.001 0.614 19193 69 1 1 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.529 0.411 19193 70 1 1 . 1 1 17 17 VAL C C 17 172.461 172.461 175.647 -3.186 19193 71 1 1 . 1 1 17 17 VAL CA C 17 60.441 60.441 61.347 -0.906 19193 72 1 1 . 1 1 17 17 VAL CB C 17 32.536 32.536 35.072 -2.536 19193 73 1 1 . 1 1 17 17 VAL H H 17 9.373 9.373 8.914 0.459 19193 74 1 1 . 1 1 18 18 SER N N 18 125.090 125.090 123.833 1.257 19193 75 1 1 . 1 1 18 18 SER HA H 18 4.970 4.970 5.240 -0.270 19193 76 1 1 . 1 1 18 18 SER C C 18 172.145 172.145 175.910 -3.765 19193 77 1 1 . 1 1 18 18 SER CA C 18 55.641 55.641 57.581 -1.940 19193 78 1 1 . 1 1 18 18 SER CB C 18 66.313 66.313 64.550 1.763 19193 79 1 1 . 1 1 18 18 SER H H 18 8.885 8.885 8.658 0.227 19193 80 1 1 . 1 1 19 19 TYR N N 19 123.319 123.319 120.072 3.247 19193 81 1 1 . 1 1 19 19 TYR HA H 19 4.960 4.960 4.035 0.925 19193 82 1 1 . 1 1 19 19 TYR C C 19 174.218 174.218 177.448 -3.230 19193 83 1 1 . 1 1 19 19 TYR CA C 19 62.398 62.398 61.123 1.275 19193 84 1 1 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.460 0.399 19193 85 1 1 . 1 1 19 19 TYR H H 19 9.180 9.180 8.148 1.032 19193 86 1 1 . 1 1 20 20 GLU N N 20 117.323 117.323 119.874 -2.551 19193 87 1 1 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.790 0.990 19193 88 1 1 . 1 1 20 20 GLU C C 20 177.285 177.285 178.876 -1.591 19193 89 1 1 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.759 0.011 19193 90 1 1 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.366 0.099 19193 91 1 1 . 1 1 20 20 GLU H H 20 8.520 8.520 7.378 1.142 19193 92 1 1 . 1 1 21 21 GLU N N 21 120.067 120.067 118.876 1.191 19193 93 1 1 . 1 1 21 21 GLU HA H 21 4.780 4.780 4.006 0.774 19193 94 1 1 . 1 1 21 21 GLU C C 21 177.617 177.617 179.234 -1.617 19193 95 1 1 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.588 -0.687 19193 96 1 1 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.192 -1.294 19193 97 1 1 . 1 1 21 21 GLU H H 21 7.738 7.738 8.037 -0.299 19193 98 1 1 . 1 1 22 22 VAL N N 22 122.931 122.931 120.825 2.106 19193 99 1 1 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.872 -0.372 19193 100 1 1 . 1 1 22 22 VAL C C 22 173.899 173.899 178.167 -4.268 19193 101 1 1 . 1 1 22 22 VAL CA C 22 67.530 67.530 67.121 0.409 19193 102 1 1 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.396 -0.615 19193 103 1 1 . 1 1 22 22 VAL H H 22 8.110 8.110 8.395 -0.285 19193 104 1 1 . 1 1 23 23 LYS N N 23 120.609 120.609 119.025 1.584 19193 105 1 1 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.995 -0.495 19193 106 1 1 . 1 1 23 23 LYS C C 23 175.965 175.965 179.358 -3.393 19193 107 1 1 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.036 1.119 19193 108 1 1 . 1 1 23 23 LYS CB C 23 31.640 31.640 31.942 -0.302 19193 109 1 1 . 1 1 23 23 LYS H H 23 8.613 8.613 7.983 0.630 19193 110 1 1 . 1 1 24 24 ALA N N 24 121.619 121.619 122.320 -0.701 19193 111 1 1 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.067 -0.047 19193 112 1 1 . 1 1 24 24 ALA C C 24 176.843 176.843 178.924 -2.081 19193 113 1 1 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.069 -0.314 19193 114 1 1 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.380 -0.295 19193 115 1 1 . 1 1 24 24 ALA H H 24 8.038 8.038 8.088 -0.050 19193 116 1 1 . 1 1 25 25 PHE N N 25 118.380 118.380 119.739 -1.359 19193 117 1 1 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.166 0.054 19193 118 1 1 . 1 1 25 25 PHE C C 25 174.657 174.657 178.137 -3.480 19193 119 1 1 . 1 1 25 25 PHE CA C 25 61.143 61.143 59.523 1.619 19193 120 1 1 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.725 0.841 19193 121 1 1 . 1 1 25 25 PHE H H 25 7.668 7.668 8.092 -0.424 19193 122 1 1 . 1 1 26 26 VAL N N 26 117.975 117.975 118.678 -0.703 19193 123 1 1 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.518 -0.338 19193 124 1 1 . 1 1 26 26 VAL C C 26 175.212 175.212 178.092 -2.880 19193 125 1 1 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.510 1.029 19193 126 1 1 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.496 -0.090 19193 127 1 1 . 1 1 26 26 VAL H H 26 8.667 8.667 7.877 0.790 19193 128 1 1 . 1 1 27 27 SER N N 27 112.988 112.988 116.312 -3.324 19193 129 1 1 . 1 1 27 27 SER HA H 27 4.900 4.900 4.448 0.452 19193 130 1 1 . 1 1 27 27 SER C C 27 172.256 172.256 175.846 -3.590 19193 131 1 1 . 1 1 27 27 SER CA C 27 60.403 60.403 61.138 -0.735 19193 132 1 1 . 1 1 27 27 SER CB C 27 63.131 63.131 63.023 0.108 19193 133 1 1 . 1 1 27 27 SER H H 27 8.138 8.138 7.780 0.358 19193 134 1 1 . 1 1 28 28 LYS N N 28 119.278 119.278 119.303 -0.025 19193 135 1 1 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.236 -0.176 19193 136 1 1 . 1 1 28 28 LYS C C 28 174.753 174.753 176.968 -2.215 19193 137 1 1 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.488 0.411 19193 138 1 1 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.640 -0.417 19193 139 1 1 . 1 1 28 28 LYS H H 28 7.077 7.077 7.574 -0.497 19193 140 1 1 . 1 1 29 29 LYS N N 29 116.136 116.136 116.780 -0.644 19193 141 1 1 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.395 -0.135 19193 142 1 1 . 1 1 29 29 LYS C C 29 173.137 173.137 176.274 -3.137 19193 143 1 1 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.423 -1.415 19193 144 1 1 . 1 1 29 29 LYS CB C 29 33.689 33.689 34.021 -0.332 19193 145 1 1 . 1 1 29 29 LYS H H 29 7.452 7.452 7.881 -0.429 19193 146 1 1 . 1 1 30 30 ARG N N 30 116.823 116.823 116.373 0.450 19193 147 1 1 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.472 -0.002 19193 148 1 1 . 1 1 30 30 ARG C C 30 169.632 169.632 173.650 -4.018 19193 149 1 1 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.445 -1.065 19193 150 1 1 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.798 -0.726 19193 151 1 1 . 1 1 30 30 ARG H H 30 8.079 8.079 7.435 0.644 19193 152 1 1 . 1 1 31 31 ALA N N 31 121.111 121.111 123.006 -1.895 19193 153 1 1 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.763 -0.303 19193 154 1 1 . 1 1 31 31 ALA C C 31 175.120 175.120 176.825 -1.705 19193 155 1 1 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.393 -0.396 19193 156 1 1 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.793 -0.698 19193 157 1 1 . 1 1 31 31 ALA H H 31 7.929 7.929 8.353 -0.424 19193 158 1 1 . 1 1 32 32 ILE N N 32 123.829 123.829 120.119 3.710 19193 159 1 1 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.437 -0.047 19193 160 1 1 . 1 1 32 32 ILE C C 32 173.398 173.398 175.082 -1.684 19193 161 1 1 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.774 0.257 19193 162 1 1 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.498 -2.333 19193 163 1 1 . 1 1 32 32 ILE H H 32 8.552 8.552 8.069 0.483 19193 164 1 1 . 1 1 33 33 LYS N N 33 130.536 130.536 127.822 2.714 19193 165 1 1 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.391 -0.371 19193 166 1 1 . 1 1 33 33 LYS C C 33 174.009 174.009 175.805 -1.796 19193 167 1 1 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.169 0.472 19193 168 1 1 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.442 4.968 19193 169 1 1 . 1 1 33 33 LYS H H 33 9.444 9.444 8.503 0.941 19193 170 1 1 . 1 1 34 34 ASN N N 34 120.119 120.119 125.192 -5.073 19193 171 1 1 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.914 -0.134 19193 172 1 1 . 1 1 34 34 ASN C C 34 171.824 171.824 175.103 -3.279 19193 173 1 1 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.541 -1.538 19193 174 1 1 . 1 1 34 34 ASN CB C 34 38.288 38.288 39.928 -1.640 19193 175 1 1 . 1 1 34 34 ASN H H 34 8.724 8.724 8.589 0.135 19193 176 1 1 . 1 1 35 35 GLU N N 35 124.613 124.613 124.616 -0.003 19193 177 1 1 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.083 0.207 19193 178 1 1 . 1 1 35 35 GLU C C 35 174.770 174.770 177.373 -2.603 19193 179 1 1 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.752 -0.445 19193 180 1 1 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.959 -1.203 19193 181 1 1 . 1 1 35 35 GLU H H 35 8.860 8.860 8.832 0.028 19193 182 1 1 . 1 1 36 36 GLN N N 36 118.117 118.117 120.243 -2.126 19193 183 1 1 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.231 0.549 19193 184 1 1 . 1 1 36 36 GLN C C 36 176.083 176.083 178.316 -2.233 19193 185 1 1 . 1 1 36 36 GLN CA C 36 59.141 59.141 59.094 0.047 19193 186 1 1 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.316 -0.720 19193 187 1 1 . 1 1 36 36 GLN H H 36 8.346 8.346 8.454 -0.108 19193 188 1 1 . 1 1 37 37 LEU N N 37 119.945 119.945 119.602 0.343 19193 189 1 1 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.088 0.012 19193 190 1 1 . 1 1 37 37 LEU C C 37 175.096 175.096 179.055 -3.959 19193 191 1 1 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.530 -0.143 19193 192 1 1 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.142 0.061 19193 193 1 1 . 1 1 37 37 LEU H H 37 7.469 7.469 8.274 -0.805 19193 194 1 1 . 1 1 38 38 LEU N N 38 119.102 119.102 119.954 -0.852 19193 195 1 1 . 1 1 38 38 LEU HA H 38 4.130 4.130 4.006 0.124 19193 196 1 1 . 1 1 38 38 LEU C C 38 175.531 175.531 179.017 -3.486 19193 197 1 1 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.397 -0.523 19193 198 1 1 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.100 -0.235 19193 199 1 1 . 1 1 38 38 LEU H H 38 7.110 7.110 7.859 -0.749 19193 200 1 1 . 1 1 39 39 GLN N N 39 118.022 118.022 118.833 -0.811 19193 201 1 1 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.122 -0.192 19193 202 1 1 . 1 1 39 39 GLN C C 39 175.315 175.315 178.937 -3.622 19193 203 1 1 . 1 1 39 39 GLN CA C 39 59.511 59.511 58.844 0.667 19193 204 1 1 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.642 -0.748 19193 205 1 1 . 1 1 39 39 GLN H H 39 8.579 8.579 7.780 0.799 19193 206 1 1 . 1 1 40 40 LEU N N 40 120.372 120.372 120.875 -0.503 19193 207 1 1 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.006 -0.066 19193 208 1 1 . 1 1 40 40 LEU C C 40 176.514 176.514 179.171 -2.657 19193 209 1 1 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.118 -0.491 19193 210 1 1 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.195 -0.147 19193 211 1 1 . 1 1 40 40 LEU H H 40 7.890 7.890 8.319 -0.429 19193 212 1 1 . 1 1 41 41 ILE N N 41 120.723 120.723 118.868 1.855 19193 213 1 1 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.745 0.395 19193 214 1 1 . 1 1 41 41 ILE C C 41 174.220 174.220 178.360 -4.140 19193 215 1 1 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.052 1.967 19193 216 1 1 . 1 1 41 41 ILE CB C 41 38.279 38.279 36.658 1.621 19193 217 1 1 . 1 1 41 41 ILE H H 41 8.106 8.106 8.568 -0.462 19193 218 1 1 . 1 1 42 42 PHE N N 42 119.850 119.850 122.489 -2.639 19193 219 1 1 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.094 0.686 19193 220 1 1 . 1 1 42 42 PHE C C 42 173.670 173.670 177.102 -3.432 19193 221 1 1 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.880 1.016 19193 222 1 1 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.733 1.284 19193 223 1 1 . 1 1 42 42 PHE H H 42 8.695 8.695 8.447 0.248 19193 224 1 1 . 1 1 43 43 LYS N N 43 115.976 115.976 117.840 -1.864 19193 225 1 1 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.651 0.369 19193 226 1 1 . 1 1 43 43 LYS C C 43 175.313 175.313 177.882 -2.569 19193 227 1 1 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.646 0.244 19193 228 1 1 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.301 0.218 19193 229 1 1 . 1 1 43 43 LYS H H 43 8.405 8.405 7.695 0.710 19193 230 1 1 . 1 1 44 44 SER N N 44 112.481 112.481 113.791 -1.310 19193 231 1 1 . 1 1 44 44 SER HA H 44 4.100 4.100 4.141 -0.041 19193 232 1 1 . 1 1 44 44 SER C C 44 172.469 172.469 175.817 -3.348 19193 233 1 1 . 1 1 44 44 SER CA C 44 61.017 61.017 61.165 -0.148 19193 234 1 1 . 1 1 44 44 SER CB C 44 63.450 63.450 63.770 -0.320 19193 235 1 1 . 1 1 44 44 SER H H 44 7.492 7.492 7.690 -0.198 19193 236 1 1 . 1 1 45 45 ILE N N 45 120.793 120.793 118.196 2.597 19193 237 1 1 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.289 1.271 19193 238 1 1 . 1 1 45 45 ILE C C 45 174.535 174.535 175.694 -1.159 19193 239 1 1 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.397 -0.622 19193 240 1 1 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.270 -0.291 19193 241 1 1 . 1 1 45 45 ILE H H 45 7.407 7.407 7.823 -0.416 19193 242 1 1 . 1 1 46 46 ASP N N 46 118.226 118.226 119.365 -1.139 19193 243 1 1 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.476 -0.076 19193 244 1 1 . 1 1 46 46 ASP C C 46 173.226 173.226 175.709 -2.483 19193 245 1 1 . 1 1 46 46 ASP CA C 46 52.245 52.245 53.596 -1.351 19193 246 1 1 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.504 -3.471 19193 247 1 1 . 1 1 46 46 ASP H H 46 7.343 7.343 7.366 -0.023 19193 248 1 1 . 1 1 47 47 ALA N N 47 130.084 130.084 128.452 1.632 19193 249 1 1 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.970 0.420 19193 250 1 1 . 1 1 47 47 ALA C C 47 176.299 176.299 177.875 -1.576 19193 251 1 1 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.273 0.293 19193 252 1 1 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.339 -0.119 19193 253 1 1 . 1 1 47 47 ALA H H 47 7.742 7.742 8.489 -0.747 19193 254 1 1 . 1 1 48 48 ASP N N 48 113.283 113.283 113.559 -0.276 19193 255 1 1 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.622 -0.022 19193 256 1 1 . 1 1 48 48 ASP C C 48 175.111 175.111 177.009 -1.898 19193 257 1 1 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.204 -0.694 19193 258 1 1 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.104 -1.665 19193 259 1 1 . 1 1 48 48 ASP H H 48 8.038 8.038 7.818 0.220 19193 260 1 1 . 1 1 49 49 GLY C C 49 172.256 172.256 174.693 -2.437 19193 261 1 1 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.732 1.002 19193 262 1 1 . 1 1 49 49 GLY H H 49 7.775 7.775 7.908 -0.133 19193 263 1 1 . 1 1 50 50 ASN N N 50 119.017 119.017 118.742 0.275 19193 264 1 1 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.635 -0.005 19193 265 1 1 . 1 1 50 50 ASN C C 50 173.670 173.670 176.657 -2.987 19193 266 1 1 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.024 1.352 19193 267 1 1 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.784 0.628 19193 268 1 1 . 1 1 50 50 ASN H H 50 8.155 8.155 7.947 0.208 19193 269 1 1 . 1 1 51 51 GLY C C 51 169.963 169.963 173.660 -3.697 19193 270 1 1 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.235 -1.998 19193 271 1 1 . 1 1 51 51 GLY H H 51 10.668 10.668 8.671 1.997 19193 272 1 1 . 1 1 52 52 GLU N N 52 116.254 116.254 118.944 -2.690 19193 273 1 1 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.067 -0.107 19193 274 1 1 . 1 1 52 52 GLU C C 52 171.378 171.378 175.304 -3.926 19193 275 1 1 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.227 -0.920 19193 276 1 1 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.283 0.798 19193 277 1 1 . 1 1 52 52 GLU H H 52 7.579 7.579 8.301 -0.722 19193 278 1 1 . 1 1 53 53 ILE N N 53 126.770 126.770 122.097 4.673 19193 279 1 1 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.929 0.051 19193 280 1 1 . 1 1 53 53 ILE C C 53 172.922 172.922 176.550 -3.628 19193 281 1 1 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.353 -1.707 19193 282 1 1 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.548 -0.531 19193 283 1 1 . 1 1 53 53 ILE H H 53 9.661 9.661 9.153 0.508 19193 284 1 1 . 1 1 54 54 ASP N N 54 128.225 128.225 127.758 0.467 19193 285 1 1 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.272 -0.362 19193 286 1 1 . 1 1 54 54 ASP C C 54 173.562 173.562 177.916 -4.354 19193 287 1 1 . 1 1 54 54 ASP CA C 54 51.892 51.892 54.482 -2.590 19193 288 1 1 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.944 -0.044 19193 289 1 1 . 1 1 54 54 ASP H H 54 8.771 8.771 9.335 -0.564 19193 290 1 1 . 1 1 55 55 GLN N N 55 116.090 116.090 121.485 -5.395 19193 291 1 1 . 1 1 55 55 GLN HA H 55 3.340 3.340 3.004 0.336 19193 292 1 1 . 1 1 55 55 GLN C C 55 175.643 175.643 177.705 -2.062 19193 293 1 1 . 1 1 55 55 GLN CA C 55 59.645 59.645 60.024 -0.379 19193 294 1 1 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.423 -0.526 19193 295 1 1 . 1 1 55 55 GLN H H 55 8.563 8.563 8.676 -0.113 19193 296 1 1 . 1 1 56 56 ASN N N 56 119.830 119.830 119.586 0.244 19193 297 1 1 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.350 0.420 19193 298 1 1 . 1 1 56 56 ASN C C 56 178.242 178.242 177.718 0.524 19193 299 1 1 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.633 -0.746 19193 300 1 1 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.661 0.602 19193 301 1 1 . 1 1 56 56 ASN H H 56 8.205 8.205 8.721 -0.516 19193 302 1 1 . 1 1 57 57 GLU N N 57 123.242 123.242 120.218 3.024 19193 303 1 1 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.983 0.027 19193 304 1 1 . 1 1 57 57 GLU C C 57 177.498 177.498 179.069 -1.571 19193 305 1 1 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.463 -0.823 19193 306 1 1 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.471 0.153 19193 307 1 1 . 1 1 57 57 GLU H H 57 9.079 9.079 8.065 1.014 19193 308 1 1 . 1 1 58 58 PHE N N 58 119.057 119.057 120.929 -1.872 19193 309 1 1 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.364 -0.334 19193 310 1 1 . 1 1 58 58 PHE C C 58 173.784 173.784 177.338 -3.554 19193 311 1 1 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.421 0.323 19193 312 1 1 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.982 0.599 19193 313 1 1 . 1 1 58 58 PHE H H 58 8.795 8.795 8.539 0.256 19193 314 1 1 . 1 1 59 59 ALA N N 59 120.919 120.919 122.044 -1.125 19193 315 1 1 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.074 -0.114 19193 316 1 1 . 1 1 59 59 ALA C C 59 177.602 177.602 179.281 -1.679 19193 317 1 1 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.111 -0.183 19193 318 1 1 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.303 -0.512 19193 319 1 1 . 1 1 59 59 ALA H H 59 8.158 8.158 8.445 -0.287 19193 320 1 1 . 1 1 60 60 LYS N N 60 116.767 116.767 116.622 0.145 19193 321 1 1 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.114 -0.064 19193 322 1 1 . 1 1 60 60 LYS C C 60 175.309 175.309 177.823 -2.514 19193 323 1 1 . 1 1 60 60 LYS CA C 60 58.274 58.274 58.001 0.273 19193 324 1 1 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.297 -0.076 19193 325 1 1 . 1 1 60 60 LYS H H 60 7.554 7.554 7.935 -0.381 19193 326 1 1 . 1 1 61 61 PHE N N 61 118.086 118.086 118.745 -0.659 19193 327 1 1 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.291 0.199 19193 328 1 1 . 1 1 61 61 PHE C C 61 173.559 173.559 175.473 -1.914 19193 329 1 1 . 1 1 61 61 PHE CA C 61 58.521 58.521 56.961 1.560 19193 330 1 1 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.927 0.112 19193 331 1 1 . 1 1 61 61 PHE H H 61 7.231 7.231 7.544 -0.313 19193 332 1 1 . 1 1 62 62 TYR N N 62 120.802 120.802 122.367 -1.565 19193 333 1 1 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.637 0.833 19193 334 1 1 . 1 1 62 62 TYR C C 62 173.559 173.559 175.451 -1.892 19193 335 1 1 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.630 1.258 19193 336 1 1 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.963 0.311 19193 337 1 1 . 1 1 62 62 TYR H H 62 8.301 8.301 7.923 0.378 19193 338 1 1 . 1 1 63 63 GLY N N 63 132.741 132.741 115.604 17.137 19193 339 1 1 . 1 1 63 63 GLY C C 63 172.799 172.799 174.527 -1.728 19193 340 1 1 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.917 1.335 19193 341 1 1 . 1 1 63 63 GLY H H 63 8.293 8.293 7.885 0.408 19193 342 1 1 . 1 1 64 64 SER N N 64 115.064 115.064 115.735 -0.671 19193 343 1 1 . 1 1 64 64 SER HA H 64 4.780 4.780 4.562 0.218 19193 344 1 1 . 1 1 64 64 SER C C 64 170.939 170.939 175.306 -4.367 19193 345 1 1 . 1 1 64 64 SER CA C 64 60.525 60.525 57.120 3.405 19193 346 1 1 . 1 1 64 64 SER CB C 64 63.430 63.430 63.249 0.181 19193 347 1 1 . 1 1 64 64 SER H H 64 7.833 7.833 7.673 0.160 19193 348 1 1 . 1 1 65 65 ILE N N 65 112.928 112.928 121.179 -8.251 19193 349 1 1 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.174 0.086 19193 350 1 1 . 1 1 65 65 ILE C C 65 175.695 175.695 176.288 -0.593 19193 351 1 1 . 1 1 65 65 ILE CA C 65 59.752 59.752 61.167 -1.415 19193 352 1 1 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.349 2.373 19193 353 1 1 . 1 1 65 65 ILE H H 65 6.935 6.935 7.719 -0.784 19193 354 1 2 . 1 1 5 5 LEU N N 5 120.669 120.669 117.066 3.603 19193 355 1 2 . 1 1 5 5 LEU HA H 5 4.210 4.210 3.985 0.225 19193 356 1 2 . 1 1 5 5 LEU CA C 5 58.825 58.825 57.024 1.801 19193 357 1 2 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.244 1.021 19193 358 1 2 . 1 1 5 5 LEU H H 5 7.998 7.998 7.993 0.005 19193 359 1 2 . 1 1 6 6 PHE N N 6 117.996 117.996 120.323 -2.327 19193 360 1 2 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.968 -0.108 19193 361 1 2 . 1 1 6 6 PHE C C 6 175.520 175.520 176.984 -1.464 19193 362 1 2 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.502 1.712 19193 363 1 2 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.830 0.188 19193 364 1 2 . 1 1 6 6 PHE H H 6 7.276 7.276 8.158 -0.882 19193 365 1 2 . 1 1 7 7 LYS N N 7 114.616 114.616 117.155 -2.539 19193 366 1 2 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.921 0.040 19193 367 1 2 . 1 1 7 7 LYS C C 7 175.105 175.105 178.181 -3.076 19193 368 1 2 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.982 -0.212 19193 369 1 2 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.299 -0.062 19193 370 1 2 . 1 1 7 7 LYS H H 7 7.523 7.523 7.659 -0.136 19193 371 1 2 . 1 1 8 8 GLU N N 8 117.996 117.996 119.183 -1.187 19193 372 1 2 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.048 -0.188 19193 373 1 2 . 1 1 8 8 GLU C C 8 174.994 174.994 178.401 -3.407 19193 374 1 2 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.792 -0.533 19193 375 1 2 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.799 -0.496 19193 376 1 2 . 1 1 8 8 GLU H H 8 7.276 7.276 7.732 -0.456 19193 377 1 2 . 1 1 9 9 ILE N N 9 117.880 117.880 116.391 1.489 19193 378 1 2 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.681 -0.239 19193 379 1 2 . 1 1 9 9 ILE C C 9 177.620 177.620 176.501 1.119 19193 380 1 2 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.201 1.210 19193 381 1 2 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.751 0.960 19193 382 1 2 . 1 1 9 9 ILE H H 9 7.166 7.166 7.579 -0.413 19193 383 1 2 . 1 1 10 10 ASP N N 10 119.154 119.154 121.847 -2.693 19193 384 1 2 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.648 -0.796 19193 385 1 2 . 1 1 10 10 ASP C C 10 174.446 174.446 177.208 -2.762 19193 386 1 2 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.836 -1.449 19193 387 1 2 . 1 1 10 10 ASP CB C 10 38.297 38.297 39.111 -0.813 19193 388 1 2 . 1 1 10 10 ASP H H 10 7.629 7.629 7.445 0.184 19193 389 1 2 . 1 1 11 11 VAL N N 11 124.080 124.080 123.760 0.320 19193 390 1 2 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.712 0.098 19193 391 1 2 . 1 1 11 11 VAL C C 11 174.883 174.883 176.680 -1.797 19193 392 1 2 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.959 -0.071 19193 393 1 2 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.721 0.199 19193 394 1 2 . 1 1 11 11 VAL H H 11 7.956 7.956 7.889 0.067 19193 395 1 2 . 1 1 12 12 ASN N N 12 114.490 114.490 116.744 -2.254 19193 396 1 2 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.647 0.113 19193 397 1 2 . 1 1 12 12 ASN C C 12 173.671 173.671 176.578 -2.907 19193 398 1 2 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.549 -0.931 19193 399 1 2 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.251 -0.679 19193 400 1 2 . 1 1 12 12 ASN H H 12 7.630 7.630 7.899 -0.269 19193 401 1 2 . 1 1 13 13 GLY N N 13 109.255 109.255 108.568 0.687 19193 402 1 2 . 1 1 13 13 GLY C C 13 172.031 172.031 174.978 -2.947 19193 403 1 2 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.669 0.329 19193 404 1 2 . 1 1 13 13 GLY H H 13 7.643 7.643 8.079 -0.436 19193 405 1 2 . 1 1 14 14 ASP N N 14 118.441 118.441 119.188 -0.747 19193 406 1 2 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.623 -0.093 19193 407 1 2 . 1 1 14 14 ASP C C 14 174.877 174.877 177.726 -2.849 19193 408 1 2 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.391 -0.518 19193 409 1 2 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.206 -1.177 19193 410 1 2 . 1 1 14 14 ASP H H 14 7.956 7.956 7.888 0.068 19193 411 1 2 . 1 1 15 15 GLY N N 15 118.441 118.441 107.403 11.038 19193 412 1 2 . 1 1 15 15 GLY C C 15 169.627 169.627 173.265 -3.638 19193 413 1 2 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.835 0.038 19193 414 1 2 . 1 1 15 15 GLY H H 15 10.286 10.286 8.767 1.519 19193 415 1 2 . 1 1 16 16 ALA N N 16 122.512 122.512 121.844 0.668 19193 416 1 2 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.677 -0.747 19193 417 1 2 . 1 1 16 16 ALA C C 16 172.696 172.696 176.093 -3.397 19193 418 1 2 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.911 -1.032 19193 419 1 2 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.502 -0.364 19193 420 1 2 . 1 1 16 16 ALA H H 16 7.883 7.883 7.848 0.035 19193 421 1 2 . 1 1 17 17 VAL N N 17 124.615 124.615 118.936 5.679 19193 422 1 2 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.805 0.135 19193 423 1 2 . 1 1 17 17 VAL C C 17 172.461 172.461 174.997 -2.536 19193 424 1 2 . 1 1 17 17 VAL CA C 17 60.441 60.441 59.756 0.685 19193 425 1 2 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.212 -1.677 19193 426 1 2 . 1 1 17 17 VAL H H 17 9.373 9.373 8.750 0.623 19193 427 1 2 . 1 1 18 18 SER N N 18 125.090 125.090 122.854 2.236 19193 428 1 2 . 1 1 18 18 SER HA H 18 4.970 4.970 5.053 -0.083 19193 429 1 2 . 1 1 18 18 SER C C 18 172.145 172.145 175.989 -3.844 19193 430 1 2 . 1 1 18 18 SER CA C 18 55.641 55.641 57.708 -2.067 19193 431 1 2 . 1 1 18 18 SER CB C 18 66.313 66.313 64.613 1.700 19193 432 1 2 . 1 1 18 18 SER H H 18 8.885 8.885 8.457 0.428 19193 433 1 2 . 1 1 19 19 TYR N N 19 123.319 123.319 119.833 3.486 19193 434 1 2 . 1 1 19 19 TYR HA H 19 4.960 4.960 3.782 1.178 19193 435 1 2 . 1 1 19 19 TYR C C 19 174.218 174.218 177.416 -3.198 19193 436 1 2 . 1 1 19 19 TYR CA C 19 62.398 62.398 60.896 1.502 19193 437 1 2 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.329 0.530 19193 438 1 2 . 1 1 19 19 TYR H H 19 9.180 9.180 7.909 1.271 19193 439 1 2 . 1 1 20 20 GLU N N 20 117.323 117.323 119.648 -2.325 19193 440 1 2 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.786 0.994 19193 441 1 2 . 1 1 20 20 GLU C C 20 177.285 177.285 178.800 -1.515 19193 442 1 2 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.619 0.151 19193 443 1 2 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.400 0.065 19193 444 1 2 . 1 1 20 20 GLU H H 20 8.520 8.520 7.347 1.173 19193 445 1 2 . 1 1 21 21 GLU N N 21 120.067 120.067 119.095 0.972 19193 446 1 2 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.964 0.816 19193 447 1 2 . 1 1 21 21 GLU C C 21 177.617 177.617 178.908 -1.291 19193 448 1 2 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.452 -0.551 19193 449 1 2 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.024 -1.126 19193 450 1 2 . 1 1 21 21 GLU H H 21 7.738 7.738 7.807 -0.069 19193 451 1 2 . 1 1 22 22 VAL N N 22 122.931 122.931 120.552 2.379 19193 452 1 2 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.481 0.019 19193 453 1 2 . 1 1 22 22 VAL C C 22 173.899 173.899 178.147 -4.248 19193 454 1 2 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.379 1.151 19193 455 1 2 . 1 1 22 22 VAL CB C 22 30.781 30.781 30.985 -0.204 19193 456 1 2 . 1 1 22 22 VAL H H 22 8.110 8.110 8.333 -0.223 19193 457 1 2 . 1 1 23 23 LYS N N 23 120.609 120.609 118.860 1.749 19193 458 1 2 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.988 -0.488 19193 459 1 2 . 1 1 23 23 LYS C C 23 175.965 175.965 179.230 -3.265 19193 460 1 2 . 1 1 23 23 LYS CA C 23 60.155 60.155 58.860 1.295 19193 461 1 2 . 1 1 23 23 LYS CB C 23 31.640 31.640 31.942 -0.302 19193 462 1 2 . 1 1 23 23 LYS H H 23 8.613 8.613 7.733 0.880 19193 463 1 2 . 1 1 24 24 ALA N N 24 121.619 121.619 122.501 -0.882 19193 464 1 2 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.199 -0.179 19193 465 1 2 . 1 1 24 24 ALA C C 24 176.843 176.843 180.021 -3.178 19193 466 1 2 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.075 -0.320 19193 467 1 2 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.277 -0.193 19193 468 1 2 . 1 1 24 24 ALA H H 24 8.038 8.038 7.886 0.152 19193 469 1 2 . 1 1 25 25 PHE N N 25 118.380 118.380 118.468 -0.088 19193 470 1 2 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.134 0.086 19193 471 1 2 . 1 1 25 25 PHE C C 25 174.657 174.657 178.663 -4.006 19193 472 1 2 . 1 1 25 25 PHE CA C 25 61.143 61.143 60.322 0.821 19193 473 1 2 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.442 1.124 19193 474 1 2 . 1 1 25 25 PHE H H 25 7.668 7.668 8.560 -0.892 19193 475 1 2 . 1 1 26 26 VAL N N 26 117.975 117.975 118.867 -0.892 19193 476 1 2 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.728 -0.548 19193 477 1 2 . 1 1 26 26 VAL C C 26 175.212 175.212 177.898 -2.686 19193 478 1 2 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.613 0.926 19193 479 1 2 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.457 -0.052 19193 480 1 2 . 1 1 26 26 VAL H H 26 8.667 8.667 7.974 0.693 19193 481 1 2 . 1 1 27 27 SER N N 27 112.988 112.988 115.070 -2.082 19193 482 1 2 . 1 1 27 27 SER HA H 27 4.900 4.900 4.379 0.521 19193 483 1 2 . 1 1 27 27 SER C C 27 172.256 172.256 174.893 -2.637 19193 484 1 2 . 1 1 27 27 SER CA C 27 60.403 60.403 60.628 -0.225 19193 485 1 2 . 1 1 27 27 SER CB C 27 63.131 63.131 63.253 -0.122 19193 486 1 2 . 1 1 27 27 SER H H 27 8.138 8.138 7.720 0.418 19193 487 1 2 . 1 1 28 28 LYS N N 28 119.278 119.278 118.342 0.936 19193 488 1 2 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.184 -0.124 19193 489 1 2 . 1 1 28 28 LYS C C 28 174.753 174.753 177.004 -2.251 19193 490 1 2 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.391 0.508 19193 491 1 2 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.253 -0.030 19193 492 1 2 . 1 1 28 28 LYS H H 28 7.077 7.077 7.430 -0.353 19193 493 1 2 . 1 1 29 29 LYS N N 29 116.136 116.136 117.171 -1.035 19193 494 1 2 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.315 -0.055 19193 495 1 2 . 1 1 29 29 LYS C C 29 173.137 173.137 177.083 -3.946 19193 496 1 2 . 1 1 29 29 LYS CA C 29 55.008 55.008 57.551 -2.543 19193 497 1 2 . 1 1 29 29 LYS CB C 29 33.689 33.689 33.900 -0.211 19193 498 1 2 . 1 1 29 29 LYS H H 29 7.452 7.452 8.111 -0.659 19193 499 1 2 . 1 1 30 30 ARG N N 30 116.823 116.823 116.820 0.003 19193 500 1 2 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.481 -0.011 19193 501 1 2 . 1 1 30 30 ARG C C 30 169.632 169.632 173.826 -4.194 19193 502 1 2 . 1 1 30 30 ARG CA C 30 54.380 54.380 54.924 -0.544 19193 503 1 2 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.060 0.012 19193 504 1 2 . 1 1 30 30 ARG H H 30 8.079 8.079 7.606 0.473 19193 505 1 2 . 1 1 31 31 ALA N N 31 121.111 121.111 122.536 -1.425 19193 506 1 2 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.733 -0.273 19193 507 1 2 . 1 1 31 31 ALA C C 31 175.120 175.120 176.539 -1.419 19193 508 1 2 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.412 -0.415 19193 509 1 2 . 1 1 31 31 ALA CB C 31 18.095 18.095 19.106 -1.011 19193 510 1 2 . 1 1 31 31 ALA H H 31 7.929 7.929 8.346 -0.417 19193 511 1 2 . 1 1 32 32 ILE N N 32 123.829 123.829 124.381 -0.552 19193 512 1 2 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.366 0.024 19193 513 1 2 . 1 1 32 32 ILE C C 32 173.398 173.398 174.237 -0.839 19193 514 1 2 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.707 0.324 19193 515 1 2 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.791 -2.626 19193 516 1 2 . 1 1 32 32 ILE H H 32 8.552 8.552 8.377 0.175 19193 517 1 2 . 1 1 33 33 LYS N N 33 130.536 130.536 128.993 1.543 19193 518 1 2 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.480 -0.460 19193 519 1 2 . 1 1 33 33 LYS C C 33 174.009 174.009 175.142 -1.133 19193 520 1 2 . 1 1 33 33 LYS CA C 33 56.641 56.641 55.968 0.673 19193 521 1 2 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.371 5.039 19193 522 1 2 . 1 1 33 33 LYS H H 33 9.444 9.444 8.417 1.027 19193 523 1 2 . 1 1 34 34 ASN N N 34 120.119 120.119 125.399 -5.280 19193 524 1 2 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.919 -0.139 19193 525 1 2 . 1 1 34 34 ASN C C 34 171.824 171.824 175.095 -3.271 19193 526 1 2 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.205 -1.202 19193 527 1 2 . 1 1 34 34 ASN CB C 34 38.288 38.288 39.882 -1.594 19193 528 1 2 . 1 1 34 34 ASN H H 34 8.724 8.724 8.574 0.150 19193 529 1 2 . 1 1 35 35 GLU N N 35 124.613 124.613 124.578 0.035 19193 530 1 2 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.072 0.218 19193 531 1 2 . 1 1 35 35 GLU C C 35 174.770 174.770 177.475 -2.705 19193 532 1 2 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.415 -0.108 19193 533 1 2 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.882 -1.126 19193 534 1 2 . 1 1 35 35 GLU H H 35 8.860 8.860 8.818 0.042 19193 535 1 2 . 1 1 36 36 GLN N N 36 118.117 118.117 120.438 -2.321 19193 536 1 2 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.191 0.589 19193 537 1 2 . 1 1 36 36 GLN C C 36 176.083 176.083 178.329 -2.246 19193 538 1 2 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.858 0.283 19193 539 1 2 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.494 -0.898 19193 540 1 2 . 1 1 36 36 GLN H H 36 8.346 8.346 8.230 0.116 19193 541 1 2 . 1 1 37 37 LEU N N 37 119.945 119.945 120.534 -0.589 19193 542 1 2 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.130 -0.030 19193 543 1 2 . 1 1 37 37 LEU C C 37 175.096 175.096 178.399 -3.303 19193 544 1 2 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.888 -0.501 19193 545 1 2 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.429 -0.226 19193 546 1 2 . 1 1 37 37 LEU H H 37 7.469 7.469 8.193 -0.724 19193 547 1 2 . 1 1 38 38 LEU N N 38 119.102 119.102 119.584 -0.482 19193 548 1 2 . 1 1 38 38 LEU HA H 38 4.130 4.130 3.970 0.160 19193 549 1 2 . 1 1 38 38 LEU C C 38 175.531 175.531 178.909 -3.378 19193 550 1 2 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.412 -0.539 19193 551 1 2 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.064 -0.199 19193 552 1 2 . 1 1 38 38 LEU H H 38 7.110 7.110 7.771 -0.661 19193 553 1 2 . 1 1 39 39 GLN N N 39 118.022 118.022 118.536 -0.514 19193 554 1 2 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.076 -0.146 19193 555 1 2 . 1 1 39 39 GLN C C 39 175.315 175.315 178.853 -3.538 19193 556 1 2 . 1 1 39 39 GLN CA C 39 59.511 59.511 59.510 0.001 19193 557 1 2 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.853 -0.959 19193 558 1 2 . 1 1 39 39 GLN H H 39 8.579 8.579 7.774 0.805 19193 559 1 2 . 1 1 40 40 LEU N N 40 120.372 120.372 120.974 -0.602 19193 560 1 2 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.005 -0.065 19193 561 1 2 . 1 1 40 40 LEU C C 40 176.514 176.514 179.101 -2.587 19193 562 1 2 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.134 -0.507 19193 563 1 2 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.225 -0.177 19193 564 1 2 . 1 1 40 40 LEU H H 40 7.890 7.890 8.315 -0.425 19193 565 1 2 . 1 1 41 41 ILE N N 41 120.723 120.723 118.963 1.760 19193 566 1 2 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.686 0.454 19193 567 1 2 . 1 1 41 41 ILE C C 41 174.220 174.220 178.421 -4.201 19193 568 1 2 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.134 1.885 19193 569 1 2 . 1 1 41 41 ILE CB C 41 38.279 38.279 36.591 1.688 19193 570 1 2 . 1 1 41 41 ILE H H 41 8.106 8.106 8.553 -0.447 19193 571 1 2 . 1 1 42 42 PHE N N 42 119.850 119.850 122.637 -2.787 19193 572 1 2 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.045 0.735 19193 573 1 2 . 1 1 42 42 PHE C C 42 173.670 173.670 177.051 -3.381 19193 574 1 2 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.860 1.036 19193 575 1 2 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.666 1.353 19193 576 1 2 . 1 1 42 42 PHE H H 42 8.695 8.695 8.436 0.259 19193 577 1 2 . 1 1 43 43 LYS N N 43 115.976 115.976 117.746 -1.770 19193 578 1 2 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.633 0.387 19193 579 1 2 . 1 1 43 43 LYS C C 43 175.313 175.313 177.934 -2.621 19193 580 1 2 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.589 0.301 19193 581 1 2 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.287 0.232 19193 582 1 2 . 1 1 43 43 LYS H H 43 8.405 8.405 7.689 0.716 19193 583 1 2 . 1 1 44 44 SER N N 44 112.481 112.481 113.707 -1.226 19193 584 1 2 . 1 1 44 44 SER HA H 44 4.100 4.100 4.132 -0.032 19193 585 1 2 . 1 1 44 44 SER C C 44 172.469 172.469 175.864 -3.395 19193 586 1 2 . 1 1 44 44 SER CA C 44 61.017 61.017 61.279 -0.262 19193 587 1 2 . 1 1 44 44 SER CB C 44 63.450 63.450 63.726 -0.276 19193 588 1 2 . 1 1 44 44 SER H H 44 7.492 7.492 7.741 -0.249 19193 589 1 2 . 1 1 45 45 ILE N N 45 120.793 120.793 118.609 2.184 19193 590 1 2 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.792 0.768 19193 591 1 2 . 1 1 45 45 ILE C C 45 174.535 174.535 175.885 -1.350 19193 592 1 2 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.386 -0.611 19193 593 1 2 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.081 -0.102 19193 594 1 2 . 1 1 45 45 ILE H H 45 7.407 7.407 7.707 -0.300 19193 595 1 2 . 1 1 46 46 ASP N N 46 118.226 118.226 119.019 -0.793 19193 596 1 2 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.389 0.011 19193 597 1 2 . 1 1 46 46 ASP C C 46 173.226 173.226 176.021 -2.795 19193 598 1 2 . 1 1 46 46 ASP CA C 46 52.245 52.245 54.345 -2.100 19193 599 1 2 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.199 -3.167 19193 600 1 2 . 1 1 46 46 ASP H H 46 7.343 7.343 7.458 -0.115 19193 601 1 2 . 1 1 47 47 ALA N N 47 130.084 130.084 129.508 0.576 19193 602 1 2 . 1 1 47 47 ALA HA H 47 4.390 4.390 4.007 0.383 19193 603 1 2 . 1 1 47 47 ALA C C 47 176.299 176.299 177.972 -1.673 19193 604 1 2 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.246 0.320 19193 605 1 2 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.461 -0.241 19193 606 1 2 . 1 1 47 47 ALA H H 47 7.742 7.742 8.470 -0.728 19193 607 1 2 . 1 1 48 48 ASP N N 48 113.283 113.283 113.574 -0.291 19193 608 1 2 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.619 -0.019 19193 609 1 2 . 1 1 48 48 ASP C C 48 175.111 175.111 177.051 -1.940 19193 610 1 2 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.213 -0.703 19193 611 1 2 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.096 -1.657 19193 612 1 2 . 1 1 48 48 ASP H H 48 8.038 8.038 7.814 0.224 19193 613 1 2 . 1 1 49 49 GLY C C 49 172.256 172.256 174.669 -2.413 19193 614 1 2 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.741 0.993 19193 615 1 2 . 1 1 49 49 GLY H H 49 7.775 7.775 7.955 -0.180 19193 616 1 2 . 1 1 50 50 ASN N N 50 119.017 119.017 118.748 0.269 19193 617 1 2 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.613 0.017 19193 618 1 2 . 1 1 50 50 ASN C C 50 173.670 173.670 176.653 -2.983 19193 619 1 2 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.037 1.339 19193 620 1 2 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.765 0.647 19193 621 1 2 . 1 1 50 50 ASN H H 50 8.155 8.155 7.934 0.221 19193 622 1 2 . 1 1 51 51 GLY C C 51 169.963 169.963 173.628 -3.665 19193 623 1 2 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.208 -1.970 19193 624 1 2 . 1 1 51 51 GLY H H 51 10.668 10.668 8.656 2.012 19193 625 1 2 . 1 1 52 52 GLU N N 52 116.254 116.254 118.933 -2.679 19193 626 1 2 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.026 -0.066 19193 627 1 2 . 1 1 52 52 GLU C C 52 171.378 171.378 175.236 -3.858 19193 628 1 2 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.233 -0.925 19193 629 1 2 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.308 0.773 19193 630 1 2 . 1 1 52 52 GLU H H 52 7.579 7.579 8.268 -0.690 19193 631 1 2 . 1 1 53 53 ILE N N 53 126.770 126.770 121.940 4.830 19193 632 1 2 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.951 0.029 19193 633 1 2 . 1 1 53 53 ILE C C 53 172.922 172.922 176.344 -3.422 19193 634 1 2 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.073 -1.427 19193 635 1 2 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.693 -0.676 19193 636 1 2 . 1 1 53 53 ILE H H 53 9.661 9.661 9.053 0.608 19193 637 1 2 . 1 1 54 54 ASP N N 54 128.225 128.225 127.001 1.224 19193 638 1 2 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.195 -0.285 19193 639 1 2 . 1 1 54 54 ASP C C 54 173.562 173.562 178.018 -4.456 19193 640 1 2 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.433 -1.541 19193 641 1 2 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.567 0.333 19193 642 1 2 . 1 1 54 54 ASP H H 54 8.771 8.771 9.227 -0.456 19193 643 1 2 . 1 1 55 55 GLN N N 55 116.090 116.090 121.230 -5.140 19193 644 1 2 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.708 0.632 19193 645 1 2 . 1 1 55 55 GLN C C 55 175.643 175.643 177.615 -1.972 19193 646 1 2 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.677 -0.032 19193 647 1 2 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.120 -0.223 19193 648 1 2 . 1 1 55 55 GLN H H 55 8.563 8.563 8.591 -0.028 19193 649 1 2 . 1 1 56 56 ASN N N 56 119.830 119.830 119.353 0.477 19193 650 1 2 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.338 0.432 19193 651 1 2 . 1 1 56 56 ASN C C 56 178.242 178.242 177.681 0.561 19193 652 1 2 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.189 -0.302 19193 653 1 2 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.536 0.727 19193 654 1 2 . 1 1 56 56 ASN H H 56 8.205 8.205 8.706 -0.501 19193 655 1 2 . 1 1 57 57 GLU N N 57 123.242 123.242 120.298 2.944 19193 656 1 2 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.974 0.036 19193 657 1 2 . 1 1 57 57 GLU C C 57 177.498 177.498 179.081 -1.583 19193 658 1 2 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.428 -0.788 19193 659 1 2 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.431 0.193 19193 660 1 2 . 1 1 57 57 GLU H H 57 9.079 9.079 8.051 1.028 19193 661 1 2 . 1 1 58 58 PHE N N 58 119.057 119.057 120.632 -1.575 19193 662 1 2 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.301 -0.271 19193 663 1 2 . 1 1 58 58 PHE C C 58 173.784 173.784 177.262 -3.478 19193 664 1 2 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.519 0.225 19193 665 1 2 . 1 1 58 58 PHE CB C 58 39.581 39.581 39.029 0.552 19193 666 1 2 . 1 1 58 58 PHE H H 58 8.795 8.795 8.321 0.474 19193 667 1 2 . 1 1 59 59 ALA N N 59 120.919 120.919 121.927 -1.008 19193 668 1 2 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.110 -0.150 19193 669 1 2 . 1 1 59 59 ALA C C 59 177.602 177.602 179.450 -1.848 19193 670 1 2 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.052 -0.124 19193 671 1 2 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.353 -0.562 19193 672 1 2 . 1 1 59 59 ALA H H 59 8.158 8.158 8.454 -0.296 19193 673 1 2 . 1 1 60 60 LYS N N 60 116.767 116.767 116.585 0.182 19193 674 1 2 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.108 -0.058 19193 675 1 2 . 1 1 60 60 LYS C C 60 175.309 175.309 178.334 -3.025 19193 676 1 2 . 1 1 60 60 LYS CA C 60 58.274 58.274 57.816 0.458 19193 677 1 2 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.536 -0.315 19193 678 1 2 . 1 1 60 60 LYS H H 60 7.554 7.554 7.884 -0.330 19193 679 1 2 . 1 1 61 61 PHE N N 61 118.086 118.086 120.634 -2.548 19193 680 1 2 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.296 0.194 19193 681 1 2 . 1 1 61 61 PHE C C 61 173.559 173.559 175.420 -1.861 19193 682 1 2 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.972 0.549 19193 683 1 2 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.716 0.323 19193 684 1 2 . 1 1 61 61 PHE H H 61 7.231 7.231 7.672 -0.441 19193 685 1 2 . 1 1 62 62 TYR N N 62 120.802 120.802 122.248 -1.446 19193 686 1 2 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.630 0.840 19193 687 1 2 . 1 1 62 62 TYR C C 62 173.559 173.559 175.652 -2.093 19193 688 1 2 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.867 1.021 19193 689 1 2 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.926 0.348 19193 690 1 2 . 1 1 62 62 TYR H H 62 8.301 8.301 7.813 0.488 19193 691 1 2 . 1 1 63 63 GLY N N 63 132.741 132.741 115.877 16.864 19193 692 1 2 . 1 1 63 63 GLY C C 63 172.799 172.799 174.993 -2.194 19193 693 1 2 . 1 1 63 63 GLY CA C 63 46.252 46.252 45.167 1.085 19193 694 1 2 . 1 1 63 63 GLY H H 63 8.293 8.293 7.965 0.328 19193 695 1 2 . 1 1 64 64 SER N N 64 115.064 115.064 115.365 -0.301 19193 696 1 2 . 1 1 64 64 SER HA H 64 4.780 4.780 4.582 0.198 19193 697 1 2 . 1 1 64 64 SER C C 64 170.939 170.939 175.388 -4.449 19193 698 1 2 . 1 1 64 64 SER CA C 64 60.525 60.525 58.056 2.469 19193 699 1 2 . 1 1 64 64 SER CB C 64 63.430 63.430 63.597 -0.167 19193 700 1 2 . 1 1 64 64 SER H H 64 7.833 7.833 7.669 0.164 19193 701 1 2 . 1 1 65 65 ILE N N 65 112.928 112.928 121.227 -8.299 19193 702 1 2 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.142 0.118 19193 703 1 2 . 1 1 65 65 ILE C C 65 175.695 175.695 175.396 0.299 19193 704 1 2 . 1 1 65 65 ILE CA C 65 59.752 59.752 61.231 -1.480 19193 705 1 2 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.963 1.759 19193 706 1 2 . 1 1 65 65 ILE H H 65 6.935 6.935 7.779 -0.844 19193 707 1 3 . 1 1 5 5 LEU N N 5 120.669 120.669 117.669 3.000 19193 708 1 3 . 1 1 5 5 LEU HA H 5 4.210 4.210 4.037 0.173 19193 709 1 3 . 1 1 5 5 LEU CA C 5 58.825 58.825 57.227 1.598 19193 710 1 3 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.257 1.008 19193 711 1 3 . 1 1 5 5 LEU H H 5 7.998 7.998 7.972 0.026 19193 712 1 3 . 1 1 6 6 PHE N N 6 117.996 117.996 119.945 -1.949 19193 713 1 3 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.795 0.065 19193 714 1 3 . 1 1 6 6 PHE C C 6 175.520 175.520 176.903 -1.383 19193 715 1 3 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.220 1.994 19193 716 1 3 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.699 0.319 19193 717 1 3 . 1 1 6 6 PHE H H 6 7.276 7.276 8.162 -0.886 19193 718 1 3 . 1 1 7 7 LYS N N 7 114.616 114.616 118.633 -4.017 19193 719 1 3 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.880 0.081 19193 720 1 3 . 1 1 7 7 LYS C C 7 175.105 175.105 177.941 -2.836 19193 721 1 3 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.769 0.001 19193 722 1 3 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.253 -0.016 19193 723 1 3 . 1 1 7 7 LYS H H 7 7.523 7.523 7.590 -0.067 19193 724 1 3 . 1 1 8 8 GLU N N 8 117.996 117.996 119.275 -1.279 19193 725 1 3 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.039 -0.179 19193 726 1 3 . 1 1 8 8 GLU C C 8 174.994 174.994 178.300 -3.306 19193 727 1 3 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.717 -0.458 19193 728 1 3 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.939 -0.636 19193 729 1 3 . 1 1 8 8 GLU H H 8 7.276 7.276 7.744 -0.468 19193 730 1 3 . 1 1 9 9 ILE N N 9 117.880 117.880 115.880 2.000 19193 731 1 3 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.691 -0.249 19193 732 1 3 . 1 1 9 9 ILE C C 9 177.620 177.620 176.552 1.068 19193 733 1 3 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.015 1.396 19193 734 1 3 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.903 0.808 19193 735 1 3 . 1 1 9 9 ILE H H 9 7.166 7.166 7.413 -0.247 19193 736 1 3 . 1 1 10 10 ASP N N 10 119.154 119.154 121.769 -2.615 19193 737 1 3 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.488 -0.636 19193 738 1 3 . 1 1 10 10 ASP C C 10 174.446 174.446 177.138 -2.692 19193 739 1 3 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.654 -1.267 19193 740 1 3 . 1 1 10 10 ASP CB C 10 38.297 38.297 38.894 -0.597 19193 741 1 3 . 1 1 10 10 ASP H H 10 7.629 7.629 7.400 0.229 19193 742 1 3 . 1 1 11 11 VAL N N 11 124.080 124.080 123.208 0.872 19193 743 1 3 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.714 0.096 19193 744 1 3 . 1 1 11 11 VAL C C 11 174.883 174.883 176.607 -1.724 19193 745 1 3 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.821 0.067 19193 746 1 3 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.705 0.215 19193 747 1 3 . 1 1 11 11 VAL H H 11 7.956 7.956 7.751 0.205 19193 748 1 3 . 1 1 12 12 ASN N N 12 114.490 114.490 116.787 -2.297 19193 749 1 3 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.624 0.136 19193 750 1 3 . 1 1 12 12 ASN C C 12 173.671 173.671 176.474 -2.803 19193 751 1 3 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.454 -0.836 19193 752 1 3 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.211 -0.639 19193 753 1 3 . 1 1 12 12 ASN H H 12 7.630 7.630 7.853 -0.223 19193 754 1 3 . 1 1 13 13 GLY N N 13 109.255 109.255 108.745 0.510 19193 755 1 3 . 1 1 13 13 GLY C C 13 172.031 172.031 174.840 -2.809 19193 756 1 3 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.584 0.414 19193 757 1 3 . 1 1 13 13 GLY H H 13 7.643 7.643 7.898 -0.255 19193 758 1 3 . 1 1 14 14 ASP N N 14 118.441 118.441 118.979 -0.538 19193 759 1 3 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.640 -0.110 19193 760 1 3 . 1 1 14 14 ASP C C 14 174.877 174.877 177.526 -2.649 19193 761 1 3 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.078 -0.205 19193 762 1 3 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.335 -1.306 19193 763 1 3 . 1 1 14 14 ASP H H 14 7.956 7.956 7.789 0.167 19193 764 1 3 . 1 1 15 15 GLY N N 15 118.441 118.441 107.415 11.026 19193 765 1 3 . 1 1 15 15 GLY C C 15 169.627 169.627 173.203 -3.576 19193 766 1 3 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.716 0.157 19193 767 1 3 . 1 1 15 15 GLY H H 15 10.286 10.286 8.763 1.523 19193 768 1 3 . 1 1 16 16 ALA N N 16 122.512 122.512 121.690 0.822 19193 769 1 3 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.726 -0.796 19193 770 1 3 . 1 1 16 16 ALA C C 16 172.696 172.696 175.973 -3.277 19193 771 1 3 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.760 -0.881 19193 772 1 3 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.618 -0.480 19193 773 1 3 . 1 1 16 16 ALA H H 16 7.883 7.883 7.969 -0.086 19193 774 1 3 . 1 1 17 17 VAL N N 17 124.615 124.615 118.540 6.075 19193 775 1 3 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.863 0.077 19193 776 1 3 . 1 1 17 17 VAL C C 17 172.461 172.461 175.249 -2.788 19193 777 1 3 . 1 1 17 17 VAL CA C 17 60.441 60.441 59.431 1.010 19193 778 1 3 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.021 -1.485 19193 779 1 3 . 1 1 17 17 VAL H H 17 9.373 9.373 8.761 0.612 19193 780 1 3 . 1 1 18 18 SER N N 18 125.090 125.090 122.158 2.932 19193 781 1 3 . 1 1 18 18 SER HA H 18 4.970 4.970 5.145 -0.175 19193 782 1 3 . 1 1 18 18 SER C C 18 172.145 172.145 176.194 -4.049 19193 783 1 3 . 1 1 18 18 SER CA C 18 55.641 55.641 57.374 -1.733 19193 784 1 3 . 1 1 18 18 SER CB C 18 66.313 66.313 65.105 1.208 19193 785 1 3 . 1 1 18 18 SER H H 18 8.885 8.885 7.942 0.943 19193 786 1 3 . 1 1 19 19 TYR N N 19 123.319 123.319 120.053 3.266 19193 787 1 3 . 1 1 19 19 TYR HA H 19 4.960 4.960 4.115 0.845 19193 788 1 3 . 1 1 19 19 TYR C C 19 174.218 174.218 177.452 -3.234 19193 789 1 3 . 1 1 19 19 TYR CA C 19 62.398 62.398 61.172 1.226 19193 790 1 3 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.664 0.195 19193 791 1 3 . 1 1 19 19 TYR H H 19 9.180 9.180 8.174 1.006 19193 792 1 3 . 1 1 20 20 GLU N N 20 117.323 117.323 119.393 -2.070 19193 793 1 3 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.774 1.006 19193 794 1 3 . 1 1 20 20 GLU C C 20 177.285 177.285 179.006 -1.721 19193 795 1 3 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.667 0.103 19193 796 1 3 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.473 -0.008 19193 797 1 3 . 1 1 20 20 GLU H H 20 8.520 8.520 7.524 0.996 19193 798 1 3 . 1 1 21 21 GLU N N 21 120.067 120.067 118.641 1.426 19193 799 1 3 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.892 0.888 19193 800 1 3 . 1 1 21 21 GLU C C 21 177.617 177.617 179.047 -1.430 19193 801 1 3 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.392 -0.491 19193 802 1 3 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.218 -1.320 19193 803 1 3 . 1 1 21 21 GLU H H 21 7.738 7.738 7.421 0.317 19193 804 1 3 . 1 1 22 22 VAL N N 22 122.931 122.931 120.401 2.530 19193 805 1 3 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.844 -0.344 19193 806 1 3 . 1 1 22 22 VAL C C 22 173.899 173.899 178.133 -4.234 19193 807 1 3 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.900 0.630 19193 808 1 3 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.247 -0.466 19193 809 1 3 . 1 1 22 22 VAL H H 22 8.110 8.110 8.038 0.072 19193 810 1 3 . 1 1 23 23 LYS N N 23 120.609 120.609 118.611 1.998 19193 811 1 3 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.988 -0.488 19193 812 1 3 . 1 1 23 23 LYS C C 23 175.965 175.965 179.421 -3.456 19193 813 1 3 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.417 0.738 19193 814 1 3 . 1 1 23 23 LYS CB C 23 31.640 31.640 31.931 -0.291 19193 815 1 3 . 1 1 23 23 LYS H H 23 8.613 8.613 7.936 0.677 19193 816 1 3 . 1 1 24 24 ALA N N 24 121.619 121.619 122.436 -0.817 19193 817 1 3 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.149 -0.129 19193 818 1 3 . 1 1 24 24 ALA C C 24 176.843 176.843 179.696 -2.853 19193 819 1 3 . 1 1 24 24 ALA CA C 24 54.755 54.755 54.979 -0.224 19193 820 1 3 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.121 -0.037 19193 821 1 3 . 1 1 24 24 ALA H H 24 8.038 8.038 7.856 0.182 19193 822 1 3 . 1 1 25 25 PHE N N 25 118.380 118.380 119.484 -1.104 19193 823 1 3 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.175 0.045 19193 824 1 3 . 1 1 25 25 PHE C C 25 174.657 174.657 178.235 -3.578 19193 825 1 3 . 1 1 25 25 PHE CA C 25 61.143 61.143 59.782 1.361 19193 826 1 3 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.820 0.746 19193 827 1 3 . 1 1 25 25 PHE H H 25 7.668 7.668 8.049 -0.381 19193 828 1 3 . 1 1 26 26 VAL N N 26 117.975 117.975 118.930 -0.955 19193 829 1 3 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.739 -0.559 19193 830 1 3 . 1 1 26 26 VAL C C 26 175.212 175.212 178.345 -3.133 19193 831 1 3 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.253 1.286 19193 832 1 3 . 1 1 26 26 VAL CB C 26 31.406 31.406 30.882 0.524 19193 833 1 3 . 1 1 26 26 VAL H H 26 8.667 8.667 7.913 0.754 19193 834 1 3 . 1 1 27 27 SER N N 27 112.988 112.988 115.696 -2.708 19193 835 1 3 . 1 1 27 27 SER HA H 27 4.900 4.900 4.458 0.442 19193 836 1 3 . 1 1 27 27 SER C C 27 172.256 172.256 174.862 -2.606 19193 837 1 3 . 1 1 27 27 SER CA C 27 60.403 60.403 60.981 -0.578 19193 838 1 3 . 1 1 27 27 SER CB C 27 63.131 63.131 63.235 -0.104 19193 839 1 3 . 1 1 27 27 SER H H 27 8.138 8.138 7.739 0.399 19193 840 1 3 . 1 1 28 28 LYS N N 28 119.278 119.278 118.429 0.849 19193 841 1 3 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.217 -0.157 19193 842 1 3 . 1 1 28 28 LYS C C 28 174.753 174.753 177.406 -2.653 19193 843 1 3 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.501 0.398 19193 844 1 3 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.334 -0.111 19193 845 1 3 . 1 1 28 28 LYS H H 28 7.077 7.077 7.416 -0.339 19193 846 1 3 . 1 1 29 29 LYS N N 29 116.136 116.136 117.051 -0.915 19193 847 1 3 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.460 -0.200 19193 848 1 3 . 1 1 29 29 LYS C C 29 173.137 173.137 176.456 -3.319 19193 849 1 3 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.759 -1.751 19193 850 1 3 . 1 1 29 29 LYS CB C 29 33.689 33.689 34.110 -0.421 19193 851 1 3 . 1 1 29 29 LYS H H 29 7.452 7.452 8.080 -0.628 19193 852 1 3 . 1 1 30 30 ARG N N 30 116.823 116.823 116.083 0.740 19193 853 1 3 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.471 -0.001 19193 854 1 3 . 1 1 30 30 ARG C C 30 169.632 169.632 173.393 -3.761 19193 855 1 3 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.321 -0.940 19193 856 1 3 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.550 -0.478 19193 857 1 3 . 1 1 30 30 ARG H H 30 8.079 8.079 7.628 0.451 19193 858 1 3 . 1 1 31 31 ALA N N 31 121.111 121.111 123.127 -2.016 19193 859 1 3 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.785 -0.325 19193 860 1 3 . 1 1 31 31 ALA C C 31 175.120 175.120 176.864 -1.744 19193 861 1 3 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.416 -0.419 19193 862 1 3 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.802 -0.707 19193 863 1 3 . 1 1 31 31 ALA H H 31 7.929 7.929 8.361 -0.432 19193 864 1 3 . 1 1 32 32 ILE N N 32 123.829 123.829 120.551 3.278 19193 865 1 3 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.496 -0.106 19193 866 1 3 . 1 1 32 32 ILE C C 32 173.398 173.398 174.917 -1.519 19193 867 1 3 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.758 0.273 19193 868 1 3 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.740 -2.575 19193 869 1 3 . 1 1 32 32 ILE H H 32 8.552 8.552 8.113 0.439 19193 870 1 3 . 1 1 33 33 LYS N N 33 130.536 130.536 128.334 2.202 19193 871 1 3 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.410 -0.390 19193 872 1 3 . 1 1 33 33 LYS C C 33 174.009 174.009 175.693 -1.684 19193 873 1 3 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.406 0.235 19193 874 1 3 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.450 4.960 19193 875 1 3 . 1 1 33 33 LYS H H 33 9.444 9.444 8.624 0.820 19193 876 1 3 . 1 1 34 34 ASN N N 34 120.119 120.119 125.212 -5.093 19193 877 1 3 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.917 -0.137 19193 878 1 3 . 1 1 34 34 ASN C C 34 171.824 171.824 175.139 -3.315 19193 879 1 3 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.388 -1.385 19193 880 1 3 . 1 1 34 34 ASN CB C 34 38.288 38.288 39.913 -1.625 19193 881 1 3 . 1 1 34 34 ASN H H 34 8.724 8.724 8.566 0.158 19193 882 1 3 . 1 1 35 35 GLU N N 35 124.613 124.613 124.764 -0.151 19193 883 1 3 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.103 0.187 19193 884 1 3 . 1 1 35 35 GLU C C 35 174.770 174.770 177.545 -2.775 19193 885 1 3 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.408 -0.101 19193 886 1 3 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.668 -0.911 19193 887 1 3 . 1 1 35 35 GLU H H 35 8.860 8.860 8.853 0.007 19193 888 1 3 . 1 1 36 36 GLN N N 36 118.117 118.117 120.136 -2.019 19193 889 1 3 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.224 0.556 19193 890 1 3 . 1 1 36 36 GLN C C 36 176.083 176.083 178.496 -2.413 19193 891 1 3 . 1 1 36 36 GLN CA C 36 59.141 59.141 59.125 0.016 19193 892 1 3 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.404 -0.807 19193 893 1 3 . 1 1 36 36 GLN H H 36 8.346 8.346 8.550 -0.204 19193 894 1 3 . 1 1 37 37 LEU N N 37 119.945 119.945 119.862 0.083 19193 895 1 3 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.066 0.033 19193 896 1 3 . 1 1 37 37 LEU C C 37 175.096 175.096 179.292 -4.196 19193 897 1 3 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.566 -0.179 19193 898 1 3 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.162 0.041 19193 899 1 3 . 1 1 37 37 LEU H H 37 7.469 7.469 8.302 -0.833 19193 900 1 3 . 1 1 38 38 LEU N N 38 119.102 119.102 119.848 -0.746 19193 901 1 3 . 1 1 38 38 LEU HA H 38 4.130 4.130 4.008 0.122 19193 902 1 3 . 1 1 38 38 LEU C C 38 175.531 175.531 179.009 -3.478 19193 903 1 3 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.361 -0.488 19193 904 1 3 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.110 -0.245 19193 905 1 3 . 1 1 38 38 LEU H H 38 7.110 7.110 7.857 -0.747 19193 906 1 3 . 1 1 39 39 GLN N N 39 118.022 118.022 118.454 -0.432 19193 907 1 3 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.064 -0.134 19193 908 1 3 . 1 1 39 39 GLN C C 39 175.315 175.315 178.906 -3.591 19193 909 1 3 . 1 1 39 39 GLN CA C 39 59.511 59.511 59.405 0.106 19193 910 1 3 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.818 -0.924 19193 911 1 3 . 1 1 39 39 GLN H H 39 8.579 8.579 7.813 0.766 19193 912 1 3 . 1 1 40 40 LEU N N 40 120.372 120.372 120.972 -0.600 19193 913 1 3 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.019 -0.079 19193 914 1 3 . 1 1 40 40 LEU C C 40 176.514 176.514 179.237 -2.723 19193 915 1 3 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.122 -0.495 19193 916 1 3 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.216 -0.168 19193 917 1 3 . 1 1 40 40 LEU H H 40 7.890 7.890 8.407 -0.517 19193 918 1 3 . 1 1 41 41 ILE N N 41 120.723 120.723 119.117 1.606 19193 919 1 3 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.638 0.502 19193 920 1 3 . 1 1 41 41 ILE C C 41 174.220 174.220 177.964 -3.744 19193 921 1 3 . 1 1 41 41 ILE CA C 41 66.019 66.019 65.341 0.678 19193 922 1 3 . 1 1 41 41 ILE CB C 41 38.279 38.279 37.874 0.405 19193 923 1 3 . 1 1 41 41 ILE H H 41 8.106 8.106 8.513 -0.407 19193 924 1 3 . 1 1 42 42 PHE N N 42 119.850 119.850 122.082 -2.232 19193 925 1 3 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.096 0.684 19193 926 1 3 . 1 1 42 42 PHE C C 42 173.670 173.670 177.068 -3.398 19193 927 1 3 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.959 0.937 19193 928 1 3 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.866 1.152 19193 929 1 3 . 1 1 42 42 PHE H H 42 8.695 8.695 8.364 0.331 19193 930 1 3 . 1 1 43 43 LYS N N 43 115.976 115.976 117.425 -1.449 19193 931 1 3 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.677 0.343 19193 932 1 3 . 1 1 43 43 LYS C C 43 175.313 175.313 177.922 -2.609 19193 933 1 3 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.845 0.045 19193 934 1 3 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.407 0.112 19193 935 1 3 . 1 1 43 43 LYS H H 43 8.405 8.405 7.732 0.673 19193 936 1 3 . 1 1 44 44 SER N N 44 112.481 112.481 113.934 -1.453 19193 937 1 3 . 1 1 44 44 SER HA H 44 4.100 4.100 4.167 -0.067 19193 938 1 3 . 1 1 44 44 SER C C 44 172.469 172.469 175.859 -3.390 19193 939 1 3 . 1 1 44 44 SER CA C 44 61.017 61.017 60.900 0.117 19193 940 1 3 . 1 1 44 44 SER CB C 44 63.450 63.450 63.610 -0.160 19193 941 1 3 . 1 1 44 44 SER H H 44 7.492 7.492 7.680 -0.188 19193 942 1 3 . 1 1 45 45 ILE N N 45 120.793 120.793 118.185 2.608 19193 943 1 3 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.490 1.070 19193 944 1 3 . 1 1 45 45 ILE C C 45 174.535 174.535 175.779 -1.244 19193 945 1 3 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.461 -0.686 19193 946 1 3 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.234 -0.255 19193 947 1 3 . 1 1 45 45 ILE H H 45 7.407 7.407 7.835 -0.428 19193 948 1 3 . 1 1 46 46 ASP N N 46 118.226 118.226 118.875 -0.649 19193 949 1 3 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.507 -0.107 19193 950 1 3 . 1 1 46 46 ASP C C 46 173.226 173.226 175.848 -2.622 19193 951 1 3 . 1 1 46 46 ASP CA C 46 52.245 52.245 53.617 -1.372 19193 952 1 3 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.460 -3.428 19193 953 1 3 . 1 1 46 46 ASP H H 46 7.343 7.343 7.404 -0.061 19193 954 1 3 . 1 1 47 47 ALA N N 47 130.084 130.084 129.477 0.607 19193 955 1 3 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.995 0.395 19193 956 1 3 . 1 1 47 47 ALA C C 47 176.299 176.299 177.976 -1.677 19193 957 1 3 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.312 0.254 19193 958 1 3 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.442 -0.222 19193 959 1 3 . 1 1 47 47 ALA H H 47 7.742 7.742 8.546 -0.804 19193 960 1 3 . 1 1 48 48 ASP N N 48 113.283 113.283 113.562 -0.279 19193 961 1 3 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.630 -0.030 19193 962 1 3 . 1 1 48 48 ASP C C 48 175.111 175.111 177.035 -1.924 19193 963 1 3 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.243 -0.733 19193 964 1 3 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.142 -1.703 19193 965 1 3 . 1 1 48 48 ASP H H 48 8.038 8.038 7.827 0.211 19193 966 1 3 . 1 1 49 49 GLY C C 49 172.256 172.256 174.708 -2.452 19193 967 1 3 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.732 1.002 19193 968 1 3 . 1 1 49 49 GLY H H 49 7.775 7.775 7.940 -0.165 19193 969 1 3 . 1 1 50 50 ASN N N 50 119.017 119.017 118.785 0.232 19193 970 1 3 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.642 -0.012 19193 971 1 3 . 1 1 50 50 ASN C C 50 173.670 173.670 176.699 -3.029 19193 972 1 3 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.128 1.248 19193 973 1 3 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.805 0.607 19193 974 1 3 . 1 1 50 50 ASN H H 50 8.155 8.155 7.936 0.219 19193 975 1 3 . 1 1 51 51 GLY C C 51 169.963 169.963 173.662 -3.699 19193 976 1 3 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.257 -2.020 19193 977 1 3 . 1 1 51 51 GLY H H 51 10.668 10.668 8.745 1.923 19193 978 1 3 . 1 1 52 52 GLU N N 52 116.254 116.254 119.004 -2.750 19193 979 1 3 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.084 -0.124 19193 980 1 3 . 1 1 52 52 GLU C C 52 171.378 171.378 175.279 -3.901 19193 981 1 3 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.256 -0.949 19193 982 1 3 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.355 0.726 19193 983 1 3 . 1 1 52 52 GLU H H 52 7.579 7.579 8.308 -0.729 19193 984 1 3 . 1 1 53 53 ILE N N 53 126.770 126.770 121.948 4.822 19193 985 1 3 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.988 -0.008 19193 986 1 3 . 1 1 53 53 ILE C C 53 172.922 172.922 176.442 -3.520 19193 987 1 3 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.095 -1.449 19193 988 1 3 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.822 -0.805 19193 989 1 3 . 1 1 53 53 ILE H H 53 9.661 9.661 9.105 0.556 19193 990 1 3 . 1 1 54 54 ASP N N 54 128.225 128.225 127.212 1.013 19193 991 1 3 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.226 -0.316 19193 992 1 3 . 1 1 54 54 ASP C C 54 173.562 173.562 178.108 -4.546 19193 993 1 3 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.473 -1.581 19193 994 1 3 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.643 0.257 19193 995 1 3 . 1 1 54 54 ASP H H 54 8.771 8.771 9.325 -0.554 19193 996 1 3 . 1 1 55 55 GLN N N 55 116.090 116.090 120.644 -4.554 19193 997 1 3 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.696 0.644 19193 998 1 3 . 1 1 55 55 GLN C C 55 175.643 175.643 177.635 -1.992 19193 999 1 3 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.613 0.032 19193 1000 1 3 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.244 -0.347 19193 1001 1 3 . 1 1 55 55 GLN H H 55 8.563 8.563 8.532 0.031 19193 1002 1 3 . 1 1 56 56 ASN N N 56 119.830 119.830 119.495 0.335 19193 1003 1 3 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.348 0.422 19193 1004 1 3 . 1 1 56 56 ASN C C 56 178.242 178.242 177.726 0.516 19193 1005 1 3 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.304 -0.417 19193 1006 1 3 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.484 0.779 19193 1007 1 3 . 1 1 56 56 ASN H H 56 8.205 8.205 8.678 -0.473 19193 1008 1 3 . 1 1 57 57 GLU N N 57 123.242 123.242 120.361 2.881 19193 1009 1 3 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.982 0.028 19193 1010 1 3 . 1 1 57 57 GLU C C 57 177.498 177.498 179.104 -1.606 19193 1011 1 3 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.387 -0.747 19193 1012 1 3 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.461 0.163 19193 1013 1 3 . 1 1 57 57 GLU H H 57 9.079 9.079 8.069 1.010 19193 1014 1 3 . 1 1 58 58 PHE N N 58 119.057 119.057 120.663 -1.606 19193 1015 1 3 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.370 -0.340 19193 1016 1 3 . 1 1 58 58 PHE C C 58 173.784 173.784 177.386 -3.602 19193 1017 1 3 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.508 0.236 19193 1018 1 3 . 1 1 58 58 PHE CB C 58 39.581 39.581 39.032 0.549 19193 1019 1 3 . 1 1 58 58 PHE H H 58 8.795 8.795 8.338 0.457 19193 1020 1 3 . 1 1 59 59 ALA N N 59 120.919 120.919 121.971 -1.052 19193 1021 1 3 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.067 -0.107 19193 1022 1 3 . 1 1 59 59 ALA C C 59 177.602 177.602 179.405 -1.803 19193 1023 1 3 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.028 -0.100 19193 1024 1 3 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.340 -0.549 19193 1025 1 3 . 1 1 59 59 ALA H H 59 8.158 8.158 8.268 -0.110 19193 1026 1 3 . 1 1 60 60 LYS N N 60 116.767 116.767 115.765 1.002 19193 1027 1 3 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.082 -0.032 19193 1028 1 3 . 1 1 60 60 LYS C C 60 175.309 175.309 177.906 -2.597 19193 1029 1 3 . 1 1 60 60 LYS CA C 60 58.274 58.274 58.056 0.218 19193 1030 1 3 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.500 -0.279 19193 1031 1 3 . 1 1 60 60 LYS H H 60 7.554 7.554 8.002 -0.448 19193 1032 1 3 . 1 1 61 61 PHE N N 61 118.086 118.086 119.395 -1.309 19193 1033 1 3 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.254 0.236 19193 1034 1 3 . 1 1 61 61 PHE C C 61 173.559 173.559 175.726 -2.167 19193 1035 1 3 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.369 1.152 19193 1036 1 3 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.824 0.215 19193 1037 1 3 . 1 1 61 61 PHE H H 61 7.231 7.231 7.576 -0.345 19193 1038 1 3 . 1 1 62 62 TYR N N 62 120.802 120.802 122.389 -1.587 19193 1039 1 3 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.631 0.839 19193 1040 1 3 . 1 1 62 62 TYR C C 62 173.559 173.559 175.637 -2.078 19193 1041 1 3 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.740 1.148 19193 1042 1 3 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.834 0.440 19193 1043 1 3 . 1 1 62 62 TYR H H 62 8.301 8.301 7.908 0.393 19193 1044 1 3 . 1 1 63 63 GLY N N 63 132.741 132.741 115.517 17.224 19193 1045 1 3 . 1 1 63 63 GLY C C 63 172.799 172.799 174.528 -1.729 19193 1046 1 3 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.932 1.320 19193 1047 1 3 . 1 1 63 63 GLY H H 63 8.293 8.293 7.883 0.410 19193 1048 1 3 . 1 1 64 64 SER N N 64 115.064 115.064 114.778 0.286 19193 1049 1 3 . 1 1 64 64 SER HA H 64 4.780 4.780 4.540 0.240 19193 1050 1 3 . 1 1 64 64 SER C C 64 170.939 170.939 175.487 -4.548 19193 1051 1 3 . 1 1 64 64 SER CA C 64 60.525 60.525 57.380 3.145 19193 1052 1 3 . 1 1 64 64 SER CB C 64 63.430 63.430 63.414 0.016 19193 1053 1 3 . 1 1 64 64 SER H H 64 7.833 7.833 7.535 0.298 19193 1054 1 3 . 1 1 65 65 ILE N N 65 112.928 112.928 120.974 -8.046 19193 1055 1 3 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.132 0.128 19193 1056 1 3 . 1 1 65 65 ILE C C 65 175.695 175.695 175.367 0.328 19193 1057 1 3 . 1 1 65 65 ILE CA C 65 59.752 59.752 61.228 -1.476 19193 1058 1 3 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.812 1.910 19193 1059 1 3 . 1 1 65 65 ILE H H 65 6.935 6.935 7.839 -0.904 19193 1060 1 4 . 1 1 5 5 LEU N N 5 120.669 120.669 117.210 3.459 19193 1061 1 4 . 1 1 5 5 LEU HA H 5 4.210 4.210 4.054 0.156 19193 1062 1 4 . 1 1 5 5 LEU CA C 5 58.825 58.825 56.865 1.960 19193 1063 1 4 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.099 1.165 19193 1064 1 4 . 1 1 5 5 LEU H H 5 7.998 7.998 7.978 0.020 19193 1065 1 4 . 1 1 6 6 PHE N N 6 117.996 117.996 120.055 -2.059 19193 1066 1 4 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.922 -0.062 19193 1067 1 4 . 1 1 6 6 PHE C C 6 175.520 175.520 176.915 -1.395 19193 1068 1 4 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.238 1.976 19193 1069 1 4 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.625 0.393 19193 1070 1 4 . 1 1 6 6 PHE H H 6 7.276 7.276 8.004 -0.728 19193 1071 1 4 . 1 1 7 7 LYS N N 7 114.616 114.616 118.824 -4.208 19193 1072 1 4 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.839 0.122 19193 1073 1 4 . 1 1 7 7 LYS C C 7 175.105 175.105 177.937 -2.832 19193 1074 1 4 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.801 -0.031 19193 1075 1 4 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.272 -0.035 19193 1076 1 4 . 1 1 7 7 LYS H H 7 7.523 7.523 7.574 -0.051 19193 1077 1 4 . 1 1 8 8 GLU N N 8 117.996 117.996 119.554 -1.558 19193 1078 1 4 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.062 -0.202 19193 1079 1 4 . 1 1 8 8 GLU C C 8 174.994 174.994 178.412 -3.418 19193 1080 1 4 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.802 -0.543 19193 1081 1 4 . 1 1 8 8 GLU CB C 8 29.303 29.303 30.027 -0.724 19193 1082 1 4 . 1 1 8 8 GLU H H 8 7.276 7.276 7.739 -0.463 19193 1083 1 4 . 1 1 9 9 ILE N N 9 117.880 117.880 116.266 1.614 19193 1084 1 4 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.700 -0.258 19193 1085 1 4 . 1 1 9 9 ILE C C 9 177.620 177.620 176.615 1.005 19193 1086 1 4 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.127 1.284 19193 1087 1 4 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.809 0.902 19193 1088 1 4 . 1 1 9 9 ILE H H 9 7.166 7.166 7.613 -0.447 19193 1089 1 4 . 1 1 10 10 ASP N N 10 119.154 119.154 122.077 -2.923 19193 1090 1 4 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.637 -0.785 19193 1091 1 4 . 1 1 10 10 ASP C C 10 174.446 174.446 177.433 -2.987 19193 1092 1 4 . 1 1 10 10 ASP CA C 10 52.387 52.387 54.012 -1.625 19193 1093 1 4 . 1 1 10 10 ASP CB C 10 38.297 38.297 39.080 -0.783 19193 1094 1 4 . 1 1 10 10 ASP H H 10 7.629 7.629 7.478 0.151 19193 1095 1 4 . 1 1 11 11 VAL N N 11 124.080 124.080 122.667 1.413 19193 1096 1 4 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.747 0.063 19193 1097 1 4 . 1 1 11 11 VAL C C 11 174.883 174.883 176.700 -1.817 19193 1098 1 4 . 1 1 11 11 VAL CA C 11 64.888 64.888 65.028 -0.140 19193 1099 1 4 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.119 0.801 19193 1100 1 4 . 1 1 11 11 VAL H H 11 7.956 7.956 7.998 -0.042 19193 1101 1 4 . 1 1 12 12 ASN N N 12 114.490 114.490 116.426 -1.936 19193 1102 1 4 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.645 0.115 19193 1103 1 4 . 1 1 12 12 ASN C C 12 173.671 173.671 176.609 -2.938 19193 1104 1 4 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.559 -0.941 19193 1105 1 4 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.296 -0.724 19193 1106 1 4 . 1 1 12 12 ASN H H 12 7.630 7.630 7.821 -0.191 19193 1107 1 4 . 1 1 13 13 GLY N N 13 109.255 109.255 109.292 -0.037 19193 1108 1 4 . 1 1 13 13 GLY C C 13 172.031 172.031 174.940 -2.909 19193 1109 1 4 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.425 0.574 19193 1110 1 4 . 1 1 13 13 GLY H H 13 7.643 7.643 7.980 -0.337 19193 1111 1 4 . 1 1 14 14 ASP N N 14 118.441 118.441 118.347 0.094 19193 1112 1 4 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.595 -0.065 19193 1113 1 4 . 1 1 14 14 ASP C C 14 174.877 174.877 177.480 -2.603 19193 1114 1 4 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.404 -0.531 19193 1115 1 4 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.735 -1.706 19193 1116 1 4 . 1 1 14 14 ASP H H 14 7.956 7.956 7.912 0.044 19193 1117 1 4 . 1 1 15 15 GLY N N 15 118.441 118.441 107.474 10.967 19193 1118 1 4 . 1 1 15 15 GLY C C 15 169.627 169.627 173.267 -3.640 19193 1119 1 4 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.819 0.054 19193 1120 1 4 . 1 1 15 15 GLY H H 15 10.286 10.286 8.747 1.539 19193 1121 1 4 . 1 1 16 16 ALA N N 16 122.512 122.512 121.380 1.132 19193 1122 1 4 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.634 -0.704 19193 1123 1 4 . 1 1 16 16 ALA C C 16 172.696 172.696 176.034 -3.338 19193 1124 1 4 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.937 -1.058 19193 1125 1 4 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.542 -0.404 19193 1126 1 4 . 1 1 16 16 ALA H H 16 7.883 7.883 7.839 0.044 19193 1127 1 4 . 1 1 17 17 VAL N N 17 124.615 124.615 123.380 1.235 19193 1128 1 4 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.486 0.454 19193 1129 1 4 . 1 1 17 17 VAL C C 17 172.461 172.461 175.512 -3.051 19193 1130 1 4 . 1 1 17 17 VAL CA C 17 60.441 60.441 60.232 0.209 19193 1131 1 4 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.244 -1.708 19193 1132 1 4 . 1 1 17 17 VAL H H 17 9.373 9.373 8.922 0.451 19193 1133 1 4 . 1 1 18 18 SER N N 18 125.090 125.090 123.478 1.612 19193 1134 1 4 . 1 1 18 18 SER HA H 18 4.970 4.970 5.061 -0.091 19193 1135 1 4 . 1 1 18 18 SER C C 18 172.145 172.145 176.048 -3.903 19193 1136 1 4 . 1 1 18 18 SER CA C 18 55.641 55.641 57.800 -2.159 19193 1137 1 4 . 1 1 18 18 SER CB C 18 66.313 66.313 64.878 1.435 19193 1138 1 4 . 1 1 18 18 SER H H 18 8.885 8.885 8.108 0.777 19193 1139 1 4 . 1 1 19 19 TYR N N 19 123.319 123.319 119.796 3.523 19193 1140 1 4 . 1 1 19 19 TYR HA H 19 4.960 4.960 3.675 1.285 19193 1141 1 4 . 1 1 19 19 TYR C C 19 174.218 174.218 177.388 -3.170 19193 1142 1 4 . 1 1 19 19 TYR CA C 19 62.398 62.398 60.854 1.544 19193 1143 1 4 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.345 0.514 19193 1144 1 4 . 1 1 19 19 TYR H H 19 9.180 9.180 7.765 1.415 19193 1145 1 4 . 1 1 20 20 GLU N N 20 117.323 117.323 119.591 -2.268 19193 1146 1 4 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.755 1.025 19193 1147 1 4 . 1 1 20 20 GLU C C 20 177.285 177.285 178.824 -1.539 19193 1148 1 4 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.702 0.068 19193 1149 1 4 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.288 0.177 19193 1150 1 4 . 1 1 20 20 GLU H H 20 8.520 8.520 7.279 1.241 19193 1151 1 4 . 1 1 21 21 GLU N N 21 120.067 120.067 119.100 0.967 19193 1152 1 4 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.936 0.844 19193 1153 1 4 . 1 1 21 21 GLU C C 21 177.617 177.617 178.954 -1.337 19193 1154 1 4 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.461 -0.560 19193 1155 1 4 . 1 1 21 21 GLU CB C 21 27.898 27.898 28.973 -1.075 19193 1156 1 4 . 1 1 21 21 GLU H H 21 7.738 7.738 7.812 -0.074 19193 1157 1 4 . 1 1 22 22 VAL N N 22 122.931 122.931 120.480 2.451 19193 1158 1 4 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.461 0.039 19193 1159 1 4 . 1 1 22 22 VAL C C 22 173.899 173.899 178.142 -4.243 19193 1160 1 4 . 1 1 22 22 VAL CA C 22 67.530 67.530 67.015 0.515 19193 1161 1 4 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.151 -0.370 19193 1162 1 4 . 1 1 22 22 VAL H H 22 8.110 8.110 8.298 -0.188 19193 1163 1 4 . 1 1 23 23 LYS N N 23 120.609 120.609 118.701 1.908 19193 1164 1 4 . 1 1 23 23 LYS HA H 23 3.500 3.500 4.010 -0.510 19193 1165 1 4 . 1 1 23 23 LYS C C 23 175.965 175.965 179.319 -3.354 19193 1166 1 4 . 1 1 23 23 LYS CA C 23 60.155 60.155 58.822 1.333 19193 1167 1 4 . 1 1 23 23 LYS CB C 23 31.640 31.640 31.902 -0.262 19193 1168 1 4 . 1 1 23 23 LYS H H 23 8.613 8.613 7.749 0.864 19193 1169 1 4 . 1 1 24 24 ALA N N 24 121.619 121.619 122.824 -1.205 19193 1170 1 4 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.100 -0.080 19193 1171 1 4 . 1 1 24 24 ALA C C 24 176.843 176.843 179.376 -2.533 19193 1172 1 4 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.079 -0.324 19193 1173 1 4 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.474 -0.390 19193 1174 1 4 . 1 1 24 24 ALA H H 24 8.038 8.038 8.026 0.012 19193 1175 1 4 . 1 1 25 25 PHE N N 25 118.380 118.380 118.461 -0.081 19193 1176 1 4 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.130 0.090 19193 1177 1 4 . 1 1 25 25 PHE C C 25 174.657 174.657 178.675 -4.018 19193 1178 1 4 . 1 1 25 25 PHE CA C 25 61.143 61.143 60.182 0.961 19193 1179 1 4 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.419 1.147 19193 1180 1 4 . 1 1 25 25 PHE H H 25 7.668 7.668 8.560 -0.892 19193 1181 1 4 . 1 1 26 26 VAL N N 26 117.975 117.975 118.750 -0.775 19193 1182 1 4 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.754 -0.574 19193 1183 1 4 . 1 1 26 26 VAL C C 26 175.212 175.212 178.029 -2.817 19193 1184 1 4 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.690 0.849 19193 1185 1 4 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.528 -0.122 19193 1186 1 4 . 1 1 26 26 VAL H H 26 8.667 8.667 7.944 0.723 19193 1187 1 4 . 1 1 27 27 SER N N 27 112.988 112.988 116.257 -3.269 19193 1188 1 4 . 1 1 27 27 SER HA H 27 4.900 4.900 4.501 0.399 19193 1189 1 4 . 1 1 27 27 SER C C 27 172.256 172.256 175.644 -3.388 19193 1190 1 4 . 1 1 27 27 SER CA C 27 60.403 60.403 61.097 -0.694 19193 1191 1 4 . 1 1 27 27 SER CB C 27 63.131 63.131 63.176 -0.045 19193 1192 1 4 . 1 1 27 27 SER H H 27 8.138 8.138 7.834 0.304 19193 1193 1 4 . 1 1 28 28 LYS N N 28 119.278 119.278 119.284 -0.006 19193 1194 1 4 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.199 -0.139 19193 1195 1 4 . 1 1 28 28 LYS C C 28 174.753 174.753 177.020 -2.267 19193 1196 1 4 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.456 0.443 19193 1197 1 4 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.529 -0.306 19193 1198 1 4 . 1 1 28 28 LYS H H 28 7.077 7.077 7.525 -0.448 19193 1199 1 4 . 1 1 29 29 LYS N N 29 116.136 116.136 116.796 -0.660 19193 1200 1 4 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.406 -0.146 19193 1201 1 4 . 1 1 29 29 LYS C C 29 173.137 173.137 176.309 -3.172 19193 1202 1 4 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.453 -1.445 19193 1203 1 4 . 1 1 29 29 LYS CB C 29 33.689 33.689 34.149 -0.460 19193 1204 1 4 . 1 1 29 29 LYS H H 29 7.452 7.452 7.946 -0.494 19193 1205 1 4 . 1 1 30 30 ARG N N 30 116.823 116.823 116.537 0.286 19193 1206 1 4 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.492 -0.022 19193 1207 1 4 . 1 1 30 30 ARG C C 30 169.632 169.632 173.672 -4.040 19193 1208 1 4 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.434 -1.054 19193 1209 1 4 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.874 -0.802 19193 1210 1 4 . 1 1 30 30 ARG H H 30 8.079 8.079 7.504 0.575 19193 1211 1 4 . 1 1 31 31 ALA N N 31 121.111 121.111 122.948 -1.837 19193 1212 1 4 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.776 -0.316 19193 1213 1 4 . 1 1 31 31 ALA C C 31 175.120 175.120 176.741 -1.621 19193 1214 1 4 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.433 -0.436 19193 1215 1 4 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.756 -0.661 19193 1216 1 4 . 1 1 31 31 ALA H H 31 7.929 7.929 8.371 -0.442 19193 1217 1 4 . 1 1 32 32 ILE N N 32 123.829 123.829 120.740 3.089 19193 1218 1 4 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.441 -0.051 19193 1219 1 4 . 1 1 32 32 ILE C C 32 173.398 173.398 174.970 -1.572 19193 1220 1 4 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.661 0.370 19193 1221 1 4 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.767 -2.602 19193 1222 1 4 . 1 1 32 32 ILE H H 32 8.552 8.552 8.030 0.522 19193 1223 1 4 . 1 1 33 33 LYS N N 33 130.536 130.536 126.637 3.899 19193 1224 1 4 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.429 -0.409 19193 1225 1 4 . 1 1 33 33 LYS C C 33 174.009 174.009 175.464 -1.455 19193 1226 1 4 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.100 0.541 19193 1227 1 4 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.378 5.032 19193 1228 1 4 . 1 1 33 33 LYS H H 33 9.444 9.444 8.471 0.973 19193 1229 1 4 . 1 1 34 34 ASN N N 34 120.119 120.119 125.411 -5.292 19193 1230 1 4 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.904 -0.124 19193 1231 1 4 . 1 1 34 34 ASN C C 34 171.824 171.824 175.186 -3.362 19193 1232 1 4 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.854 -1.851 19193 1233 1 4 . 1 1 34 34 ASN CB C 34 38.288 38.288 40.404 -2.116 19193 1234 1 4 . 1 1 34 34 ASN H H 34 8.724 8.724 8.573 0.151 19193 1235 1 4 . 1 1 35 35 GLU N N 35 124.613 124.613 124.558 0.055 19193 1236 1 4 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.044 0.246 19193 1237 1 4 . 1 1 35 35 GLU C C 35 174.770 174.770 177.564 -2.794 19193 1238 1 4 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.679 -0.372 19193 1239 1 4 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.774 -1.018 19193 1240 1 4 . 1 1 35 35 GLU H H 35 8.860 8.860 8.848 0.012 19193 1241 1 4 . 1 1 36 36 GLN N N 36 118.117 118.117 120.184 -2.067 19193 1242 1 4 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.193 0.587 19193 1243 1 4 . 1 1 36 36 GLN C C 36 176.083 176.083 178.569 -2.486 19193 1244 1 4 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.784 0.357 19193 1245 1 4 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.527 -0.931 19193 1246 1 4 . 1 1 36 36 GLN H H 36 8.346 8.346 8.378 -0.032 19193 1247 1 4 . 1 1 37 37 LEU N N 37 119.945 119.945 121.039 -1.094 19193 1248 1 4 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.144 -0.044 19193 1249 1 4 . 1 1 37 37 LEU C C 37 175.096 175.096 178.698 -3.602 19193 1250 1 4 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.753 -0.366 19193 1251 1 4 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.460 -0.257 19193 1252 1 4 . 1 1 37 37 LEU H H 37 7.469 7.469 8.204 -0.735 19193 1253 1 4 . 1 1 38 38 LEU N N 38 119.102 119.102 119.696 -0.594 19193 1254 1 4 . 1 1 38 38 LEU HA H 38 4.130 4.130 3.990 0.140 19193 1255 1 4 . 1 1 38 38 LEU C C 38 175.531 175.531 178.891 -3.360 19193 1256 1 4 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.497 -0.624 19193 1257 1 4 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.053 -0.188 19193 1258 1 4 . 1 1 38 38 LEU H H 38 7.110 7.110 7.792 -0.682 19193 1259 1 4 . 1 1 39 39 GLN N N 39 118.022 118.022 118.993 -0.971 19193 1260 1 4 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.144 -0.214 19193 1261 1 4 . 1 1 39 39 GLN C C 39 175.315 175.315 178.885 -3.570 19193 1262 1 4 . 1 1 39 39 GLN CA C 39 59.511 59.511 58.936 0.575 19193 1263 1 4 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.572 -0.678 19193 1264 1 4 . 1 1 39 39 GLN H H 39 8.579 8.579 7.683 0.896 19193 1265 1 4 . 1 1 40 40 LEU N N 40 120.372 120.372 120.845 -0.473 19193 1266 1 4 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.000 -0.060 19193 1267 1 4 . 1 1 40 40 LEU C C 40 176.514 176.514 179.171 -2.657 19193 1268 1 4 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.098 -0.471 19193 1269 1 4 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.195 -0.147 19193 1270 1 4 . 1 1 40 40 LEU H H 40 7.890 7.890 8.289 -0.399 19193 1271 1 4 . 1 1 41 41 ILE N N 41 120.723 120.723 118.901 1.822 19193 1272 1 4 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.755 0.385 19193 1273 1 4 . 1 1 41 41 ILE C C 41 174.220 174.220 178.373 -4.153 19193 1274 1 4 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.067 1.952 19193 1275 1 4 . 1 1 41 41 ILE CB C 41 38.279 38.279 36.630 1.649 19193 1276 1 4 . 1 1 41 41 ILE H H 41 8.106 8.106 8.543 -0.437 19193 1277 1 4 . 1 1 42 42 PHE N N 42 119.850 119.850 122.423 -2.573 19193 1278 1 4 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.055 0.725 19193 1279 1 4 . 1 1 42 42 PHE C C 42 173.670 173.670 177.094 -3.424 19193 1280 1 4 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.367 1.529 19193 1281 1 4 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.572 1.446 19193 1282 1 4 . 1 1 42 42 PHE H H 42 8.695 8.695 8.473 0.222 19193 1283 1 4 . 1 1 43 43 LYS N N 43 115.976 115.976 117.830 -1.854 19193 1284 1 4 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.609 0.411 19193 1285 1 4 . 1 1 43 43 LYS C C 43 175.313 175.313 177.837 -2.524 19193 1286 1 4 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.503 0.387 19193 1287 1 4 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.265 0.254 19193 1288 1 4 . 1 1 43 43 LYS H H 43 8.405 8.405 7.623 0.782 19193 1289 1 4 . 1 1 44 44 SER N N 44 112.481 112.481 113.783 -1.302 19193 1290 1 4 . 1 1 44 44 SER HA H 44 4.100 4.100 4.120 -0.020 19193 1291 1 4 . 1 1 44 44 SER C C 44 172.469 172.469 175.929 -3.460 19193 1292 1 4 . 1 1 44 44 SER CA C 44 61.017 61.017 61.113 -0.096 19193 1293 1 4 . 1 1 44 44 SER CB C 44 63.450 63.450 63.747 -0.297 19193 1294 1 4 . 1 1 44 44 SER H H 44 7.492 7.492 7.667 -0.175 19193 1295 1 4 . 1 1 45 45 ILE N N 45 120.793 120.793 118.090 2.703 19193 1296 1 4 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.236 1.324 19193 1297 1 4 . 1 1 45 45 ILE C C 45 174.535 174.535 175.623 -1.088 19193 1298 1 4 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.291 -0.516 19193 1299 1 4 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.304 -0.325 19193 1300 1 4 . 1 1 45 45 ILE H H 45 7.407 7.407 7.780 -0.373 19193 1301 1 4 . 1 1 46 46 ASP N N 46 118.226 118.226 119.280 -1.054 19193 1302 1 4 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.469 -0.069 19193 1303 1 4 . 1 1 46 46 ASP C C 46 173.226 173.226 175.722 -2.496 19193 1304 1 4 . 1 1 46 46 ASP CA C 46 52.245 52.245 53.609 -1.365 19193 1305 1 4 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.478 -3.446 19193 1306 1 4 . 1 1 46 46 ASP H H 46 7.343 7.343 7.395 -0.052 19193 1307 1 4 . 1 1 47 47 ALA N N 47 130.084 130.084 128.459 1.625 19193 1308 1 4 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.976 0.414 19193 1309 1 4 . 1 1 47 47 ALA C C 47 176.299 176.299 177.881 -1.582 19193 1310 1 4 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.270 0.296 19193 1311 1 4 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.335 -0.115 19193 1312 1 4 . 1 1 47 47 ALA H H 47 7.742 7.742 8.485 -0.743 19193 1313 1 4 . 1 1 48 48 ASP N N 48 113.283 113.283 113.577 -0.294 19193 1314 1 4 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.612 -0.012 19193 1315 1 4 . 1 1 48 48 ASP C C 48 175.111 175.111 176.981 -1.870 19193 1316 1 4 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.210 -0.700 19193 1317 1 4 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.105 -1.666 19193 1318 1 4 . 1 1 48 48 ASP H H 48 8.038 8.038 7.817 0.221 19193 1319 1 4 . 1 1 49 49 GLY C C 49 172.256 172.256 174.674 -2.418 19193 1320 1 4 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.695 1.039 19193 1321 1 4 . 1 1 49 49 GLY H H 49 7.775 7.775 7.857 -0.082 19193 1322 1 4 . 1 1 50 50 ASN N N 50 119.017 119.017 118.766 0.251 19193 1323 1 4 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.610 0.020 19193 1324 1 4 . 1 1 50 50 ASN C C 50 173.670 173.670 176.646 -2.976 19193 1325 1 4 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.093 1.282 19193 1326 1 4 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.794 0.618 19193 1327 1 4 . 1 1 50 50 ASN H H 50 8.155 8.155 7.924 0.231 19193 1328 1 4 . 1 1 51 51 GLY C C 51 169.963 169.963 173.613 -3.650 19193 1329 1 4 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.224 -1.988 19193 1330 1 4 . 1 1 51 51 GLY H H 51 10.668 10.668 8.654 2.014 19193 1331 1 4 . 1 1 52 52 GLU N N 52 116.254 116.254 118.878 -2.624 19193 1332 1 4 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.040 -0.080 19193 1333 1 4 . 1 1 52 52 GLU C C 52 171.378 171.378 175.277 -3.899 19193 1334 1 4 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.212 -0.906 19193 1335 1 4 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.274 0.807 19193 1336 1 4 . 1 1 52 52 GLU H H 52 7.579 7.579 8.284 -0.705 19193 1337 1 4 . 1 1 53 53 ILE N N 53 126.770 126.770 121.948 4.822 19193 1338 1 4 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.945 0.035 19193 1339 1 4 . 1 1 53 53 ILE C C 53 172.922 172.922 176.451 -3.529 19193 1340 1 4 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.129 -1.483 19193 1341 1 4 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.609 -0.592 19193 1342 1 4 . 1 1 53 53 ILE H H 53 9.661 9.661 9.074 0.587 19193 1343 1 4 . 1 1 54 54 ASP N N 54 128.225 128.225 127.382 0.843 19193 1344 1 4 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.140 -0.230 19193 1345 1 4 . 1 1 54 54 ASP C C 54 173.562 173.562 178.045 -4.483 19193 1346 1 4 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.421 -1.529 19193 1347 1 4 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.610 0.290 19193 1348 1 4 . 1 1 54 54 ASP H H 54 8.771 8.771 9.260 -0.489 19193 1349 1 4 . 1 1 55 55 GLN N N 55 116.090 116.090 120.900 -4.810 19193 1350 1 4 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.955 0.385 19193 1351 1 4 . 1 1 55 55 GLN C C 55 175.643 175.643 177.563 -1.920 19193 1352 1 4 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.591 0.054 19193 1353 1 4 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.235 -0.338 19193 1354 1 4 . 1 1 55 55 GLN H H 55 8.563 8.563 8.563 0.000 19193 1355 1 4 . 1 1 56 56 ASN N N 56 119.830 119.830 119.705 0.125 19193 1356 1 4 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.346 0.424 19193 1357 1 4 . 1 1 56 56 ASN C C 56 178.242 178.242 177.638 0.604 19193 1358 1 4 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.560 -0.673 19193 1359 1 4 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.838 0.425 19193 1360 1 4 . 1 1 56 56 ASN H H 56 8.205 8.205 8.623 -0.418 19193 1361 1 4 . 1 1 57 57 GLU N N 57 123.242 123.242 120.001 3.241 19193 1362 1 4 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.993 0.017 19193 1363 1 4 . 1 1 57 57 GLU C C 57 177.498 177.498 179.133 -1.635 19193 1364 1 4 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.240 -0.600 19193 1365 1 4 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.333 0.291 19193 1366 1 4 . 1 1 57 57 GLU H H 57 9.079 9.079 8.122 0.957 19193 1367 1 4 . 1 1 58 58 PHE N N 58 119.057 119.057 120.728 -1.671 19193 1368 1 4 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.360 -0.330 19193 1369 1 4 . 1 1 58 58 PHE C C 58 173.784 173.784 177.244 -3.460 19193 1370 1 4 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.451 0.293 19193 1371 1 4 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.988 0.593 19193 1372 1 4 . 1 1 58 58 PHE H H 58 8.795 8.795 8.163 0.632 19193 1373 1 4 . 1 1 59 59 ALA N N 59 120.919 120.919 121.984 -1.065 19193 1374 1 4 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.297 -0.337 19193 1375 1 4 . 1 1 59 59 ALA C C 59 177.602 177.602 179.386 -1.784 19193 1376 1 4 . 1 1 59 59 ALA CA C 59 54.928 54.928 54.643 0.285 19193 1377 1 4 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.396 -0.605 19193 1378 1 4 . 1 1 59 59 ALA H H 59 8.158 8.158 8.092 0.066 19193 1379 1 4 . 1 1 60 60 LYS N N 60 116.767 116.767 116.988 -0.221 19193 1380 1 4 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.098 -0.048 19193 1381 1 4 . 1 1 60 60 LYS C C 60 175.309 175.309 177.895 -2.586 19193 1382 1 4 . 1 1 60 60 LYS CA C 60 58.274 58.274 58.089 0.185 19193 1383 1 4 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.455 -0.234 19193 1384 1 4 . 1 1 60 60 LYS H H 60 7.554 7.554 7.986 -0.432 19193 1385 1 4 . 1 1 61 61 PHE N N 61 118.086 118.086 118.058 0.028 19193 1386 1 4 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.357 0.133 19193 1387 1 4 . 1 1 61 61 PHE C C 61 173.559 173.559 175.594 -2.035 19193 1388 1 4 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.288 1.233 19193 1389 1 4 . 1 1 61 61 PHE CB C 61 40.039 40.039 40.067 -0.028 19193 1390 1 4 . 1 1 61 61 PHE H H 61 7.231 7.231 7.578 -0.347 19193 1391 1 4 . 1 1 62 62 TYR N N 62 120.802 120.802 121.811 -1.009 19193 1392 1 4 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.600 0.870 19193 1393 1 4 . 1 1 62 62 TYR C C 62 173.559 173.559 175.919 -2.360 19193 1394 1 4 . 1 1 62 62 TYR CA C 62 60.888 60.888 60.031 0.857 19193 1395 1 4 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.593 0.681 19193 1396 1 4 . 1 1 62 62 TYR H H 62 8.301 8.301 7.853 0.448 19193 1397 1 4 . 1 1 63 63 GLY N N 63 132.741 132.741 114.446 18.295 19193 1398 1 4 . 1 1 63 63 GLY C C 63 172.799 172.799 175.507 -2.708 19193 1399 1 4 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.960 1.292 19193 1400 1 4 . 1 1 63 63 GLY H H 63 8.293 8.293 7.948 0.345 19193 1401 1 4 . 1 1 64 64 SER N N 64 115.064 115.064 117.997 -2.933 19193 1402 1 4 . 1 1 64 64 SER HA H 64 4.780 4.780 4.476 0.304 19193 1403 1 4 . 1 1 64 64 SER C C 64 170.939 170.939 175.411 -4.472 19193 1404 1 4 . 1 1 64 64 SER CA C 64 60.525 60.525 58.096 2.429 19193 1405 1 4 . 1 1 64 64 SER CB C 64 63.430 63.430 61.870 1.560 19193 1406 1 4 . 1 1 64 64 SER H H 64 7.833 7.833 7.779 0.054 19193 1407 1 4 . 1 1 65 65 ILE N N 65 112.928 112.928 122.560 -9.632 19193 1408 1 4 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.132 0.128 19193 1409 1 4 . 1 1 65 65 ILE C C 65 175.695 175.695 176.265 -0.570 19193 1410 1 4 . 1 1 65 65 ILE CA C 65 59.752 59.752 60.935 -1.183 19193 1411 1 4 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.385 2.337 19193 1412 1 4 . 1 1 65 65 ILE H H 65 6.935 6.935 8.097 -1.162 19193 1413 1 5 . 1 1 5 5 LEU N N 5 120.669 120.669 117.472 3.197 19193 1414 1 5 . 1 1 5 5 LEU HA H 5 4.210 4.210 3.977 0.233 19193 1415 1 5 . 1 1 5 5 LEU CA C 5 58.825 58.825 57.088 1.737 19193 1416 1 5 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.431 0.834 19193 1417 1 5 . 1 1 5 5 LEU H H 5 7.998 7.998 7.535 0.463 19193 1418 1 5 . 1 1 6 6 PHE N N 6 117.996 117.996 120.132 -2.136 19193 1419 1 5 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.928 -0.068 19193 1420 1 5 . 1 1 6 6 PHE C C 6 175.520 175.520 176.903 -1.383 19193 1421 1 5 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.215 1.999 19193 1422 1 5 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.597 0.421 19193 1423 1 5 . 1 1 6 6 PHE H H 6 7.276 7.276 8.068 -0.792 19193 1424 1 5 . 1 1 7 7 LYS N N 7 114.616 114.616 118.736 -4.120 19193 1425 1 5 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.840 0.121 19193 1426 1 5 . 1 1 7 7 LYS C C 7 175.105 175.105 178.016 -2.911 19193 1427 1 5 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.847 -0.077 19193 1428 1 5 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.353 -0.116 19193 1429 1 5 . 1 1 7 7 LYS H H 7 7.523 7.523 7.603 -0.080 19193 1430 1 5 . 1 1 8 8 GLU N N 8 117.996 117.996 119.391 -1.395 19193 1431 1 5 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.068 -0.208 19193 1432 1 5 . 1 1 8 8 GLU C C 8 174.994 174.994 178.526 -3.532 19193 1433 1 5 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.858 -0.599 19193 1434 1 5 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.836 -0.533 19193 1435 1 5 . 1 1 8 8 GLU H H 8 7.276 7.276 7.724 -0.448 19193 1436 1 5 . 1 1 9 9 ILE N N 9 117.880 117.880 116.397 1.483 19193 1437 1 5 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.693 -0.251 19193 1438 1 5 . 1 1 9 9 ILE C C 9 177.620 177.620 176.531 1.089 19193 1439 1 5 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.256 1.155 19193 1440 1 5 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.798 0.913 19193 1441 1 5 . 1 1 9 9 ILE H H 9 7.166 7.166 7.594 -0.428 19193 1442 1 5 . 1 1 10 10 ASP N N 10 119.154 119.154 122.212 -3.058 19193 1443 1 5 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.638 -0.786 19193 1444 1 5 . 1 1 10 10 ASP C C 10 174.446 174.446 177.138 -2.692 19193 1445 1 5 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.895 -1.508 19193 1446 1 5 . 1 1 10 10 ASP CB C 10 38.297 38.297 39.114 -0.817 19193 1447 1 5 . 1 1 10 10 ASP H H 10 7.629 7.629 7.481 0.148 19193 1448 1 5 . 1 1 11 11 VAL N N 11 124.080 124.080 123.717 0.363 19193 1449 1 5 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.785 0.025 19193 1450 1 5 . 1 1 11 11 VAL C C 11 174.883 174.883 176.755 -1.872 19193 1451 1 5 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.675 0.213 19193 1452 1 5 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.297 0.623 19193 1453 1 5 . 1 1 11 11 VAL H H 11 7.956 7.956 8.056 -0.100 19193 1454 1 5 . 1 1 12 12 ASN N N 12 114.490 114.490 116.643 -2.153 19193 1455 1 5 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.650 0.110 19193 1456 1 5 . 1 1 12 12 ASN C C 12 173.671 173.671 176.614 -2.943 19193 1457 1 5 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.612 -0.994 19193 1458 1 5 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.416 -0.844 19193 1459 1 5 . 1 1 12 12 ASN H H 12 7.630 7.630 7.901 -0.271 19193 1460 1 5 . 1 1 13 13 GLY N N 13 109.255 109.255 108.562 0.693 19193 1461 1 5 . 1 1 13 13 GLY C C 13 172.031 172.031 174.974 -2.943 19193 1462 1 5 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.648 0.350 19193 1463 1 5 . 1 1 13 13 GLY H H 13 7.643 7.643 8.038 -0.395 19193 1464 1 5 . 1 1 14 14 ASP N N 14 118.441 118.441 119.173 -0.732 19193 1465 1 5 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.616 -0.086 19193 1466 1 5 . 1 1 14 14 ASP C C 14 174.877 174.877 177.724 -2.847 19193 1467 1 5 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.400 -0.527 19193 1468 1 5 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.178 -1.149 19193 1469 1 5 . 1 1 14 14 ASP H H 14 7.956 7.956 7.890 0.066 19193 1470 1 5 . 1 1 15 15 GLY N N 15 118.441 118.441 107.452 10.989 19193 1471 1 5 . 1 1 15 15 GLY C C 15 169.627 169.627 173.275 -3.648 19193 1472 1 5 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.818 0.055 19193 1473 1 5 . 1 1 15 15 GLY H H 15 10.286 10.286 8.755 1.531 19193 1474 1 5 . 1 1 16 16 ALA N N 16 122.512 122.512 121.526 0.986 19193 1475 1 5 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.681 -0.751 19193 1476 1 5 . 1 1 16 16 ALA C C 16 172.696 172.696 176.211 -3.515 19193 1477 1 5 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.946 -1.067 19193 1478 1 5 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.399 -0.261 19193 1479 1 5 . 1 1 16 16 ALA H H 16 7.883 7.883 7.842 0.041 19193 1480 1 5 . 1 1 17 17 VAL N N 17 124.615 124.615 123.716 0.899 19193 1481 1 5 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.333 0.607 19193 1482 1 5 . 1 1 17 17 VAL C C 17 172.461 172.461 175.114 -2.653 19193 1483 1 5 . 1 1 17 17 VAL CA C 17 60.441 60.441 61.605 -1.164 19193 1484 1 5 . 1 1 17 17 VAL CB C 17 32.536 32.536 33.959 -1.423 19193 1485 1 5 . 1 1 17 17 VAL H H 17 9.373 9.373 8.983 0.390 19193 1486 1 5 . 1 1 18 18 SER N N 18 125.090 125.090 124.052 1.038 19193 1487 1 5 . 1 1 18 18 SER HA H 18 4.970 4.970 5.210 -0.240 19193 1488 1 5 . 1 1 18 18 SER C C 18 172.145 172.145 175.960 -3.815 19193 1489 1 5 . 1 1 18 18 SER CA C 18 55.641 55.641 57.299 -1.658 19193 1490 1 5 . 1 1 18 18 SER CB C 18 66.313 66.313 64.631 1.682 19193 1491 1 5 . 1 1 18 18 SER H H 18 8.885 8.885 8.669 0.216 19193 1492 1 5 . 1 1 19 19 TYR N N 19 123.319 123.319 119.840 3.479 19193 1493 1 5 . 1 1 19 19 TYR HA H 19 4.960 4.960 3.874 1.086 19193 1494 1 5 . 1 1 19 19 TYR C C 19 174.218 174.218 177.456 -3.238 19193 1495 1 5 . 1 1 19 19 TYR CA C 19 62.398 62.398 61.108 1.290 19193 1496 1 5 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.458 0.401 19193 1497 1 5 . 1 1 19 19 TYR H H 19 9.180 9.180 7.972 1.208 19193 1498 1 5 . 1 1 20 20 GLU N N 20 117.323 117.323 119.578 -2.255 19193 1499 1 5 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.784 0.996 19193 1500 1 5 . 1 1 20 20 GLU C C 20 177.285 177.285 178.870 -1.585 19193 1501 1 5 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.677 0.093 19193 1502 1 5 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.280 0.185 19193 1503 1 5 . 1 1 20 20 GLU H H 20 8.520 8.520 7.322 1.198 19193 1504 1 5 . 1 1 21 21 GLU N N 21 120.067 120.067 119.118 0.949 19193 1505 1 5 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.961 0.819 19193 1506 1 5 . 1 1 21 21 GLU C C 21 177.617 177.617 178.886 -1.269 19193 1507 1 5 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.426 -0.525 19193 1508 1 5 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.010 -1.112 19193 1509 1 5 . 1 1 21 21 GLU H H 21 7.738 7.738 7.857 -0.119 19193 1510 1 5 . 1 1 22 22 VAL N N 22 122.931 122.931 120.654 2.277 19193 1511 1 5 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.494 0.006 19193 1512 1 5 . 1 1 22 22 VAL C C 22 173.899 173.899 178.118 -4.219 19193 1513 1 5 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.522 1.008 19193 1514 1 5 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.117 -0.336 19193 1515 1 5 . 1 1 22 22 VAL H H 22 8.110 8.110 8.286 -0.176 19193 1516 1 5 . 1 1 23 23 LYS N N 23 120.609 120.609 118.916 1.693 19193 1517 1 5 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.997 -0.497 19193 1518 1 5 . 1 1 23 23 LYS C C 23 175.965 175.965 179.232 -3.267 19193 1519 1 5 . 1 1 23 23 LYS CA C 23 60.155 60.155 58.834 1.321 19193 1520 1 5 . 1 1 23 23 LYS CB C 23 31.640 31.640 31.928 -0.288 19193 1521 1 5 . 1 1 23 23 LYS H H 23 8.613 8.613 7.763 0.850 19193 1522 1 5 . 1 1 24 24 ALA N N 24 121.619 121.619 122.816 -1.197 19193 1523 1 5 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.106 -0.086 19193 1524 1 5 . 1 1 24 24 ALA C C 24 176.843 176.843 179.377 -2.534 19193 1525 1 5 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.092 -0.337 19193 1526 1 5 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.483 -0.399 19193 1527 1 5 . 1 1 24 24 ALA H H 24 8.038 8.038 8.037 0.001 19193 1528 1 5 . 1 1 25 25 PHE N N 25 118.380 118.380 118.095 0.285 19193 1529 1 5 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.148 0.072 19193 1530 1 5 . 1 1 25 25 PHE C C 25 174.657 174.657 178.609 -3.952 19193 1531 1 5 . 1 1 25 25 PHE CA C 25 61.143 61.143 60.081 1.062 19193 1532 1 5 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.370 1.196 19193 1533 1 5 . 1 1 25 25 PHE H H 25 7.668 7.668 8.567 -0.899 19193 1534 1 5 . 1 1 26 26 VAL N N 26 117.975 117.975 118.985 -1.010 19193 1535 1 5 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.846 -0.666 19193 1536 1 5 . 1 1 26 26 VAL C C 26 175.212 175.212 178.377 -3.165 19193 1537 1 5 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.363 1.176 19193 1538 1 5 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.016 0.390 19193 1539 1 5 . 1 1 26 26 VAL H H 26 8.667 8.667 7.919 0.748 19193 1540 1 5 . 1 1 27 27 SER N N 27 112.988 112.988 116.608 -3.620 19193 1541 1 5 . 1 1 27 27 SER HA H 27 4.900 4.900 4.517 0.383 19193 1542 1 5 . 1 1 27 27 SER C C 27 172.256 172.256 175.753 -3.497 19193 1543 1 5 . 1 1 27 27 SER CA C 27 60.403 60.403 60.910 -0.507 19193 1544 1 5 . 1 1 27 27 SER CB C 27 63.131 63.131 63.108 0.023 19193 1545 1 5 . 1 1 27 27 SER H H 27 8.138 8.138 7.788 0.350 19193 1546 1 5 . 1 1 28 28 LYS N N 28 119.278 119.278 119.307 -0.029 19193 1547 1 5 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.201 -0.141 19193 1548 1 5 . 1 1 28 28 LYS C C 28 174.753 174.753 177.066 -2.313 19193 1549 1 5 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.426 0.473 19193 1550 1 5 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.554 -0.331 19193 1551 1 5 . 1 1 28 28 LYS H H 28 7.077 7.077 7.528 -0.451 19193 1552 1 5 . 1 1 29 29 LYS N N 29 116.136 116.136 116.791 -0.655 19193 1553 1 5 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.404 -0.144 19193 1554 1 5 . 1 1 29 29 LYS C C 29 173.137 173.137 176.300 -3.163 19193 1555 1 5 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.446 -1.438 19193 1556 1 5 . 1 1 29 29 LYS CB C 29 33.689 33.689 34.123 -0.434 19193 1557 1 5 . 1 1 29 29 LYS H H 29 7.452 7.452 7.947 -0.494 19193 1558 1 5 . 1 1 30 30 ARG N N 30 116.823 116.823 116.484 0.339 19193 1559 1 5 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.488 -0.018 19193 1560 1 5 . 1 1 30 30 ARG C C 30 169.632 169.632 173.666 -4.034 19193 1561 1 5 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.443 -1.063 19193 1562 1 5 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.855 -0.783 19193 1563 1 5 . 1 1 30 30 ARG H H 30 8.079 8.079 7.491 0.588 19193 1564 1 5 . 1 1 31 31 ALA N N 31 121.111 121.111 122.955 -1.844 19193 1565 1 5 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.774 -0.314 19193 1566 1 5 . 1 1 31 31 ALA C C 31 175.120 175.120 176.742 -1.622 19193 1567 1 5 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.431 -0.434 19193 1568 1 5 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.753 -0.658 19193 1569 1 5 . 1 1 31 31 ALA H H 31 7.929 7.929 8.371 -0.442 19193 1570 1 5 . 1 1 32 32 ILE N N 32 123.829 123.829 120.150 3.679 19193 1571 1 5 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.443 -0.053 19193 1572 1 5 . 1 1 32 32 ILE C C 32 173.398 173.398 175.098 -1.700 19193 1573 1 5 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.792 0.238 19193 1574 1 5 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.527 -2.362 19193 1575 1 5 . 1 1 32 32 ILE H H 32 8.552 8.552 8.080 0.472 19193 1576 1 5 . 1 1 33 33 LYS N N 33 130.536 130.536 127.708 2.828 19193 1577 1 5 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.414 -0.394 19193 1578 1 5 . 1 1 33 33 LYS C C 33 174.009 174.009 175.751 -1.742 19193 1579 1 5 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.096 0.545 19193 1580 1 5 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.509 4.901 19193 1581 1 5 . 1 1 33 33 LYS H H 33 9.444 9.444 8.503 0.941 19193 1582 1 5 . 1 1 34 34 ASN N N 34 120.119 120.119 125.160 -5.041 19193 1583 1 5 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.928 -0.148 19193 1584 1 5 . 1 1 34 34 ASN C C 34 171.824 171.824 175.150 -3.326 19193 1585 1 5 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.376 -1.373 19193 1586 1 5 . 1 1 34 34 ASN CB C 34 38.288 38.288 39.906 -1.618 19193 1587 1 5 . 1 1 34 34 ASN H H 34 8.724 8.724 8.567 0.157 19193 1588 1 5 . 1 1 35 35 GLU N N 35 124.613 124.613 124.722 -0.109 19193 1589 1 5 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.107 0.183 19193 1590 1 5 . 1 1 35 35 GLU C C 35 174.770 174.770 177.529 -2.759 19193 1591 1 5 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.357 -0.050 19193 1592 1 5 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.687 -0.931 19193 1593 1 5 . 1 1 35 35 GLU H H 35 8.860 8.860 8.852 0.008 19193 1594 1 5 . 1 1 36 36 GLN N N 36 118.117 118.117 120.127 -2.010 19193 1595 1 5 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.224 0.556 19193 1596 1 5 . 1 1 36 36 GLN C C 36 176.083 176.083 178.490 -2.407 19193 1597 1 5 . 1 1 36 36 GLN CA C 36 59.141 59.141 59.102 0.038 19193 1598 1 5 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.424 -0.828 19193 1599 1 5 . 1 1 36 36 GLN H H 36 8.346 8.346 8.551 -0.205 19193 1600 1 5 . 1 1 37 37 LEU N N 37 119.945 119.945 119.762 0.183 19193 1601 1 5 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.068 0.032 19193 1602 1 5 . 1 1 37 37 LEU C C 37 175.096 175.096 179.249 -4.153 19193 1603 1 5 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.512 -0.125 19193 1604 1 5 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.166 0.037 19193 1605 1 5 . 1 1 37 37 LEU H H 37 7.469 7.469 8.297 -0.828 19193 1606 1 5 . 1 1 38 38 LEU N N 38 119.102 119.102 119.903 -0.801 19193 1607 1 5 . 1 1 38 38 LEU HA H 38 4.130 4.130 3.982 0.148 19193 1608 1 5 . 1 1 38 38 LEU C C 38 175.531 175.531 179.035 -3.504 19193 1609 1 5 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.355 -0.482 19193 1610 1 5 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.111 -0.246 19193 1611 1 5 . 1 1 38 38 LEU H H 38 7.110 7.110 7.846 -0.736 19193 1612 1 5 . 1 1 39 39 GLN N N 39 118.022 118.022 118.787 -0.765 19193 1613 1 5 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.096 -0.166 19193 1614 1 5 . 1 1 39 39 GLN C C 39 175.315 175.315 178.882 -3.567 19193 1615 1 5 . 1 1 39 39 GLN CA C 39 59.511 59.511 59.105 0.406 19193 1616 1 5 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.619 -0.725 19193 1617 1 5 . 1 1 39 39 GLN H H 39 8.579 8.579 7.680 0.899 19193 1618 1 5 . 1 1 40 40 LEU N N 40 120.372 120.372 121.051 -0.679 19193 1619 1 5 . 1 1 40 40 LEU HA H 40 3.940 3.940 3.995 -0.055 19193 1620 1 5 . 1 1 40 40 LEU C C 40 176.514 176.514 179.245 -2.731 19193 1621 1 5 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.123 -0.496 19193 1622 1 5 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.179 -0.131 19193 1623 1 5 . 1 1 40 40 LEU H H 40 7.890 7.890 8.225 -0.335 19193 1624 1 5 . 1 1 41 41 ILE N N 41 120.723 120.723 119.125 1.598 19193 1625 1 5 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.611 0.529 19193 1626 1 5 . 1 1 41 41 ILE C C 41 174.220 174.220 177.965 -3.745 19193 1627 1 5 . 1 1 41 41 ILE CA C 41 66.019 66.019 65.300 0.719 19193 1628 1 5 . 1 1 41 41 ILE CB C 41 38.279 38.279 37.829 0.450 19193 1629 1 5 . 1 1 41 41 ILE H H 41 8.106 8.106 8.510 -0.404 19193 1630 1 5 . 1 1 42 42 PHE N N 42 119.850 119.850 121.853 -2.003 19193 1631 1 5 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.040 0.740 19193 1632 1 5 . 1 1 42 42 PHE C C 42 173.670 173.670 177.013 -3.343 19193 1633 1 5 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.483 1.413 19193 1634 1 5 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.727 1.290 19193 1635 1 5 . 1 1 42 42 PHE H H 42 8.695 8.695 8.345 0.350 19193 1636 1 5 . 1 1 43 43 LYS N N 43 115.976 115.976 117.861 -1.885 19193 1637 1 5 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.632 0.388 19193 1638 1 5 . 1 1 43 43 LYS C C 43 175.313 175.313 177.762 -2.449 19193 1639 1 5 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.517 0.373 19193 1640 1 5 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.315 0.204 19193 1641 1 5 . 1 1 43 43 LYS H H 43 8.405 8.405 7.673 0.732 19193 1642 1 5 . 1 1 44 44 SER N N 44 112.481 112.481 113.888 -1.407 19193 1643 1 5 . 1 1 44 44 SER HA H 44 4.100 4.100 4.100 0.000 19193 1644 1 5 . 1 1 44 44 SER C C 44 172.469 172.469 175.943 -3.474 19193 1645 1 5 . 1 1 44 44 SER CA C 44 61.017 61.017 60.884 0.133 19193 1646 1 5 . 1 1 44 44 SER CB C 44 63.450 63.450 63.661 -0.211 19193 1647 1 5 . 1 1 44 44 SER H H 44 7.492 7.492 7.664 -0.172 19193 1648 1 5 . 1 1 45 45 ILE N N 45 120.793 120.793 118.148 2.645 19193 1649 1 5 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.360 1.200 19193 1650 1 5 . 1 1 45 45 ILE C C 45 174.535 174.535 175.592 -1.057 19193 1651 1 5 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.179 -0.404 19193 1652 1 5 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.137 -0.158 19193 1653 1 5 . 1 1 45 45 ILE H H 45 7.407 7.407 7.711 -0.304 19193 1654 1 5 . 1 1 46 46 ASP N N 46 118.226 118.226 119.263 -1.037 19193 1655 1 5 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.432 -0.032 19193 1656 1 5 . 1 1 46 46 ASP C C 46 173.226 173.226 175.716 -2.490 19193 1657 1 5 . 1 1 46 46 ASP CA C 46 52.245 52.245 53.591 -1.346 19193 1658 1 5 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.413 -3.381 19193 1659 1 5 . 1 1 46 46 ASP H H 46 7.343 7.343 7.367 -0.024 19193 1660 1 5 . 1 1 47 47 ALA N N 47 130.084 130.084 127.625 2.459 19193 1661 1 5 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.970 0.420 19193 1662 1 5 . 1 1 47 47 ALA C C 47 176.299 176.299 177.703 -1.404 19193 1663 1 5 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.200 0.366 19193 1664 1 5 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.242 -0.022 19193 1665 1 5 . 1 1 47 47 ALA H H 47 7.742 7.742 8.389 -0.647 19193 1666 1 5 . 1 1 48 48 ASP N N 48 113.283 113.283 113.221 0.062 19193 1667 1 5 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.579 0.021 19193 1668 1 5 . 1 1 48 48 ASP C C 48 175.111 175.111 177.178 -2.067 19193 1669 1 5 . 1 1 48 48 ASP CA C 48 52.510 52.510 52.825 -0.315 19193 1670 1 5 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.836 -2.397 19193 1671 1 5 . 1 1 48 48 ASP H H 48 8.038 8.038 7.718 0.320 19193 1672 1 5 . 1 1 49 49 GLY C C 49 172.256 172.256 174.683 -2.427 19193 1673 1 5 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.702 1.032 19193 1674 1 5 . 1 1 49 49 GLY H H 49 7.775 7.775 7.848 -0.073 19193 1675 1 5 . 1 1 50 50 ASN N N 50 119.017 119.017 118.761 0.256 19193 1676 1 5 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.614 0.016 19193 1677 1 5 . 1 1 50 50 ASN C C 50 173.670 173.670 176.650 -2.980 19193 1678 1 5 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.085 1.291 19193 1679 1 5 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.789 0.623 19193 1680 1 5 . 1 1 50 50 ASN H H 50 8.155 8.155 7.927 0.228 19193 1681 1 5 . 1 1 51 51 GLY C C 51 169.963 169.963 173.617 -3.654 19193 1682 1 5 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.228 -1.991 19193 1683 1 5 . 1 1 51 51 GLY H H 51 10.668 10.668 8.671 1.997 19193 1684 1 5 . 1 1 52 52 GLU N N 52 116.254 116.254 118.904 -2.650 19193 1685 1 5 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.036 -0.076 19193 1686 1 5 . 1 1 52 52 GLU C C 52 171.378 171.378 175.254 -3.876 19193 1687 1 5 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.209 -0.902 19193 1688 1 5 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.304 0.777 19193 1689 1 5 . 1 1 52 52 GLU H H 52 7.579 7.579 8.279 -0.700 19193 1690 1 5 . 1 1 53 53 ILE N N 53 126.770 126.770 121.936 4.834 19193 1691 1 5 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.934 0.046 19193 1692 1 5 . 1 1 53 53 ILE C C 53 172.922 172.922 176.440 -3.518 19193 1693 1 5 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.105 -1.459 19193 1694 1 5 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.584 -0.567 19193 1695 1 5 . 1 1 53 53 ILE H H 53 9.661 9.661 9.053 0.608 19193 1696 1 5 . 1 1 54 54 ASP N N 54 128.225 128.225 127.384 0.841 19193 1697 1 5 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.157 -0.247 19193 1698 1 5 . 1 1 54 54 ASP C C 54 173.562 173.562 178.071 -4.509 19193 1699 1 5 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.398 -1.506 19193 1700 1 5 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.605 0.295 19193 1701 1 5 . 1 1 54 54 ASP H H 54 8.771 8.771 9.261 -0.490 19193 1702 1 5 . 1 1 55 55 GLN N N 55 116.090 116.090 120.708 -4.618 19193 1703 1 5 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.995 0.345 19193 1704 1 5 . 1 1 55 55 GLN C C 55 175.643 175.643 177.490 -1.847 19193 1705 1 5 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.601 0.044 19193 1706 1 5 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.255 -0.358 19193 1707 1 5 . 1 1 55 55 GLN H H 55 8.563 8.563 8.590 -0.027 19193 1708 1 5 . 1 1 56 56 ASN N N 56 119.830 119.830 119.676 0.154 19193 1709 1 5 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.291 0.479 19193 1710 1 5 . 1 1 56 56 ASN C C 56 178.242 178.242 177.510 0.732 19193 1711 1 5 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.592 -0.705 19193 1712 1 5 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.868 0.395 19193 1713 1 5 . 1 1 56 56 ASN H H 56 8.205 8.205 8.631 -0.426 19193 1714 1 5 . 1 1 57 57 GLU N N 57 123.242 123.242 120.189 3.053 19193 1715 1 5 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.995 0.015 19193 1716 1 5 . 1 1 57 57 GLU C C 57 177.498 177.498 179.172 -1.674 19193 1717 1 5 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.366 -0.726 19193 1718 1 5 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.357 0.267 19193 1719 1 5 . 1 1 57 57 GLU H H 57 9.079 9.079 8.086 0.993 19193 1720 1 5 . 1 1 58 58 PHE N N 58 119.057 119.057 120.703 -1.646 19193 1721 1 5 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.369 -0.339 19193 1722 1 5 . 1 1 58 58 PHE C C 58 173.784 173.784 177.323 -3.539 19193 1723 1 5 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.342 0.402 19193 1724 1 5 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.961 0.620 19193 1725 1 5 . 1 1 58 58 PHE H H 58 8.795 8.795 8.384 0.411 19193 1726 1 5 . 1 1 59 59 ALA N N 59 120.919 120.919 122.143 -1.224 19193 1727 1 5 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.119 -0.159 19193 1728 1 5 . 1 1 59 59 ALA C C 59 177.602 177.602 179.456 -1.854 19193 1729 1 5 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.081 -0.153 19193 1730 1 5 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.376 -0.585 19193 1731 1 5 . 1 1 59 59 ALA H H 59 8.158 8.158 8.354 -0.196 19193 1732 1 5 . 1 1 60 60 LYS N N 60 116.767 116.767 116.470 0.297 19193 1733 1 5 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.138 -0.088 19193 1734 1 5 . 1 1 60 60 LYS C C 60 175.309 175.309 178.282 -2.973 19193 1735 1 5 . 1 1 60 60 LYS CA C 60 58.274 58.274 57.674 0.600 19193 1736 1 5 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.581 -0.360 19193 1737 1 5 . 1 1 60 60 LYS H H 60 7.554 7.554 7.895 -0.341 19193 1738 1 5 . 1 1 61 61 PHE N N 61 118.086 118.086 120.473 -2.387 19193 1739 1 5 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.293 0.197 19193 1740 1 5 . 1 1 61 61 PHE C C 61 173.559 173.559 175.125 -1.566 19193 1741 1 5 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.369 1.152 19193 1742 1 5 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.637 0.402 19193 1743 1 5 . 1 1 61 61 PHE H H 61 7.231 7.231 7.755 -0.524 19193 1744 1 5 . 1 1 62 62 TYR N N 62 120.802 120.802 122.755 -1.953 19193 1745 1 5 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.706 0.764 19193 1746 1 5 . 1 1 62 62 TYR C C 62 173.559 173.559 176.032 -2.473 19193 1747 1 5 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.862 1.026 19193 1748 1 5 . 1 1 62 62 TYR CB C 62 38.274 38.274 38.251 0.023 19193 1749 1 5 . 1 1 62 62 TYR H H 62 8.301 8.301 7.940 0.361 19193 1750 1 5 . 1 1 63 63 GLY N N 63 132.741 132.741 115.461 17.280 19193 1751 1 5 . 1 1 63 63 GLY C C 63 172.799 172.799 174.988 -2.189 19193 1752 1 5 . 1 1 63 63 GLY CA C 63 46.252 46.252 45.126 1.126 19193 1753 1 5 . 1 1 63 63 GLY H H 63 8.293 8.293 7.905 0.388 19193 1754 1 5 . 1 1 64 64 SER N N 64 115.064 115.064 115.383 -0.319 19193 1755 1 5 . 1 1 64 64 SER HA H 64 4.780 4.780 4.501 0.279 19193 1756 1 5 . 1 1 64 64 SER C C 64 170.939 170.939 175.391 -4.452 19193 1757 1 5 . 1 1 64 64 SER CA C 64 60.525 60.525 57.633 2.892 19193 1758 1 5 . 1 1 64 64 SER CB C 64 63.430 63.430 63.443 -0.013 19193 1759 1 5 . 1 1 64 64 SER H H 64 7.833 7.833 7.728 0.105 19193 1760 1 5 . 1 1 65 65 ILE N N 65 112.928 112.928 121.821 -8.893 19193 1761 1 5 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.192 0.068 19193 1762 1 5 . 1 1 65 65 ILE C C 65 175.695 175.695 176.125 -0.430 19193 1763 1 5 . 1 1 65 65 ILE CA C 65 59.752 59.752 60.959 -1.207 19193 1764 1 5 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.657 2.065 19193 1765 1 5 . 1 1 65 65 ILE H H 65 6.935 6.935 7.594 -0.659 19193 1766 1 6 . 1 1 5 5 LEU N N 5 120.669 120.669 117.025 3.644 19193 1767 1 6 . 1 1 5 5 LEU HA H 5 4.210 4.210 3.958 0.252 19193 1768 1 6 . 1 1 5 5 LEU CA C 5 58.825 58.825 56.965 1.860 19193 1769 1 6 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.521 0.744 19193 1770 1 6 . 1 1 5 5 LEU H H 5 7.998 7.998 7.621 0.377 19193 1771 1 6 . 1 1 6 6 PHE N N 6 117.996 117.996 119.791 -1.795 19193 1772 1 6 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.667 0.193 19193 1773 1 6 . 1 1 6 6 PHE C C 6 175.520 175.520 176.518 -0.998 19193 1774 1 6 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.067 2.147 19193 1775 1 6 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.555 0.463 19193 1776 1 6 . 1 1 6 6 PHE H H 6 7.276 7.276 8.013 -0.737 19193 1777 1 6 . 1 1 7 7 LYS N N 7 114.616 114.616 118.989 -4.373 19193 1778 1 6 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.766 0.195 19193 1779 1 6 . 1 1 7 7 LYS C C 7 175.105 175.105 177.888 -2.783 19193 1780 1 6 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.891 -0.121 19193 1781 1 6 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.188 0.049 19193 1782 1 6 . 1 1 7 7 LYS H H 7 7.523 7.523 7.513 0.010 19193 1783 1 6 . 1 1 8 8 GLU N N 8 117.996 117.996 119.332 -1.336 19193 1784 1 6 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.030 -0.170 19193 1785 1 6 . 1 1 8 8 GLU C C 8 174.994 174.994 178.319 -3.325 19193 1786 1 6 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.696 -0.437 19193 1787 1 6 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.937 -0.634 19193 1788 1 6 . 1 1 8 8 GLU H H 8 7.276 7.276 7.673 -0.397 19193 1789 1 6 . 1 1 9 9 ILE N N 9 117.880 117.880 116.010 1.870 19193 1790 1 6 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.727 -0.285 19193 1791 1 6 . 1 1 9 9 ILE C C 9 177.620 177.620 176.627 0.993 19193 1792 1 6 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.129 1.282 19193 1793 1 6 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.924 0.787 19193 1794 1 6 . 1 1 9 9 ILE H H 9 7.166 7.166 7.422 -0.256 19193 1795 1 6 . 1 1 10 10 ASP N N 10 119.154 119.154 121.714 -2.560 19193 1796 1 6 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.500 -0.648 19193 1797 1 6 . 1 1 10 10 ASP C C 10 174.446 174.446 177.412 -2.966 19193 1798 1 6 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.396 -1.009 19193 1799 1 6 . 1 1 10 10 ASP CB C 10 38.297 38.297 38.776 -0.479 19193 1800 1 6 . 1 1 10 10 ASP H H 10 7.629 7.629 7.388 0.240 19193 1801 1 6 . 1 1 11 11 VAL N N 11 124.080 124.080 122.335 1.745 19193 1802 1 6 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.698 0.112 19193 1803 1 6 . 1 1 11 11 VAL C C 11 174.883 174.883 176.456 -1.573 19193 1804 1 6 . 1 1 11 11 VAL CA C 11 64.888 64.888 65.094 -0.206 19193 1805 1 6 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.202 0.718 19193 1806 1 6 . 1 1 11 11 VAL H H 11 7.956 7.956 7.766 0.190 19193 1807 1 6 . 1 1 12 12 ASN N N 12 114.490 114.490 116.118 -1.628 19193 1808 1 6 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.621 0.139 19193 1809 1 6 . 1 1 12 12 ASN C C 12 173.671 173.671 176.537 -2.866 19193 1810 1 6 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.478 -0.860 19193 1811 1 6 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.136 -0.564 19193 1812 1 6 . 1 1 12 12 ASN H H 12 7.630 7.630 7.685 -0.055 19193 1813 1 6 . 1 1 13 13 GLY N N 13 109.255 109.255 108.764 0.491 19193 1814 1 6 . 1 1 13 13 GLY C C 13 172.031 172.031 174.823 -2.792 19193 1815 1 6 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.578 0.421 19193 1816 1 6 . 1 1 13 13 GLY H H 13 7.643 7.643 8.059 -0.416 19193 1817 1 6 . 1 1 14 14 ASP N N 14 118.441 118.441 119.025 -0.584 19193 1818 1 6 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.626 -0.096 19193 1819 1 6 . 1 1 14 14 ASP C C 14 174.877 174.877 177.538 -2.661 19193 1820 1 6 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.136 -0.263 19193 1821 1 6 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.284 -1.255 19193 1822 1 6 . 1 1 14 14 ASP H H 14 7.956 7.956 7.778 0.178 19193 1823 1 6 . 1 1 15 15 GLY N N 15 118.441 118.441 107.493 10.948 19193 1824 1 6 . 1 1 15 15 GLY C C 15 169.627 169.627 173.199 -3.572 19193 1825 1 6 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.715 0.158 19193 1826 1 6 . 1 1 15 15 GLY H H 15 10.286 10.286 8.730 1.556 19193 1827 1 6 . 1 1 16 16 ALA N N 16 122.512 122.512 121.390 1.122 19193 1828 1 6 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.625 -0.695 19193 1829 1 6 . 1 1 16 16 ALA C C 16 172.696 172.696 175.970 -3.274 19193 1830 1 6 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.934 -1.055 19193 1831 1 6 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.552 -0.414 19193 1832 1 6 . 1 1 16 16 ALA H H 16 7.883 7.883 7.995 -0.112 19193 1833 1 6 . 1 1 17 17 VAL N N 17 124.615 124.615 124.298 0.317 19193 1834 1 6 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.617 0.323 19193 1835 1 6 . 1 1 17 17 VAL C C 17 172.461 172.461 175.681 -3.220 19193 1836 1 6 . 1 1 17 17 VAL CA C 17 60.441 60.441 60.156 0.285 19193 1837 1 6 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.235 -1.699 19193 1838 1 6 . 1 1 17 17 VAL H H 17 9.373 9.373 9.011 0.362 19193 1839 1 6 . 1 1 18 18 SER N N 18 125.090 125.090 124.188 0.902 19193 1840 1 6 . 1 1 18 18 SER HA H 18 4.970 4.970 5.147 -0.177 19193 1841 1 6 . 1 1 18 18 SER C C 18 172.145 172.145 176.008 -3.863 19193 1842 1 6 . 1 1 18 18 SER CA C 18 55.641 55.641 57.566 -1.925 19193 1843 1 6 . 1 1 18 18 SER CB C 18 66.313 66.313 64.507 1.806 19193 1844 1 6 . 1 1 18 18 SER H H 18 8.885 8.885 8.231 0.654 19193 1845 1 6 . 1 1 19 19 TYR N N 19 123.319 123.319 119.982 3.337 19193 1846 1 6 . 1 1 19 19 TYR HA H 19 4.960 4.960 3.923 1.037 19193 1847 1 6 . 1 1 19 19 TYR C C 19 174.218 174.218 177.445 -3.227 19193 1848 1 6 . 1 1 19 19 TYR CA C 19 62.398 62.398 61.158 1.240 19193 1849 1 6 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.574 0.285 19193 1850 1 6 . 1 1 19 19 TYR H H 19 9.180 9.180 7.902 1.278 19193 1851 1 6 . 1 1 20 20 GLU N N 20 117.323 117.323 119.823 -2.500 19193 1852 1 6 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.774 1.006 19193 1853 1 6 . 1 1 20 20 GLU C C 20 177.285 177.285 178.865 -1.580 19193 1854 1 6 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.769 0.001 19193 1855 1 6 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.337 0.128 19193 1856 1 6 . 1 1 20 20 GLU H H 20 8.520 8.520 7.367 1.153 19193 1857 1 6 . 1 1 21 21 GLU N N 21 120.067 120.067 118.779 1.288 19193 1858 1 6 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.922 0.858 19193 1859 1 6 . 1 1 21 21 GLU C C 21 177.617 177.617 178.904 -1.287 19193 1860 1 6 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.409 -0.508 19193 1861 1 6 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.205 -1.307 19193 1862 1 6 . 1 1 21 21 GLU H H 21 7.738 7.738 8.170 -0.432 19193 1863 1 6 . 1 1 22 22 VAL N N 22 122.931 122.931 120.831 2.100 19193 1864 1 6 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.760 -0.260 19193 1865 1 6 . 1 1 22 22 VAL C C 22 173.899 173.899 177.736 -3.837 19193 1866 1 6 . 1 1 22 22 VAL CA C 22 67.530 67.530 67.138 0.392 19193 1867 1 6 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.756 -0.975 19193 1868 1 6 . 1 1 22 22 VAL H H 22 8.110 8.110 8.234 -0.124 19193 1869 1 6 . 1 1 23 23 LYS N N 23 120.609 120.609 119.071 1.538 19193 1870 1 6 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.917 -0.417 19193 1871 1 6 . 1 1 23 23 LYS C C 23 175.965 175.965 179.114 -3.149 19193 1872 1 6 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.902 0.253 19193 1873 1 6 . 1 1 23 23 LYS CB C 23 31.640 31.640 32.379 -0.739 19193 1874 1 6 . 1 1 23 23 LYS H H 23 8.613 8.613 7.878 0.735 19193 1875 1 6 . 1 1 24 24 ALA N N 24 121.619 121.619 122.298 -0.679 19193 1876 1 6 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.063 -0.043 19193 1877 1 6 . 1 1 24 24 ALA C C 24 176.843 176.843 178.916 -2.073 19193 1878 1 6 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.104 -0.349 19193 1879 1 6 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.383 -0.299 19193 1880 1 6 . 1 1 24 24 ALA H H 24 8.038 8.038 8.061 -0.023 19193 1881 1 6 . 1 1 25 25 PHE N N 25 118.380 118.380 119.698 -1.318 19193 1882 1 6 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.180 0.040 19193 1883 1 6 . 1 1 25 25 PHE C C 25 174.657 174.657 178.182 -3.525 19193 1884 1 6 . 1 1 25 25 PHE CA C 25 61.143 61.143 59.526 1.617 19193 1885 1 6 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.684 0.882 19193 1886 1 6 . 1 1 25 25 PHE H H 25 7.668 7.668 8.110 -0.442 19193 1887 1 6 . 1 1 26 26 VAL N N 26 117.975 117.975 119.099 -1.124 19193 1888 1 6 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.563 -0.383 19193 1889 1 6 . 1 1 26 26 VAL C C 26 175.212 175.212 177.922 -2.710 19193 1890 1 6 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.401 1.138 19193 1891 1 6 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.866 -0.460 19193 1892 1 6 . 1 1 26 26 VAL H H 26 8.667 8.667 7.878 0.789 19193 1893 1 6 . 1 1 27 27 SER N N 27 112.988 112.988 115.134 -2.146 19193 1894 1 6 . 1 1 27 27 SER HA H 27 4.900 4.900 4.382 0.518 19193 1895 1 6 . 1 1 27 27 SER C C 27 172.256 172.256 174.853 -2.597 19193 1896 1 6 . 1 1 27 27 SER CA C 27 60.403 60.403 60.495 -0.092 19193 1897 1 6 . 1 1 27 27 SER CB C 27 63.131 63.131 63.181 -0.050 19193 1898 1 6 . 1 1 27 27 SER H H 27 8.138 8.138 7.637 0.501 19193 1899 1 6 . 1 1 28 28 LYS N N 28 119.278 119.278 118.038 1.240 19193 1900 1 6 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.230 -0.170 19193 1901 1 6 . 1 1 28 28 LYS C C 28 174.753 174.753 177.328 -2.575 19193 1902 1 6 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.455 0.445 19193 1903 1 6 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.349 -0.126 19193 1904 1 6 . 1 1 28 28 LYS H H 28 7.077 7.077 7.393 -0.316 19193 1905 1 6 . 1 1 29 29 LYS N N 29 116.136 116.136 116.947 -0.811 19193 1906 1 6 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.430 -0.170 19193 1907 1 6 . 1 1 29 29 LYS C C 29 173.137 173.137 176.361 -3.224 19193 1908 1 6 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.641 -1.633 19193 1909 1 6 . 1 1 29 29 LYS CB C 29 33.689 33.689 33.997 -0.308 19193 1910 1 6 . 1 1 29 29 LYS H H 29 7.452 7.452 8.043 -0.591 19193 1911 1 6 . 1 1 30 30 ARG N N 30 116.823 116.823 116.068 0.755 19193 1912 1 6 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.440 0.030 19193 1913 1 6 . 1 1 30 30 ARG C C 30 169.632 169.632 173.382 -3.750 19193 1914 1 6 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.299 -0.919 19193 1915 1 6 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.464 -0.392 19193 1916 1 6 . 1 1 30 30 ARG H H 30 8.079 8.079 7.506 0.573 19193 1917 1 6 . 1 1 31 31 ALA N N 31 121.111 121.111 122.958 -1.847 19193 1918 1 6 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.773 -0.313 19193 1919 1 6 . 1 1 31 31 ALA C C 31 175.120 175.120 176.740 -1.620 19193 1920 1 6 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.464 -0.467 19193 1921 1 6 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.697 -0.602 19193 1922 1 6 . 1 1 31 31 ALA H H 31 7.929 7.929 8.360 -0.431 19193 1923 1 6 . 1 1 32 32 ILE N N 32 123.829 123.829 120.573 3.256 19193 1924 1 6 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.466 -0.076 19193 1925 1 6 . 1 1 32 32 ILE C C 32 173.398 173.398 174.825 -1.427 19193 1926 1 6 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.782 0.249 19193 1927 1 6 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.531 -2.366 19193 1928 1 6 . 1 1 32 32 ILE H H 32 8.552 8.552 8.061 0.491 19193 1929 1 6 . 1 1 33 33 LYS N N 33 130.536 130.536 127.668 2.868 19193 1930 1 6 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.394 -0.374 19193 1931 1 6 . 1 1 33 33 LYS C C 33 174.009 174.009 175.875 -1.866 19193 1932 1 6 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.217 0.424 19193 1933 1 6 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.461 4.949 19193 1934 1 6 . 1 1 33 33 LYS H H 33 9.444 9.444 8.476 0.968 19193 1935 1 6 . 1 1 34 34 ASN N N 34 120.119 120.119 125.511 -5.392 19193 1936 1 6 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.969 -0.189 19193 1937 1 6 . 1 1 34 34 ASN C C 34 171.824 171.824 175.108 -3.284 19193 1938 1 6 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.631 -1.628 19193 1939 1 6 . 1 1 34 34 ASN CB C 34 38.288 38.288 40.529 -2.241 19193 1940 1 6 . 1 1 34 34 ASN H H 34 8.724 8.724 8.550 0.174 19193 1941 1 6 . 1 1 35 35 GLU N N 35 124.613 124.613 124.028 0.585 19193 1942 1 6 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.099 0.191 19193 1943 1 6 . 1 1 35 35 GLU C C 35 174.770 174.770 177.668 -2.898 19193 1944 1 6 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.582 -0.275 19193 1945 1 6 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.311 -0.555 19193 1946 1 6 . 1 1 35 35 GLU H H 35 8.860 8.860 8.921 -0.061 19193 1947 1 6 . 1 1 36 36 GLN N N 36 118.117 118.117 120.640 -2.523 19193 1948 1 6 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.201 0.579 19193 1949 1 6 . 1 1 36 36 GLN C C 36 176.083 176.083 178.213 -2.130 19193 1950 1 6 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.755 0.386 19193 1951 1 6 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.437 -0.841 19193 1952 1 6 . 1 1 36 36 GLN H H 36 8.346 8.346 8.613 -0.267 19193 1953 1 6 . 1 1 37 37 LEU N N 37 119.945 119.945 119.790 0.155 19193 1954 1 6 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.067 0.033 19193 1955 1 6 . 1 1 37 37 LEU C C 37 175.096 175.096 179.272 -4.176 19193 1956 1 6 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.541 -0.154 19193 1957 1 6 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.157 0.046 19193 1958 1 6 . 1 1 37 37 LEU H H 37 7.469 7.469 8.304 -0.835 19193 1959 1 6 . 1 1 38 38 LEU N N 38 119.102 119.102 119.952 -0.850 19193 1960 1 6 . 1 1 38 38 LEU HA H 38 4.130 4.130 4.001 0.129 19193 1961 1 6 . 1 1 38 38 LEU C C 38 175.531 175.531 179.008 -3.477 19193 1962 1 6 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.328 -0.455 19193 1963 1 6 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.100 -0.235 19193 1964 1 6 . 1 1 38 38 LEU H H 38 7.110 7.110 7.870 -0.760 19193 1965 1 6 . 1 1 39 39 GLN N N 39 118.022 118.022 118.902 -0.880 19193 1966 1 6 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.128 -0.198 19193 1967 1 6 . 1 1 39 39 GLN C C 39 175.315 175.315 178.790 -3.475 19193 1968 1 6 . 1 1 39 39 GLN CA C 39 59.511 59.511 59.450 0.061 19193 1969 1 6 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.825 -0.931 19193 1970 1 6 . 1 1 39 39 GLN H H 39 8.579 8.579 7.672 0.907 19193 1971 1 6 . 1 1 40 40 LEU N N 40 120.372 120.372 120.945 -0.573 19193 1972 1 6 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.009 -0.069 19193 1973 1 6 . 1 1 40 40 LEU C C 40 176.514 176.514 179.154 -2.640 19193 1974 1 6 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.156 -0.528 19193 1975 1 6 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.225 -0.177 19193 1976 1 6 . 1 1 40 40 LEU H H 40 7.890 7.890 8.403 -0.513 19193 1977 1 6 . 1 1 41 41 ILE N N 41 120.723 120.723 118.838 1.885 19193 1978 1 6 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.743 0.397 19193 1979 1 6 . 1 1 41 41 ILE C C 41 174.220 174.220 178.377 -4.157 19193 1980 1 6 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.024 1.995 19193 1981 1 6 . 1 1 41 41 ILE CB C 41 38.279 38.279 36.622 1.657 19193 1982 1 6 . 1 1 41 41 ILE H H 41 8.106 8.106 8.564 -0.458 19193 1983 1 6 . 1 1 42 42 PHE N N 42 119.850 119.850 122.476 -2.626 19193 1984 1 6 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.093 0.687 19193 1985 1 6 . 1 1 42 42 PHE C C 42 173.670 173.670 177.131 -3.461 19193 1986 1 6 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.531 1.365 19193 1987 1 6 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.667 1.351 19193 1988 1 6 . 1 1 42 42 PHE H H 42 8.695 8.695 8.417 0.278 19193 1989 1 6 . 1 1 43 43 LYS N N 43 115.976 115.976 117.890 -1.914 19193 1990 1 6 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.631 0.389 19193 1991 1 6 . 1 1 43 43 LYS C C 43 175.313 175.313 177.850 -2.537 19193 1992 1 6 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.526 0.364 19193 1993 1 6 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.275 0.244 19193 1994 1 6 . 1 1 43 43 LYS H H 43 8.405 8.405 7.691 0.714 19193 1995 1 6 . 1 1 44 44 SER N N 44 112.481 112.481 113.805 -1.324 19193 1996 1 6 . 1 1 44 44 SER HA H 44 4.100 4.100 4.127 -0.027 19193 1997 1 6 . 1 1 44 44 SER C C 44 172.469 172.469 176.023 -3.554 19193 1998 1 6 . 1 1 44 44 SER CA C 44 61.017 61.017 61.152 -0.135 19193 1999 1 6 . 1 1 44 44 SER CB C 44 63.450 63.450 63.737 -0.287 19193 2000 1 6 . 1 1 44 44 SER H H 44 7.492 7.492 7.696 -0.204 19193 2001 1 6 . 1 1 45 45 ILE N N 45 120.793 120.793 117.949 2.844 19193 2002 1 6 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.588 0.972 19193 2003 1 6 . 1 1 45 45 ILE C C 45 174.535 174.535 175.705 -1.170 19193 2004 1 6 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.294 -0.519 19193 2005 1 6 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.216 -0.237 19193 2006 1 6 . 1 1 45 45 ILE H H 45 7.407 7.407 7.782 -0.375 19193 2007 1 6 . 1 1 46 46 ASP N N 46 118.226 118.226 118.920 -0.694 19193 2008 1 6 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.510 -0.110 19193 2009 1 6 . 1 1 46 46 ASP C C 46 173.226 173.226 175.830 -2.604 19193 2010 1 6 . 1 1 46 46 ASP CA C 46 52.245 52.245 53.716 -1.471 19193 2011 1 6 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.392 -3.361 19193 2012 1 6 . 1 1 46 46 ASP H H 46 7.343 7.343 7.417 -0.074 19193 2013 1 6 . 1 1 47 47 ALA N N 47 130.084 130.084 128.556 1.528 19193 2014 1 6 . 1 1 47 47 ALA HA H 47 4.390 4.390 4.015 0.375 19193 2015 1 6 . 1 1 47 47 ALA C C 47 176.299 176.299 177.830 -1.531 19193 2016 1 6 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.220 0.346 19193 2017 1 6 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.332 -0.112 19193 2018 1 6 . 1 1 47 47 ALA H H 47 7.742 7.742 8.417 -0.675 19193 2019 1 6 . 1 1 48 48 ASP N N 48 113.283 113.283 113.440 -0.157 19193 2020 1 6 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.600 -0.000 19193 2021 1 6 . 1 1 48 48 ASP C C 48 175.111 175.111 177.139 -2.028 19193 2022 1 6 . 1 1 48 48 ASP CA C 48 52.510 52.510 52.882 -0.372 19193 2023 1 6 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.878 -2.439 19193 2024 1 6 . 1 1 48 48 ASP H H 48 8.038 8.038 7.758 0.280 19193 2025 1 6 . 1 1 49 49 GLY C C 49 172.256 172.256 174.690 -2.434 19193 2026 1 6 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.732 1.002 19193 2027 1 6 . 1 1 49 49 GLY H H 49 7.775 7.775 7.921 -0.146 19193 2028 1 6 . 1 1 50 50 ASN N N 50 119.017 119.017 118.731 0.286 19193 2029 1 6 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.640 -0.010 19193 2030 1 6 . 1 1 50 50 ASN C C 50 173.670 173.670 176.658 -2.988 19193 2031 1 6 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.014 1.362 19193 2032 1 6 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.794 0.618 19193 2033 1 6 . 1 1 50 50 ASN H H 50 8.155 8.155 7.955 0.200 19193 2034 1 6 . 1 1 51 51 GLY C C 51 169.963 169.963 173.667 -3.704 19193 2035 1 6 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.252 -2.015 19193 2036 1 6 . 1 1 51 51 GLY H H 51 10.668 10.668 8.674 1.994 19193 2037 1 6 . 1 1 52 52 GLU N N 52 116.254 116.254 118.998 -2.744 19193 2038 1 6 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.107 -0.147 19193 2039 1 6 . 1 1 52 52 GLU C C 52 171.378 171.378 175.315 -3.937 19193 2040 1 6 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.271 -0.964 19193 2041 1 6 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.355 0.726 19193 2042 1 6 . 1 1 52 52 GLU H H 52 7.579 7.579 8.319 -0.740 19193 2043 1 6 . 1 1 53 53 ILE N N 53 126.770 126.770 121.994 4.776 19193 2044 1 6 . 1 1 53 53 ILE HA H 53 4.980 4.980 5.006 -0.026 19193 2045 1 6 . 1 1 53 53 ILE C C 53 172.922 172.922 176.507 -3.585 19193 2046 1 6 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.161 -1.515 19193 2047 1 6 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.744 -0.727 19193 2048 1 6 . 1 1 53 53 ILE H H 53 9.661 9.661 9.156 0.505 19193 2049 1 6 . 1 1 54 54 ASP N N 54 128.225 128.225 127.251 0.974 19193 2050 1 6 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.271 -0.361 19193 2051 1 6 . 1 1 54 54 ASP C C 54 173.562 173.562 178.051 -4.489 19193 2052 1 6 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.495 -1.603 19193 2053 1 6 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.603 0.297 19193 2054 1 6 . 1 1 54 54 ASP H H 54 8.771 8.771 9.278 -0.507 19193 2055 1 6 . 1 1 55 55 GLN N N 55 116.090 116.090 121.531 -5.441 19193 2056 1 6 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.972 0.368 19193 2057 1 6 . 1 1 55 55 GLN C C 55 175.643 175.643 177.705 -2.062 19193 2058 1 6 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.871 -0.226 19193 2059 1 6 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.231 -0.334 19193 2060 1 6 . 1 1 55 55 GLN H H 55 8.563 8.563 8.605 -0.042 19193 2061 1 6 . 1 1 56 56 ASN N N 56 119.830 119.830 119.395 0.435 19193 2062 1 6 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.344 0.426 19193 2063 1 6 . 1 1 56 56 ASN C C 56 178.242 178.242 177.735 0.507 19193 2064 1 6 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.643 -0.756 19193 2065 1 6 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.624 0.639 19193 2066 1 6 . 1 1 56 56 ASN H H 56 8.205 8.205 8.731 -0.526 19193 2067 1 6 . 1 1 57 57 GLU N N 57 123.242 123.242 120.245 2.997 19193 2068 1 6 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.980 0.030 19193 2069 1 6 . 1 1 57 57 GLU C C 57 177.498 177.498 179.065 -1.567 19193 2070 1 6 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.397 -0.757 19193 2071 1 6 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.477 0.147 19193 2072 1 6 . 1 1 57 57 GLU H H 57 9.079 9.079 8.058 1.021 19193 2073 1 6 . 1 1 58 58 PHE N N 58 119.057 119.057 120.728 -1.671 19193 2074 1 6 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.361 -0.331 19193 2075 1 6 . 1 1 58 58 PHE C C 58 173.784 173.784 177.306 -3.522 19193 2076 1 6 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.404 0.340 19193 2077 1 6 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.985 0.596 19193 2078 1 6 . 1 1 58 58 PHE H H 58 8.795 8.795 8.403 0.392 19193 2079 1 6 . 1 1 59 59 ALA N N 59 120.919 120.919 122.690 -1.771 19193 2080 1 6 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.034 -0.074 19193 2081 1 6 . 1 1 59 59 ALA C C 59 177.602 177.602 178.848 -1.246 19193 2082 1 6 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.040 -0.112 19193 2083 1 6 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.348 -0.557 19193 2084 1 6 . 1 1 59 59 ALA H H 59 8.158 8.158 8.243 -0.085 19193 2085 1 6 . 1 1 60 60 LYS N N 60 116.767 116.767 116.515 0.252 19193 2086 1 6 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.139 -0.089 19193 2087 1 6 . 1 1 60 60 LYS C C 60 175.309 175.309 177.649 -2.340 19193 2088 1 6 . 1 1 60 60 LYS CA C 60 58.274 58.274 58.050 0.223 19193 2089 1 6 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.270 -0.049 19193 2090 1 6 . 1 1 60 60 LYS H H 60 7.554 7.554 7.889 -0.335 19193 2091 1 6 . 1 1 61 61 PHE N N 61 118.086 118.086 118.086 0.000 19193 2092 1 6 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.265 0.225 19193 2093 1 6 . 1 1 61 61 PHE C C 61 173.559 173.559 175.593 -2.034 19193 2094 1 6 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.377 1.144 19193 2095 1 6 . 1 1 61 61 PHE CB C 61 40.039 40.039 40.076 -0.037 19193 2096 1 6 . 1 1 61 61 PHE H H 61 7.231 7.231 7.525 -0.294 19193 2097 1 6 . 1 1 62 62 TYR N N 62 120.802 120.802 122.041 -1.239 19193 2098 1 6 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.634 0.836 19193 2099 1 6 . 1 1 62 62 TYR C C 62 173.559 173.559 175.372 -1.813 19193 2100 1 6 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.653 1.235 19193 2101 1 6 . 1 1 62 62 TYR CB C 62 38.274 38.274 38.075 0.199 19193 2102 1 6 . 1 1 62 62 TYR H H 62 8.301 8.301 7.875 0.426 19193 2103 1 6 . 1 1 63 63 GLY N N 63 132.741 132.741 115.584 17.157 19193 2104 1 6 . 1 1 63 63 GLY C C 63 172.799 172.799 174.503 -1.704 19193 2105 1 6 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.756 1.496 19193 2106 1 6 . 1 1 63 63 GLY H H 63 8.293 8.293 7.853 0.440 19193 2107 1 6 . 1 1 64 64 SER N N 64 115.064 115.064 115.247 -0.183 19193 2108 1 6 . 1 1 64 64 SER HA H 64 4.780 4.780 4.588 0.192 19193 2109 1 6 . 1 1 64 64 SER C C 64 170.939 170.939 175.439 -4.500 19193 2110 1 6 . 1 1 64 64 SER CA C 64 60.525 60.525 57.454 3.071 19193 2111 1 6 . 1 1 64 64 SER CB C 64 63.430 63.430 63.178 0.252 19193 2112 1 6 . 1 1 64 64 SER H H 64 7.833 7.833 7.596 0.237 19193 2113 1 6 . 1 1 65 65 ILE N N 65 112.928 112.928 120.278 -7.350 19193 2114 1 6 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.112 0.148 19193 2115 1 6 . 1 1 65 65 ILE C C 65 175.695 175.695 176.136 -0.441 19193 2116 1 6 . 1 1 65 65 ILE CA C 65 59.752 59.752 60.944 -1.192 19193 2117 1 6 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.190 2.533 19193 2118 1 6 . 1 1 65 65 ILE H H 65 6.935 6.935 7.884 -0.949 19193 2119 1 7 . 1 1 5 5 LEU N N 5 120.669 120.669 117.092 3.577 19193 2120 1 7 . 1 1 5 5 LEU HA H 5 4.210 4.210 3.953 0.257 19193 2121 1 7 . 1 1 5 5 LEU CA C 5 58.825 58.825 56.927 1.898 19193 2122 1 7 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.134 1.131 19193 2123 1 7 . 1 1 5 5 LEU H H 5 7.998 7.998 7.954 0.044 19193 2124 1 7 . 1 1 6 6 PHE N N 6 117.996 117.996 120.093 -2.097 19193 2125 1 7 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.978 -0.118 19193 2126 1 7 . 1 1 6 6 PHE C C 6 175.520 175.520 176.955 -1.435 19193 2127 1 7 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.282 1.932 19193 2128 1 7 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.766 0.252 19193 2129 1 7 . 1 1 6 6 PHE H H 6 7.276 7.276 8.047 -0.771 19193 2130 1 7 . 1 1 7 7 LYS N N 7 114.616 114.616 119.404 -4.788 19193 2131 1 7 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.852 0.109 19193 2132 1 7 . 1 1 7 7 LYS C C 7 175.105 175.105 178.106 -3.001 19193 2133 1 7 . 1 1 7 7 LYS CA C 7 58.770 58.770 59.198 -0.428 19193 2134 1 7 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.199 0.038 19193 2135 1 7 . 1 1 7 7 LYS H H 7 7.523 7.523 7.583 -0.060 19193 2136 1 7 . 1 1 8 8 GLU N N 8 117.996 117.996 119.262 -1.266 19193 2137 1 7 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.052 -0.192 19193 2138 1 7 . 1 1 8 8 GLU C C 8 174.994 174.994 178.421 -3.427 19193 2139 1 7 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.762 -0.503 19193 2140 1 7 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.926 -0.623 19193 2141 1 7 . 1 1 8 8 GLU H H 8 7.276 7.276 7.767 -0.491 19193 2142 1 7 . 1 1 9 9 ILE N N 9 117.880 117.880 116.833 1.047 19193 2143 1 7 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.634 -0.192 19193 2144 1 7 . 1 1 9 9 ILE C C 9 177.620 177.620 176.452 1.168 19193 2145 1 7 . 1 1 9 9 ILE CA C 9 63.411 63.411 63.385 0.026 19193 2146 1 7 . 1 1 9 9 ILE CB C 9 37.711 37.711 37.629 0.082 19193 2147 1 7 . 1 1 9 9 ILE H H 9 7.166 7.166 7.536 -0.370 19193 2148 1 7 . 1 1 10 10 ASP N N 10 119.154 119.154 122.004 -2.850 19193 2149 1 7 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.680 -0.828 19193 2150 1 7 . 1 1 10 10 ASP C C 10 174.446 174.446 176.988 -2.542 19193 2151 1 7 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.726 -1.339 19193 2152 1 7 . 1 1 10 10 ASP CB C 10 38.297 38.297 39.267 -0.971 19193 2153 1 7 . 1 1 10 10 ASP H H 10 7.629 7.629 7.473 0.156 19193 2154 1 7 . 1 1 11 11 VAL N N 11 124.080 124.080 124.224 -0.144 19193 2155 1 7 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.783 0.027 19193 2156 1 7 . 1 1 11 11 VAL C C 11 174.883 174.883 176.750 -1.867 19193 2157 1 7 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.805 0.083 19193 2158 1 7 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.403 0.517 19193 2159 1 7 . 1 1 11 11 VAL H H 11 7.956 7.956 7.950 0.006 19193 2160 1 7 . 1 1 12 12 ASN N N 12 114.490 114.490 116.640 -2.150 19193 2161 1 7 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.652 0.108 19193 2162 1 7 . 1 1 12 12 ASN C C 12 173.671 173.671 176.602 -2.931 19193 2163 1 7 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.615 -0.997 19193 2164 1 7 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.433 -0.861 19193 2165 1 7 . 1 1 12 12 ASN H H 12 7.630 7.630 7.922 -0.292 19193 2166 1 7 . 1 1 13 13 GLY N N 13 109.255 109.255 108.573 0.682 19193 2167 1 7 . 1 1 13 13 GLY C C 13 172.031 172.031 174.982 -2.951 19193 2168 1 7 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.664 0.334 19193 2169 1 7 . 1 1 13 13 GLY H H 13 7.643 7.643 8.073 -0.430 19193 2170 1 7 . 1 1 14 14 ASP N N 14 118.441 118.441 119.211 -0.770 19193 2171 1 7 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.613 -0.083 19193 2172 1 7 . 1 1 14 14 ASP C C 14 174.877 174.877 177.759 -2.882 19193 2173 1 7 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.483 -0.610 19193 2174 1 7 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.182 -1.153 19193 2175 1 7 . 1 1 14 14 ASP H H 14 7.956 7.956 7.891 0.065 19193 2176 1 7 . 1 1 15 15 GLY N N 15 118.441 118.441 107.373 11.068 19193 2177 1 7 . 1 1 15 15 GLY C C 15 169.627 169.627 173.281 -3.654 19193 2178 1 7 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.823 0.050 19193 2179 1 7 . 1 1 15 15 GLY H H 15 10.286 10.286 8.778 1.508 19193 2180 1 7 . 1 1 16 16 ALA N N 16 122.512 122.512 121.770 0.742 19193 2181 1 7 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.728 -0.798 19193 2182 1 7 . 1 1 16 16 ALA C C 16 172.696 172.696 176.091 -3.395 19193 2183 1 7 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.852 -0.973 19193 2184 1 7 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.336 -0.198 19193 2185 1 7 . 1 1 16 16 ALA H H 16 7.883 7.883 7.700 0.183 19193 2186 1 7 . 1 1 17 17 VAL N N 17 124.615 124.615 118.266 6.349 19193 2187 1 7 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.830 0.110 19193 2188 1 7 . 1 1 17 17 VAL C C 17 172.461 172.461 175.270 -2.809 19193 2189 1 7 . 1 1 17 17 VAL CA C 17 60.441 60.441 60.094 0.347 19193 2190 1 7 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.463 -1.927 19193 2191 1 7 . 1 1 17 17 VAL H H 17 9.373 9.373 8.794 0.579 19193 2192 1 7 . 1 1 18 18 SER N N 18 125.090 125.090 121.936 3.154 19193 2193 1 7 . 1 1 18 18 SER HA H 18 4.970 4.970 4.973 -0.003 19193 2194 1 7 . 1 1 18 18 SER C C 18 172.145 172.145 175.843 -3.698 19193 2195 1 7 . 1 1 18 18 SER CA C 18 55.641 55.641 57.301 -1.660 19193 2196 1 7 . 1 1 18 18 SER CB C 18 66.313 66.313 64.963 1.350 19193 2197 1 7 . 1 1 18 18 SER H H 18 8.885 8.885 8.480 0.405 19193 2198 1 7 . 1 1 19 19 TYR N N 19 123.319 123.319 119.634 3.685 19193 2199 1 7 . 1 1 19 19 TYR HA H 19 4.960 4.960 3.583 1.377 19193 2200 1 7 . 1 1 19 19 TYR C C 19 174.218 174.218 177.283 -3.065 19193 2201 1 7 . 1 1 19 19 TYR CA C 19 62.398 62.398 60.694 1.704 19193 2202 1 7 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.864 -0.005 19193 2203 1 7 . 1 1 19 19 TYR H H 19 9.180 9.180 7.731 1.449 19193 2204 1 7 . 1 1 20 20 GLU N N 20 117.323 117.323 118.618 -1.295 19193 2205 1 7 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.724 1.056 19193 2206 1 7 . 1 1 20 20 GLU C C 20 177.285 177.285 178.823 -1.538 19193 2207 1 7 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.497 0.273 19193 2208 1 7 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.406 0.059 19193 2209 1 7 . 1 1 20 20 GLU H H 20 8.520 8.520 7.505 1.015 19193 2210 1 7 . 1 1 21 21 GLU N N 21 120.067 120.067 119.639 0.428 19193 2211 1 7 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.939 0.841 19193 2212 1 7 . 1 1 21 21 GLU C C 21 177.617 177.617 178.936 -1.319 19193 2213 1 7 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.107 -0.206 19193 2214 1 7 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.164 -1.266 19193 2215 1 7 . 1 1 21 21 GLU H H 21 7.738 7.738 7.145 0.593 19193 2216 1 7 . 1 1 22 22 VAL N N 22 122.931 122.931 120.624 2.307 19193 2217 1 7 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.408 0.092 19193 2218 1 7 . 1 1 22 22 VAL C C 22 173.899 173.899 177.255 -3.356 19193 2219 1 7 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.156 1.374 19193 2220 1 7 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.752 -0.971 19193 2221 1 7 . 1 1 22 22 VAL H H 22 8.110 8.110 8.255 -0.145 19193 2222 1 7 . 1 1 23 23 LYS N N 23 120.609 120.609 119.629 0.980 19193 2223 1 7 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.944 -0.444 19193 2224 1 7 . 1 1 23 23 LYS C C 23 175.965 175.965 178.937 -2.972 19193 2225 1 7 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.215 0.940 19193 2226 1 7 . 1 1 23 23 LYS CB C 23 31.640 31.640 32.035 -0.395 19193 2227 1 7 . 1 1 23 23 LYS H H 23 8.613 8.613 7.586 1.027 19193 2228 1 7 . 1 1 24 24 ALA N N 24 121.619 121.619 122.138 -0.519 19193 2229 1 7 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.073 -0.053 19193 2230 1 7 . 1 1 24 24 ALA C C 24 176.843 176.843 179.543 -2.700 19193 2231 1 7 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.073 -0.318 19193 2232 1 7 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.384 -0.300 19193 2233 1 7 . 1 1 24 24 ALA H H 24 8.038 8.038 7.954 0.084 19193 2234 1 7 . 1 1 25 25 PHE N N 25 118.380 118.380 118.014 0.366 19193 2235 1 7 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.159 0.061 19193 2236 1 7 . 1 1 25 25 PHE C C 25 174.657 174.657 178.547 -3.890 19193 2237 1 7 . 1 1 25 25 PHE CA C 25 61.143 61.143 60.313 0.830 19193 2238 1 7 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.303 1.263 19193 2239 1 7 . 1 1 25 25 PHE H H 25 7.668 7.668 8.425 -0.757 19193 2240 1 7 . 1 1 26 26 VAL N N 26 117.975 117.975 119.087 -1.112 19193 2241 1 7 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.786 -0.606 19193 2242 1 7 . 1 1 26 26 VAL C C 26 175.212 175.212 177.894 -2.682 19193 2243 1 7 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.538 1.000 19193 2244 1 7 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.856 -0.450 19193 2245 1 7 . 1 1 26 26 VAL H H 26 8.667 8.667 7.905 0.762 19193 2246 1 7 . 1 1 27 27 SER N N 27 112.988 112.988 115.056 -2.068 19193 2247 1 7 . 1 1 27 27 SER HA H 27 4.900 4.900 4.385 0.515 19193 2248 1 7 . 1 1 27 27 SER C C 27 172.256 172.256 174.823 -2.567 19193 2249 1 7 . 1 1 27 27 SER CA C 27 60.403 60.403 60.504 -0.101 19193 2250 1 7 . 1 1 27 27 SER CB C 27 63.131 63.131 63.173 -0.042 19193 2251 1 7 . 1 1 27 27 SER H H 27 8.138 8.138 7.648 0.490 19193 2252 1 7 . 1 1 28 28 LYS N N 28 119.278 119.278 118.106 1.172 19193 2253 1 7 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.181 -0.121 19193 2254 1 7 . 1 1 28 28 LYS C C 28 174.753 174.753 177.334 -2.581 19193 2255 1 7 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.433 0.466 19193 2256 1 7 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.242 -0.019 19193 2257 1 7 . 1 1 28 28 LYS H H 28 7.077 7.077 7.365 -0.288 19193 2258 1 7 . 1 1 29 29 LYS N N 29 116.136 116.136 116.932 -0.796 19193 2259 1 7 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.424 -0.164 19193 2260 1 7 . 1 1 29 29 LYS C C 29 173.137 173.137 176.343 -3.206 19193 2261 1 7 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.623 -1.615 19193 2262 1 7 . 1 1 29 29 LYS CB C 29 33.689 33.689 33.964 -0.275 19193 2263 1 7 . 1 1 29 29 LYS H H 29 7.452 7.452 8.031 -0.579 19193 2264 1 7 . 1 1 30 30 ARG N N 30 116.823 116.823 116.038 0.785 19193 2265 1 7 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.429 0.041 19193 2266 1 7 . 1 1 30 30 ARG C C 30 169.632 169.632 173.405 -3.773 19193 2267 1 7 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.360 -0.980 19193 2268 1 7 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.384 -0.312 19193 2269 1 7 . 1 1 30 30 ARG H H 30 8.079 8.079 7.438 0.641 19193 2270 1 7 . 1 1 31 31 ALA N N 31 121.111 121.111 123.164 -2.053 19193 2271 1 7 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.648 -0.188 19193 2272 1 7 . 1 1 31 31 ALA C C 31 175.120 175.120 176.708 -1.588 19193 2273 1 7 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.416 -0.419 19193 2274 1 7 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.943 -0.848 19193 2275 1 7 . 1 1 31 31 ALA H H 31 7.929 7.929 8.349 -0.420 19193 2276 1 7 . 1 1 32 32 ILE N N 32 123.829 123.829 124.905 -1.076 19193 2277 1 7 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.393 -0.003 19193 2278 1 7 . 1 1 32 32 ILE C C 32 173.398 173.398 174.436 -1.038 19193 2279 1 7 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.264 0.767 19193 2280 1 7 . 1 1 32 32 ILE CB C 32 37.165 37.165 40.707 -3.542 19193 2281 1 7 . 1 1 32 32 ILE H H 32 8.552 8.552 8.365 0.187 19193 2282 1 7 . 1 1 33 33 LYS N N 33 130.536 130.536 129.795 0.741 19193 2283 1 7 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.378 -0.358 19193 2284 1 7 . 1 1 33 33 LYS C C 33 174.009 174.009 175.592 -1.583 19193 2285 1 7 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.461 0.180 19193 2286 1 7 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.314 5.096 19193 2287 1 7 . 1 1 33 33 LYS H H 33 9.444 9.444 8.424 1.020 19193 2288 1 7 . 1 1 34 34 ASN N N 34 120.119 120.119 124.899 -4.780 19193 2289 1 7 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.917 -0.137 19193 2290 1 7 . 1 1 34 34 ASN C C 34 171.824 171.824 175.130 -3.306 19193 2291 1 7 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.244 -1.241 19193 2292 1 7 . 1 1 34 34 ASN CB C 34 38.288 38.288 39.870 -1.583 19193 2293 1 7 . 1 1 34 34 ASN H H 34 8.724 8.724 8.622 0.102 19193 2294 1 7 . 1 1 35 35 GLU N N 35 124.613 124.613 124.230 0.383 19193 2295 1 7 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.073 0.217 19193 2296 1 7 . 1 1 35 35 GLU C C 35 174.770 174.770 177.387 -2.617 19193 2297 1 7 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.926 -0.619 19193 2298 1 7 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.979 -1.223 19193 2299 1 7 . 1 1 35 35 GLU H H 35 8.860 8.860 8.815 0.045 19193 2300 1 7 . 1 1 36 36 GLN N N 36 118.117 118.117 120.381 -2.264 19193 2301 1 7 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.197 0.583 19193 2302 1 7 . 1 1 36 36 GLN C C 36 176.083 176.083 178.314 -2.231 19193 2303 1 7 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.795 0.346 19193 2304 1 7 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.438 -0.842 19193 2305 1 7 . 1 1 36 36 GLN H H 36 8.346 8.346 8.178 0.168 19193 2306 1 7 . 1 1 37 37 LEU N N 37 119.945 119.945 120.842 -0.897 19193 2307 1 7 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.104 -0.004 19193 2308 1 7 . 1 1 37 37 LEU C C 37 175.096 175.096 178.568 -3.472 19193 2309 1 7 . 1 1 37 37 LEU CA C 37 57.387 57.387 58.055 -0.668 19193 2310 1 7 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.253 -0.050 19193 2311 1 7 . 1 1 37 37 LEU H H 37 7.469 7.469 8.237 -0.768 19193 2312 1 7 . 1 1 38 38 LEU N N 38 119.102 119.102 118.804 0.298 19193 2313 1 7 . 1 1 38 38 LEU HA H 38 4.130 4.130 4.009 0.121 19193 2314 1 7 . 1 1 38 38 LEU C C 38 175.531 175.531 179.252 -3.721 19193 2315 1 7 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.364 -0.491 19193 2316 1 7 . 1 1 38 38 LEU CB C 38 40.865 40.865 40.810 0.055 19193 2317 1 7 . 1 1 38 38 LEU H H 38 7.110 7.110 7.688 -0.578 19193 2318 1 7 . 1 1 39 39 GLN N N 39 118.022 118.022 118.766 -0.744 19193 2319 1 7 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.138 -0.208 19193 2320 1 7 . 1 1 39 39 GLN C C 39 175.315 175.315 178.935 -3.620 19193 2321 1 7 . 1 1 39 39 GLN CA C 39 59.511 59.511 58.811 0.700 19193 2322 1 7 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.504 -0.610 19193 2323 1 7 . 1 1 39 39 GLN H H 39 8.579 8.579 7.710 0.869 19193 2324 1 7 . 1 1 40 40 LEU N N 40 120.372 120.372 121.034 -0.662 19193 2325 1 7 . 1 1 40 40 LEU HA H 40 3.940 3.940 3.980 -0.040 19193 2326 1 7 . 1 1 40 40 LEU C C 40 176.514 176.514 179.075 -2.561 19193 2327 1 7 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.060 -0.433 19193 2328 1 7 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.200 -0.152 19193 2329 1 7 . 1 1 40 40 LEU H H 40 7.890 7.890 8.671 -0.781 19193 2330 1 7 . 1 1 41 41 ILE N N 41 120.723 120.723 118.875 1.848 19193 2331 1 7 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.690 0.450 19193 2332 1 7 . 1 1 41 41 ILE C C 41 174.220 174.220 178.361 -4.141 19193 2333 1 7 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.134 1.885 19193 2334 1 7 . 1 1 41 41 ILE CB C 41 38.279 38.279 36.559 1.720 19193 2335 1 7 . 1 1 41 41 ILE H H 41 8.106 8.106 8.579 -0.473 19193 2336 1 7 . 1 1 42 42 PHE N N 42 119.850 119.850 122.481 -2.631 19193 2337 1 7 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.023 0.757 19193 2338 1 7 . 1 1 42 42 PHE C C 42 173.670 173.670 176.994 -3.324 19193 2339 1 7 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.353 1.543 19193 2340 1 7 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.539 1.479 19193 2341 1 7 . 1 1 42 42 PHE H H 42 8.695 8.695 8.390 0.305 19193 2342 1 7 . 1 1 43 43 LYS N N 43 115.976 115.976 117.909 -1.933 19193 2343 1 7 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.519 0.501 19193 2344 1 7 . 1 1 43 43 LYS C C 43 175.313 175.313 177.784 -2.471 19193 2345 1 7 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.604 0.286 19193 2346 1 7 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.237 0.282 19193 2347 1 7 . 1 1 43 43 LYS H H 43 8.405 8.405 7.626 0.779 19193 2348 1 7 . 1 1 44 44 SER N N 44 112.481 112.481 113.854 -1.373 19193 2349 1 7 . 1 1 44 44 SER HA H 44 4.100 4.100 4.175 -0.075 19193 2350 1 7 . 1 1 44 44 SER C C 44 172.469 172.469 175.850 -3.381 19193 2351 1 7 . 1 1 44 44 SER CA C 44 61.017 61.017 60.921 0.096 19193 2352 1 7 . 1 1 44 44 SER CB C 44 63.450 63.450 63.524 -0.074 19193 2353 1 7 . 1 1 44 44 SER H H 44 7.492 7.492 7.708 -0.216 19193 2354 1 7 . 1 1 45 45 ILE N N 45 120.793 120.793 118.898 1.895 19193 2355 1 7 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.735 0.825 19193 2356 1 7 . 1 1 45 45 ILE C C 45 174.535 174.535 175.923 -1.388 19193 2357 1 7 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.376 -0.601 19193 2358 1 7 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.004 -0.025 19193 2359 1 7 . 1 1 45 45 ILE H H 45 7.407 7.407 7.719 -0.312 19193 2360 1 7 . 1 1 46 46 ASP N N 46 118.226 118.226 119.671 -1.445 19193 2361 1 7 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.399 0.001 19193 2362 1 7 . 1 1 46 46 ASP C C 46 173.226 173.226 176.011 -2.785 19193 2363 1 7 . 1 1 46 46 ASP CA C 46 52.245 52.245 54.297 -2.051 19193 2364 1 7 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.437 -3.405 19193 2365 1 7 . 1 1 46 46 ASP H H 46 7.343 7.343 7.582 -0.239 19193 2366 1 7 . 1 1 47 47 ALA N N 47 130.084 130.084 128.618 1.466 19193 2367 1 7 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.984 0.406 19193 2368 1 7 . 1 1 47 47 ALA C C 47 176.299 176.299 177.867 -1.568 19193 2369 1 7 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.274 0.292 19193 2370 1 7 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.331 -0.111 19193 2371 1 7 . 1 1 47 47 ALA H H 47 7.742 7.742 8.484 -0.742 19193 2372 1 7 . 1 1 48 48 ASP N N 48 113.283 113.283 113.566 -0.283 19193 2373 1 7 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.615 -0.015 19193 2374 1 7 . 1 1 48 48 ASP C C 48 175.111 175.111 177.038 -1.927 19193 2375 1 7 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.240 -0.730 19193 2376 1 7 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.109 -1.670 19193 2377 1 7 . 1 1 48 48 ASP H H 48 8.038 8.038 7.821 0.217 19193 2378 1 7 . 1 1 49 49 GLY C C 49 172.256 172.256 174.665 -2.409 19193 2379 1 7 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.722 1.012 19193 2380 1 7 . 1 1 49 49 GLY H H 49 7.775 7.775 7.943 -0.168 19193 2381 1 7 . 1 1 50 50 ASN N N 50 119.017 119.017 118.783 0.234 19193 2382 1 7 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.604 0.026 19193 2383 1 7 . 1 1 50 50 ASN C C 50 173.670 173.670 176.694 -3.024 19193 2384 1 7 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.148 1.228 19193 2385 1 7 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.795 0.616 19193 2386 1 7 . 1 1 50 50 ASN H H 50 8.155 8.155 7.905 0.250 19193 2387 1 7 . 1 1 51 51 GLY C C 51 169.963 169.963 173.596 -3.633 19193 2388 1 7 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.221 -1.984 19193 2389 1 7 . 1 1 51 51 GLY H H 51 10.668 10.668 8.688 1.980 19193 2390 1 7 . 1 1 52 52 GLU N N 52 116.254 116.254 118.991 -2.737 19193 2391 1 7 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.070 -0.110 19193 2392 1 7 . 1 1 52 52 GLU C C 52 171.378 171.378 175.328 -3.950 19193 2393 1 7 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.224 -0.916 19193 2394 1 7 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.347 0.734 19193 2395 1 7 . 1 1 52 52 GLU H H 52 7.579 7.579 8.288 -0.709 19193 2396 1 7 . 1 1 53 53 ILE N N 53 126.770 126.770 121.957 4.813 19193 2397 1 7 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.972 0.008 19193 2398 1 7 . 1 1 53 53 ILE C C 53 172.922 172.922 176.339 -3.417 19193 2399 1 7 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.099 -1.453 19193 2400 1 7 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.806 -0.789 19193 2401 1 7 . 1 1 53 53 ILE H H 53 9.661 9.661 9.112 0.549 19193 2402 1 7 . 1 1 54 54 ASP N N 54 128.225 128.225 127.147 1.078 19193 2403 1 7 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.178 -0.268 19193 2404 1 7 . 1 1 54 54 ASP C C 54 173.562 173.562 178.085 -4.523 19193 2405 1 7 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.366 -1.474 19193 2406 1 7 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.625 0.275 19193 2407 1 7 . 1 1 54 54 ASP H H 54 8.771 8.771 9.290 -0.519 19193 2408 1 7 . 1 1 55 55 GLN N N 55 116.090 116.090 120.824 -4.734 19193 2409 1 7 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.801 0.539 19193 2410 1 7 . 1 1 55 55 GLN C C 55 175.643 175.643 177.654 -2.011 19193 2411 1 7 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.675 -0.029 19193 2412 1 7 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.247 -0.350 19193 2413 1 7 . 1 1 55 55 GLN H H 55 8.563 8.563 8.541 0.022 19193 2414 1 7 . 1 1 56 56 ASN N N 56 119.830 119.830 119.719 0.111 19193 2415 1 7 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.263 0.507 19193 2416 1 7 . 1 1 56 56 ASN C C 56 178.242 178.242 177.455 0.787 19193 2417 1 7 . 1 1 56 56 ASN CA C 56 55.887 55.887 57.240 -1.353 19193 2418 1 7 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.882 0.381 19193 2419 1 7 . 1 1 56 56 ASN H H 56 8.205 8.205 8.674 -0.469 19193 2420 1 7 . 1 1 57 57 GLU N N 57 123.242 123.242 120.250 2.992 19193 2421 1 7 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.965 0.045 19193 2422 1 7 . 1 1 57 57 GLU C C 57 177.498 177.498 179.025 -1.527 19193 2423 1 7 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.410 -0.770 19193 2424 1 7 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.422 0.203 19193 2425 1 7 . 1 1 57 57 GLU H H 57 9.079 9.079 8.058 1.021 19193 2426 1 7 . 1 1 58 58 PHE N N 58 119.057 119.057 120.645 -1.588 19193 2427 1 7 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.261 -0.231 19193 2428 1 7 . 1 1 58 58 PHE C C 58 173.784 173.784 177.293 -3.509 19193 2429 1 7 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.401 0.343 19193 2430 1 7 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.907 0.674 19193 2431 1 7 . 1 1 58 58 PHE H H 58 8.795 8.795 8.232 0.563 19193 2432 1 7 . 1 1 59 59 ALA N N 59 120.919 120.919 121.875 -0.956 19193 2433 1 7 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.118 -0.158 19193 2434 1 7 . 1 1 59 59 ALA C C 59 177.602 177.602 179.391 -1.789 19193 2435 1 7 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.134 -0.206 19193 2436 1 7 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.305 -0.514 19193 2437 1 7 . 1 1 59 59 ALA H H 59 8.158 8.158 8.397 -0.239 19193 2438 1 7 . 1 1 60 60 LYS N N 60 116.767 116.767 117.417 -0.650 19193 2439 1 7 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.135 -0.085 19193 2440 1 7 . 1 1 60 60 LYS C C 60 175.309 175.309 178.401 -3.092 19193 2441 1 7 . 1 1 60 60 LYS CA C 60 58.274 58.274 58.113 0.161 19193 2442 1 7 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.300 -0.079 19193 2443 1 7 . 1 1 60 60 LYS H H 60 7.554 7.554 7.926 -0.372 19193 2444 1 7 . 1 1 61 61 PHE N N 61 118.086 118.086 120.244 -2.158 19193 2445 1 7 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.297 0.193 19193 2446 1 7 . 1 1 61 61 PHE C C 61 173.559 173.559 175.554 -1.995 19193 2447 1 7 . 1 1 61 61 PHE CA C 61 58.521 58.521 58.245 0.276 19193 2448 1 7 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.900 0.139 19193 2449 1 7 . 1 1 61 61 PHE H H 61 7.231 7.231 7.735 -0.504 19193 2450 1 7 . 1 1 62 62 TYR N N 62 120.802 120.802 122.210 -1.408 19193 2451 1 7 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.768 0.703 19193 2452 1 7 . 1 1 62 62 TYR C C 62 173.559 173.559 175.482 -1.923 19193 2453 1 7 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.786 1.101 19193 2454 1 7 . 1 1 62 62 TYR CB C 62 38.274 38.274 38.143 0.131 19193 2455 1 7 . 1 1 62 62 TYR H H 62 8.301 8.301 7.903 0.398 19193 2456 1 7 . 1 1 63 63 GLY N N 63 132.741 132.741 115.917 16.824 19193 2457 1 7 . 1 1 63 63 GLY C C 63 172.799 172.799 174.889 -2.090 19193 2458 1 7 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.979 1.273 19193 2459 1 7 . 1 1 63 63 GLY H H 63 8.293 8.293 7.914 0.379 19193 2460 1 7 . 1 1 64 64 SER N N 64 115.064 115.064 115.518 -0.454 19193 2461 1 7 . 1 1 64 64 SER HA H 64 4.780 4.780 4.604 0.176 19193 2462 1 7 . 1 1 64 64 SER C C 64 170.939 170.939 175.249 -4.310 19193 2463 1 7 . 1 1 64 64 SER CA C 64 60.525 60.525 57.993 2.532 19193 2464 1 7 . 1 1 64 64 SER CB C 64 63.430 63.430 63.314 0.116 19193 2465 1 7 . 1 1 64 64 SER H H 64 7.833 7.833 7.754 0.079 19193 2466 1 7 . 1 1 65 65 ILE N N 65 112.928 112.928 120.705 -7.777 19193 2467 1 7 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.159 0.101 19193 2468 1 7 . 1 1 65 65 ILE C C 65 175.695 175.695 175.896 -0.201 19193 2469 1 7 . 1 1 65 65 ILE CA C 65 59.752 59.752 61.039 -1.287 19193 2470 1 7 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.544 2.178 19193 2471 1 7 . 1 1 65 65 ILE H H 65 6.935 6.935 7.753 -0.818 19193 2472 1 8 . 1 1 5 5 LEU N N 5 120.669 120.669 117.722 2.947 19193 2473 1 8 . 1 1 5 5 LEU HA H 5 4.210 4.210 3.968 0.242 19193 2474 1 8 . 1 1 5 5 LEU CA C 5 58.825 58.825 57.176 1.649 19193 2475 1 8 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.187 1.078 19193 2476 1 8 . 1 1 5 5 LEU H H 5 7.998 7.998 7.958 0.040 19193 2477 1 8 . 1 1 6 6 PHE N N 6 117.996 117.996 119.831 -1.835 19193 2478 1 8 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.656 0.204 19193 2479 1 8 . 1 1 6 6 PHE C C 6 175.520 175.520 176.879 -1.359 19193 2480 1 8 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.200 2.014 19193 2481 1 8 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.599 0.419 19193 2482 1 8 . 1 1 6 6 PHE H H 6 7.276 7.276 7.989 -0.713 19193 2483 1 8 . 1 1 7 7 LYS N N 7 114.616 114.616 116.999 -2.383 19193 2484 1 8 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.863 0.098 19193 2485 1 8 . 1 1 7 7 LYS C C 7 175.105 175.105 177.975 -2.870 19193 2486 1 8 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.687 0.083 19193 2487 1 8 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.289 -0.052 19193 2488 1 8 . 1 1 7 7 LYS H H 7 7.523 7.523 7.551 -0.028 19193 2489 1 8 . 1 1 8 8 GLU N N 8 117.996 117.996 118.947 -0.951 19193 2490 1 8 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.010 -0.150 19193 2491 1 8 . 1 1 8 8 GLU C C 8 174.994 174.994 178.321 -3.327 19193 2492 1 8 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.681 -0.422 19193 2493 1 8 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.665 -0.362 19193 2494 1 8 . 1 1 8 8 GLU H H 8 7.276 7.276 7.650 -0.374 19193 2495 1 8 . 1 1 9 9 ILE N N 9 117.880 117.880 116.184 1.696 19193 2496 1 8 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.716 -0.274 19193 2497 1 8 . 1 1 9 9 ILE C C 9 177.620 177.620 176.473 1.147 19193 2498 1 8 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.345 1.066 19193 2499 1 8 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.827 0.884 19193 2500 1 8 . 1 1 9 9 ILE H H 9 7.166 7.166 7.356 -0.190 19193 2501 1 8 . 1 1 10 10 ASP N N 10 119.154 119.154 121.978 -2.824 19193 2502 1 8 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.490 -0.638 19193 2503 1 8 . 1 1 10 10 ASP C C 10 174.446 174.446 177.253 -2.807 19193 2504 1 8 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.853 -1.466 19193 2505 1 8 . 1 1 10 10 ASP CB C 10 38.297 38.297 39.041 -0.744 19193 2506 1 8 . 1 1 10 10 ASP H H 10 7.629 7.629 7.393 0.236 19193 2507 1 8 . 1 1 11 11 VAL N N 11 124.080 124.080 123.403 0.677 19193 2508 1 8 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.690 0.120 19193 2509 1 8 . 1 1 11 11 VAL C C 11 174.883 174.883 176.668 -1.785 19193 2510 1 8 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.977 -0.089 19193 2511 1 8 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.716 0.204 19193 2512 1 8 . 1 1 11 11 VAL H H 11 7.956 7.956 7.808 0.148 19193 2513 1 8 . 1 1 12 12 ASN N N 12 114.490 114.490 116.629 -2.139 19193 2514 1 8 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.626 0.134 19193 2515 1 8 . 1 1 12 12 ASN C C 12 173.671 173.671 176.477 -2.806 19193 2516 1 8 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.456 -0.838 19193 2517 1 8 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.212 -0.640 19193 2518 1 8 . 1 1 12 12 ASN H H 12 7.630 7.630 7.839 -0.209 19193 2519 1 8 . 1 1 13 13 GLY N N 13 109.255 109.255 108.777 0.478 19193 2520 1 8 . 1 1 13 13 GLY C C 13 172.031 172.031 174.808 -2.777 19193 2521 1 8 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.583 0.415 19193 2522 1 8 . 1 1 13 13 GLY H H 13 7.643 7.643 8.052 -0.409 19193 2523 1 8 . 1 1 14 14 ASP N N 14 118.441 118.441 118.972 -0.531 19193 2524 1 8 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.639 -0.109 19193 2525 1 8 . 1 1 14 14 ASP C C 14 174.877 174.877 177.509 -2.632 19193 2526 1 8 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.077 -0.204 19193 2527 1 8 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.363 -1.334 19193 2528 1 8 . 1 1 14 14 ASP H H 14 7.956 7.956 7.785 0.172 19193 2529 1 8 . 1 1 15 15 GLY N N 15 118.441 118.441 107.431 11.010 19193 2530 1 8 . 1 1 15 15 GLY C C 15 169.627 169.627 173.189 -3.562 19193 2531 1 8 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.715 0.158 19193 2532 1 8 . 1 1 15 15 GLY H H 15 10.286 10.286 8.748 1.538 19193 2533 1 8 . 1 1 16 16 ALA N N 16 122.512 122.512 121.696 0.816 19193 2534 1 8 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.752 -0.822 19193 2535 1 8 . 1 1 16 16 ALA C C 16 172.696 172.696 176.058 -3.362 19193 2536 1 8 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.745 -0.866 19193 2537 1 8 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.432 -0.294 19193 2538 1 8 . 1 1 16 16 ALA H H 16 7.883 7.883 7.918 -0.035 19193 2539 1 8 . 1 1 17 17 VAL N N 17 124.615 124.615 118.099 6.516 19193 2540 1 8 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.863 0.077 19193 2541 1 8 . 1 1 17 17 VAL C C 17 172.461 172.461 175.339 -2.878 19193 2542 1 8 . 1 1 17 17 VAL CA C 17 60.441 60.441 60.153 0.288 19193 2543 1 8 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.504 -1.968 19193 2544 1 8 . 1 1 17 17 VAL H H 17 9.373 9.373 8.765 0.608 19193 2545 1 8 . 1 1 18 18 SER N N 18 125.090 125.090 122.221 2.869 19193 2546 1 8 . 1 1 18 18 SER HA H 18 4.970 4.970 5.181 -0.211 19193 2547 1 8 . 1 1 18 18 SER C C 18 172.145 172.145 176.187 -4.042 19193 2548 1 8 . 1 1 18 18 SER CA C 18 55.641 55.641 57.335 -1.694 19193 2549 1 8 . 1 1 18 18 SER CB C 18 66.313 66.313 64.962 1.351 19193 2550 1 8 . 1 1 18 18 SER H H 18 8.885 8.885 8.610 0.275 19193 2551 1 8 . 1 1 19 19 TYR N N 19 123.319 123.319 120.309 3.010 19193 2552 1 8 . 1 1 19 19 TYR HA H 19 4.960 4.960 3.945 1.015 19193 2553 1 8 . 1 1 19 19 TYR C C 19 174.218 174.218 177.356 -3.138 19193 2554 1 8 . 1 1 19 19 TYR CA C 19 62.398 62.398 60.967 1.431 19193 2555 1 8 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.882 -0.023 19193 2556 1 8 . 1 1 19 19 TYR H H 19 9.180 9.180 8.013 1.167 19193 2557 1 8 . 1 1 20 20 GLU N N 20 117.323 117.323 118.745 -1.422 19193 2558 1 8 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.728 1.052 19193 2559 1 8 . 1 1 20 20 GLU C C 20 177.285 177.285 178.872 -1.587 19193 2560 1 8 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.364 0.406 19193 2561 1 8 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.458 0.007 19193 2562 1 8 . 1 1 20 20 GLU H H 20 8.520 8.520 7.612 0.908 19193 2563 1 8 . 1 1 21 21 GLU N N 21 120.067 120.067 119.933 0.134 19193 2564 1 8 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.925 0.855 19193 2565 1 8 . 1 1 21 21 GLU C C 21 177.617 177.617 178.895 -1.278 19193 2566 1 8 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.555 -0.654 19193 2567 1 8 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.358 -1.460 19193 2568 1 8 . 1 1 21 21 GLU H H 21 7.738 7.738 7.278 0.460 19193 2569 1 8 . 1 1 22 22 VAL N N 22 122.931 122.931 120.838 2.093 19193 2570 1 8 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.923 -0.423 19193 2571 1 8 . 1 1 22 22 VAL C C 22 173.899 173.899 177.596 -3.697 19193 2572 1 8 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.122 1.408 19193 2573 1 8 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.648 -0.867 19193 2574 1 8 . 1 1 22 22 VAL H H 22 8.110 8.110 8.448 -0.338 19193 2575 1 8 . 1 1 23 23 LYS N N 23 120.609 120.609 119.902 0.707 19193 2576 1 8 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.978 -0.478 19193 2577 1 8 . 1 1 23 23 LYS C C 23 175.965 175.965 179.170 -3.205 19193 2578 1 8 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.397 0.758 19193 2579 1 8 . 1 1 23 23 LYS CB C 23 31.640 31.640 32.094 -0.454 19193 2580 1 8 . 1 1 23 23 LYS H H 23 8.613 8.613 7.781 0.832 19193 2581 1 8 . 1 1 24 24 ALA N N 24 121.619 121.619 122.049 -0.430 19193 2582 1 8 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.037 -0.017 19193 2583 1 8 . 1 1 24 24 ALA C C 24 176.843 176.843 179.103 -2.260 19193 2584 1 8 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.073 -0.318 19193 2585 1 8 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.281 -0.197 19193 2586 1 8 . 1 1 24 24 ALA H H 24 8.038 8.038 7.995 0.043 19193 2587 1 8 . 1 1 25 25 PHE N N 25 118.380 118.380 119.500 -1.120 19193 2588 1 8 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.166 0.054 19193 2589 1 8 . 1 1 25 25 PHE C C 25 174.657 174.657 178.165 -3.508 19193 2590 1 8 . 1 1 25 25 PHE CA C 25 61.143 61.143 59.575 1.568 19193 2591 1 8 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.673 0.893 19193 2592 1 8 . 1 1 25 25 PHE H H 25 7.668 7.668 8.157 -0.489 19193 2593 1 8 . 1 1 26 26 VAL N N 26 117.975 117.975 119.034 -1.059 19193 2594 1 8 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.535 -0.355 19193 2595 1 8 . 1 1 26 26 VAL C C 26 175.212 175.212 177.861 -2.649 19193 2596 1 8 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.437 1.102 19193 2597 1 8 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.815 -0.409 19193 2598 1 8 . 1 1 26 26 VAL H H 26 8.667 8.667 7.811 0.856 19193 2599 1 8 . 1 1 27 27 SER N N 27 112.988 112.988 115.727 -2.739 19193 2600 1 8 . 1 1 27 27 SER HA H 27 4.900 4.900 4.464 0.436 19193 2601 1 8 . 1 1 27 27 SER C C 27 172.256 172.256 175.246 -2.990 19193 2602 1 8 . 1 1 27 27 SER CA C 27 60.403 60.403 60.987 -0.584 19193 2603 1 8 . 1 1 27 27 SER CB C 27 63.131 63.131 63.177 -0.046 19193 2604 1 8 . 1 1 27 27 SER H H 27 8.138 8.138 7.797 0.341 19193 2605 1 8 . 1 1 28 28 LYS N N 28 119.278 119.278 119.766 -0.488 19193 2606 1 8 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.178 -0.118 19193 2607 1 8 . 1 1 28 28 LYS C C 28 174.753 174.753 177.123 -2.370 19193 2608 1 8 . 1 1 28 28 LYS CA C 28 57.899 57.899 58.205 -0.306 19193 2609 1 8 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.834 -0.611 19193 2610 1 8 . 1 1 28 28 LYS H H 28 7.077 7.077 7.421 -0.344 19193 2611 1 8 . 1 1 29 29 LYS N N 29 116.136 116.136 116.539 -0.403 19193 2612 1 8 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.401 -0.141 19193 2613 1 8 . 1 1 29 29 LYS C C 29 173.137 173.137 176.250 -3.113 19193 2614 1 8 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.548 -1.540 19193 2615 1 8 . 1 1 29 29 LYS CB C 29 33.689 33.689 33.987 -0.298 19193 2616 1 8 . 1 1 29 29 LYS H H 29 7.452 7.452 7.889 -0.437 19193 2617 1 8 . 1 1 30 30 ARG N N 30 116.823 116.823 116.310 0.513 19193 2618 1 8 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.460 0.010 19193 2619 1 8 . 1 1 30 30 ARG C C 30 169.632 169.632 173.656 -4.024 19193 2620 1 8 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.503 -1.123 19193 2621 1 8 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.715 -0.643 19193 2622 1 8 . 1 1 30 30 ARG H H 30 8.079 8.079 7.411 0.668 19193 2623 1 8 . 1 1 31 31 ALA N N 31 121.111 121.111 122.854 -1.743 19193 2624 1 8 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.658 -0.198 19193 2625 1 8 . 1 1 31 31 ALA C C 31 175.120 175.120 176.357 -1.237 19193 2626 1 8 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.469 -0.472 19193 2627 1 8 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.810 -0.715 19193 2628 1 8 . 1 1 31 31 ALA H H 31 7.929 7.929 8.352 -0.423 19193 2629 1 8 . 1 1 32 32 ILE N N 32 123.829 123.829 124.301 -0.472 19193 2630 1 8 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.303 0.087 19193 2631 1 8 . 1 1 32 32 ILE C C 32 173.398 173.398 174.564 -1.166 19193 2632 1 8 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.317 0.714 19193 2633 1 8 . 1 1 32 32 ILE CB C 32 37.165 37.165 40.473 -3.308 19193 2634 1 8 . 1 1 32 32 ILE H H 32 8.552 8.552 8.219 0.333 19193 2635 1 8 . 1 1 33 33 LYS N N 33 130.536 130.536 129.397 1.139 19193 2636 1 8 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.397 -0.377 19193 2637 1 8 . 1 1 33 33 LYS C C 33 174.009 174.009 175.478 -1.469 19193 2638 1 8 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.330 0.311 19193 2639 1 8 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.106 5.304 19193 2640 1 8 . 1 1 33 33 LYS H H 33 9.444 9.444 8.376 1.068 19193 2641 1 8 . 1 1 34 34 ASN N N 34 120.119 120.119 125.339 -5.220 19193 2642 1 8 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.886 -0.106 19193 2643 1 8 . 1 1 34 34 ASN C C 34 171.824 171.824 175.171 -3.347 19193 2644 1 8 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.898 -1.895 19193 2645 1 8 . 1 1 34 34 ASN CB C 34 38.288 38.288 40.359 -2.071 19193 2646 1 8 . 1 1 34 34 ASN H H 34 8.724 8.724 8.608 0.116 19193 2647 1 8 . 1 1 35 35 GLU N N 35 124.613 124.613 124.750 -0.137 19193 2648 1 8 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.087 0.203 19193 2649 1 8 . 1 1 35 35 GLU C C 35 174.770 174.770 177.574 -2.804 19193 2650 1 8 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.236 0.071 19193 2651 1 8 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.758 -1.002 19193 2652 1 8 . 1 1 35 35 GLU H H 35 8.860 8.860 8.840 0.020 19193 2653 1 8 . 1 1 36 36 GLN N N 36 118.117 118.117 120.240 -2.123 19193 2654 1 8 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.186 0.594 19193 2655 1 8 . 1 1 36 36 GLN C C 36 176.083 176.083 178.462 -2.379 19193 2656 1 8 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.898 0.243 19193 2657 1 8 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.534 -0.938 19193 2658 1 8 . 1 1 36 36 GLN H H 36 8.346 8.346 8.340 0.006 19193 2659 1 8 . 1 1 37 37 LEU N N 37 119.945 119.945 121.287 -1.342 19193 2660 1 8 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.097 0.003 19193 2661 1 8 . 1 1 37 37 LEU C C 37 175.096 175.096 178.811 -3.715 19193 2662 1 8 . 1 1 37 37 LEU CA C 37 57.387 57.387 58.030 -0.643 19193 2663 1 8 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.265 -0.062 19193 2664 1 8 . 1 1 37 37 LEU H H 37 7.469 7.469 8.249 -0.780 19193 2665 1 8 . 1 1 38 38 LEU N N 38 119.102 119.102 118.628 0.474 19193 2666 1 8 . 1 1 38 38 LEU HA H 38 4.130 4.130 4.007 0.123 19193 2667 1 8 . 1 1 38 38 LEU C C 38 175.531 175.531 179.281 -3.750 19193 2668 1 8 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.365 -0.492 19193 2669 1 8 . 1 1 38 38 LEU CB C 38 40.865 40.865 40.889 -0.024 19193 2670 1 8 . 1 1 38 38 LEU H H 38 7.110 7.110 7.654 -0.544 19193 2671 1 8 . 1 1 39 39 GLN N N 39 118.022 118.022 118.674 -0.652 19193 2672 1 8 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.083 -0.153 19193 2673 1 8 . 1 1 39 39 GLN C C 39 175.315 175.315 178.923 -3.608 19193 2674 1 8 . 1 1 39 39 GLN CA C 39 59.511 59.511 58.951 0.560 19193 2675 1 8 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.531 -0.637 19193 2676 1 8 . 1 1 39 39 GLN H H 39 8.579 8.579 7.609 0.970 19193 2677 1 8 . 1 1 40 40 LEU N N 40 120.372 120.372 121.009 -0.637 19193 2678 1 8 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.007 -0.067 19193 2679 1 8 . 1 1 40 40 LEU C C 40 176.514 176.514 179.286 -2.772 19193 2680 1 8 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.148 -0.521 19193 2681 1 8 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.154 -0.106 19193 2682 1 8 . 1 1 40 40 LEU H H 40 7.890 7.890 8.552 -0.662 19193 2683 1 8 . 1 1 41 41 ILE N N 41 120.723 120.723 119.229 1.494 19193 2684 1 8 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.712 0.428 19193 2685 1 8 . 1 1 41 41 ILE C C 41 174.220 174.220 177.944 -3.724 19193 2686 1 8 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.540 1.479 19193 2687 1 8 . 1 1 41 41 ILE CB C 41 38.279 38.279 37.470 0.809 19193 2688 1 8 . 1 1 41 41 ILE H H 41 8.106 8.106 8.597 -0.491 19193 2689 1 8 . 1 1 42 42 PHE N N 42 119.850 119.850 121.143 -1.293 19193 2690 1 8 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.078 0.702 19193 2691 1 8 . 1 1 42 42 PHE C C 42 173.670 173.670 177.223 -3.553 19193 2692 1 8 . 1 1 42 42 PHE CA C 42 62.896 62.896 62.034 0.862 19193 2693 1 8 . 1 1 42 42 PHE CB C 42 40.018 40.018 39.000 1.018 19193 2694 1 8 . 1 1 42 42 PHE H H 42 8.695 8.695 8.296 0.399 19193 2695 1 8 . 1 1 43 43 LYS N N 43 115.976 115.976 118.159 -2.183 19193 2696 1 8 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.673 0.347 19193 2697 1 8 . 1 1 43 43 LYS C C 43 175.313 175.313 177.746 -2.433 19193 2698 1 8 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.727 0.163 19193 2699 1 8 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.330 0.189 19193 2700 1 8 . 1 1 43 43 LYS H H 43 8.405 8.405 7.766 0.639 19193 2701 1 8 . 1 1 44 44 SER N N 44 112.481 112.481 114.015 -1.534 19193 2702 1 8 . 1 1 44 44 SER HA H 44 4.100 4.100 4.215 -0.115 19193 2703 1 8 . 1 1 44 44 SER C C 44 172.469 172.469 175.944 -3.475 19193 2704 1 8 . 1 1 44 44 SER CA C 44 61.017 61.017 60.893 0.124 19193 2705 1 8 . 1 1 44 44 SER CB C 44 63.450 63.450 63.530 -0.080 19193 2706 1 8 . 1 1 44 44 SER H H 44 7.492 7.492 7.718 -0.226 19193 2707 1 8 . 1 1 45 45 ILE N N 45 120.793 120.793 119.002 1.791 19193 2708 1 8 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.851 0.709 19193 2709 1 8 . 1 1 45 45 ILE C C 45 174.535 174.535 175.956 -1.421 19193 2710 1 8 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.477 -0.702 19193 2711 1 8 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.151 -0.172 19193 2712 1 8 . 1 1 45 45 ILE H H 45 7.407 7.407 7.774 -0.367 19193 2713 1 8 . 1 1 46 46 ASP N N 46 118.226 118.226 119.632 -1.406 19193 2714 1 8 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.421 -0.021 19193 2715 1 8 . 1 1 46 46 ASP C C 46 173.226 173.226 175.996 -2.770 19193 2716 1 8 . 1 1 46 46 ASP CA C 46 52.245 52.245 54.207 -1.962 19193 2717 1 8 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.379 -3.347 19193 2718 1 8 . 1 1 46 46 ASP H H 46 7.343 7.343 7.565 -0.222 19193 2719 1 8 . 1 1 47 47 ALA N N 47 130.084 130.084 128.621 1.463 19193 2720 1 8 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.992 0.398 19193 2721 1 8 . 1 1 47 47 ALA C C 47 176.299 176.299 177.886 -1.587 19193 2722 1 8 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.309 0.257 19193 2723 1 8 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.328 -0.108 19193 2724 1 8 . 1 1 47 47 ALA H H 47 7.742 7.742 8.508 -0.766 19193 2725 1 8 . 1 1 48 48 ASP N N 48 113.283 113.283 113.567 -0.284 19193 2726 1 8 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.632 -0.032 19193 2727 1 8 . 1 1 48 48 ASP C C 48 175.111 175.111 177.055 -1.944 19193 2728 1 8 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.259 -0.749 19193 2729 1 8 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.129 -1.690 19193 2730 1 8 . 1 1 48 48 ASP H H 48 8.038 8.038 7.834 0.204 19193 2731 1 8 . 1 1 49 49 GLY C C 49 172.256 172.256 174.714 -2.458 19193 2732 1 8 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.761 0.973 19193 2733 1 8 . 1 1 49 49 GLY H H 49 7.775 7.775 7.947 -0.172 19193 2734 1 8 . 1 1 50 50 ASN N N 50 119.017 119.017 118.803 0.214 19193 2735 1 8 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.631 -0.001 19193 2736 1 8 . 1 1 50 50 ASN C C 50 173.670 173.670 176.711 -3.041 19193 2737 1 8 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.176 1.200 19193 2738 1 8 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.814 0.598 19193 2739 1 8 . 1 1 50 50 ASN H H 50 8.155 8.155 7.908 0.247 19193 2740 1 8 . 1 1 51 51 GLY C C 51 169.963 169.963 173.637 -3.674 19193 2741 1 8 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.244 -2.007 19193 2742 1 8 . 1 1 51 51 GLY H H 51 10.668 10.668 8.727 1.941 19193 2743 1 8 . 1 1 52 52 GLU N N 52 116.254 116.254 118.994 -2.740 19193 2744 1 8 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.130 -0.170 19193 2745 1 8 . 1 1 52 52 GLU C C 52 171.378 171.378 175.305 -3.927 19193 2746 1 8 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.252 -0.945 19193 2747 1 8 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.391 0.690 19193 2748 1 8 . 1 1 52 52 GLU H H 52 7.579 7.579 8.296 -0.717 19193 2749 1 8 . 1 1 53 53 ILE N N 53 126.770 126.770 121.939 4.831 19193 2750 1 8 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.988 -0.008 19193 2751 1 8 . 1 1 53 53 ILE C C 53 172.922 172.922 176.390 -3.468 19193 2752 1 8 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.066 -1.420 19193 2753 1 8 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.884 -0.867 19193 2754 1 8 . 1 1 53 53 ILE H H 53 9.661 9.661 9.121 0.540 19193 2755 1 8 . 1 1 54 54 ASP N N 54 128.225 128.225 126.963 1.262 19193 2756 1 8 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.252 -0.342 19193 2757 1 8 . 1 1 54 54 ASP C C 54 173.562 173.562 178.028 -4.466 19193 2758 1 8 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.511 -1.619 19193 2759 1 8 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.570 0.330 19193 2760 1 8 . 1 1 54 54 ASP H H 54 8.771 8.771 9.294 -0.523 19193 2761 1 8 . 1 1 55 55 GLN N N 55 116.090 116.090 121.131 -5.041 19193 2762 1 8 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.731 0.609 19193 2763 1 8 . 1 1 55 55 GLN C C 55 175.643 175.643 177.484 -1.841 19193 2764 1 8 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.561 0.084 19193 2765 1 8 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.115 -0.218 19193 2766 1 8 . 1 1 55 55 GLN H H 55 8.563 8.563 8.606 -0.043 19193 2767 1 8 . 1 1 56 56 ASN N N 56 119.830 119.830 119.441 0.389 19193 2768 1 8 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.338 0.432 19193 2769 1 8 . 1 1 56 56 ASN C C 56 178.242 178.242 177.658 0.584 19193 2770 1 8 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.094 -0.207 19193 2771 1 8 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.517 0.746 19193 2772 1 8 . 1 1 56 56 ASN H H 56 8.205 8.205 8.693 -0.488 19193 2773 1 8 . 1 1 57 57 GLU N N 57 123.242 123.242 120.302 2.940 19193 2774 1 8 . 1 1 57 57 GLU HA H 57 4.010 4.010 4.000 0.010 19193 2775 1 8 . 1 1 57 57 GLU C C 57 177.498 177.498 179.109 -1.611 19193 2776 1 8 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.438 -0.798 19193 2777 1 8 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.419 0.204 19193 2778 1 8 . 1 1 57 57 GLU H H 57 9.079 9.079 8.079 1.000 19193 2779 1 8 . 1 1 58 58 PHE N N 58 119.057 119.057 120.654 -1.597 19193 2780 1 8 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.244 -0.213 19193 2781 1 8 . 1 1 58 58 PHE C C 58 173.784 173.784 177.262 -3.478 19193 2782 1 8 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.591 0.153 19193 2783 1 8 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.974 0.607 19193 2784 1 8 . 1 1 58 58 PHE H H 58 8.795 8.795 8.232 0.563 19193 2785 1 8 . 1 1 59 59 ALA N N 59 120.919 120.919 121.739 -0.820 19193 2786 1 8 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.061 -0.101 19193 2787 1 8 . 1 1 59 59 ALA C C 59 177.602 177.602 179.450 -1.848 19193 2788 1 8 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.043 -0.115 19193 2789 1 8 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.328 -0.536 19193 2790 1 8 . 1 1 59 59 ALA H H 59 8.158 8.158 8.382 -0.224 19193 2791 1 8 . 1 1 60 60 LYS N N 60 116.767 116.767 116.683 0.084 19193 2792 1 8 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.108 -0.058 19193 2793 1 8 . 1 1 60 60 LYS C C 60 175.309 175.309 178.363 -3.054 19193 2794 1 8 . 1 1 60 60 LYS CA C 60 58.274 58.274 57.839 0.435 19193 2795 1 8 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.463 -0.242 19193 2796 1 8 . 1 1 60 60 LYS H H 60 7.554 7.554 7.869 -0.315 19193 2797 1 8 . 1 1 61 61 PHE N N 61 118.086 118.086 120.698 -2.612 19193 2798 1 8 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.277 0.213 19193 2799 1 8 . 1 1 61 61 PHE C C 61 173.559 173.559 175.425 -1.866 19193 2800 1 8 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.735 0.786 19193 2801 1 8 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.668 0.371 19193 2802 1 8 . 1 1 61 61 PHE H H 61 7.231 7.231 7.701 -0.470 19193 2803 1 8 . 1 1 62 62 TYR N N 62 120.802 120.802 122.300 -1.498 19193 2804 1 8 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.657 0.813 19193 2805 1 8 . 1 1 62 62 TYR C C 62 173.559 173.559 175.558 -1.999 19193 2806 1 8 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.697 1.191 19193 2807 1 8 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.965 0.308 19193 2808 1 8 . 1 1 62 62 TYR H H 62 8.301 8.301 7.785 0.516 19193 2809 1 8 . 1 1 63 63 GLY N N 63 132.741 132.741 116.045 16.696 19193 2810 1 8 . 1 1 63 63 GLY C C 63 172.799 172.799 174.931 -2.132 19193 2811 1 8 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.937 1.315 19193 2812 1 8 . 1 1 63 63 GLY H H 63 8.293 8.293 7.876 0.417 19193 2813 1 8 . 1 1 64 64 SER N N 64 115.064 115.064 115.306 -0.242 19193 2814 1 8 . 1 1 64 64 SER HA H 64 4.780 4.780 4.547 0.233 19193 2815 1 8 . 1 1 64 64 SER C C 64 170.939 170.939 175.429 -4.490 19193 2816 1 8 . 1 1 64 64 SER CA C 64 60.525 60.525 58.060 2.465 19193 2817 1 8 . 1 1 64 64 SER CB C 64 63.430 63.430 63.567 -0.137 19193 2818 1 8 . 1 1 64 64 SER H H 64 7.833 7.833 7.726 0.107 19193 2819 1 8 . 1 1 65 65 ILE N N 65 112.928 112.928 121.087 -8.159 19193 2820 1 8 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.137 0.123 19193 2821 1 8 . 1 1 65 65 ILE C C 65 175.695 175.695 175.476 0.219 19193 2822 1 8 . 1 1 65 65 ILE CA C 65 59.752 59.752 61.230 -1.478 19193 2823 1 8 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.903 1.819 19193 2824 1 8 . 1 1 65 65 ILE H H 65 6.935 6.935 7.759 -0.824 19193 2825 1 9 . 1 1 5 5 LEU N N 5 120.669 120.669 117.675 2.994 19193 2826 1 9 . 1 1 5 5 LEU HA H 5 4.210 4.210 4.014 0.196 19193 2827 1 9 . 1 1 5 5 LEU CA C 5 58.825 58.825 57.194 1.631 19193 2828 1 9 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.546 0.719 19193 2829 1 9 . 1 1 5 5 LEU H H 5 7.998 7.998 7.615 0.383 19193 2830 1 9 . 1 1 6 6 PHE N N 6 117.996 117.996 119.969 -1.973 19193 2831 1 9 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.901 -0.041 19193 2832 1 9 . 1 1 6 6 PHE C C 6 175.520 175.520 176.941 -1.421 19193 2833 1 9 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.272 1.942 19193 2834 1 9 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.754 0.265 19193 2835 1 9 . 1 1 6 6 PHE H H 6 7.276 7.276 8.179 -0.903 19193 2836 1 9 . 1 1 7 7 LYS N N 7 114.616 114.616 118.564 -3.948 19193 2837 1 9 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.893 0.067 19193 2838 1 9 . 1 1 7 7 LYS C C 7 175.105 175.105 177.997 -2.892 19193 2839 1 9 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.764 0.006 19193 2840 1 9 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.354 -0.117 19193 2841 1 9 . 1 1 7 7 LYS H H 7 7.523 7.523 7.638 -0.115 19193 2842 1 9 . 1 1 8 8 GLU N N 8 117.996 117.996 119.228 -1.232 19193 2843 1 9 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.055 -0.195 19193 2844 1 9 . 1 1 8 8 GLU C C 8 174.994 174.994 178.408 -3.414 19193 2845 1 9 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.802 -0.543 19193 2846 1 9 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.744 -0.441 19193 2847 1 9 . 1 1 8 8 GLU H H 8 7.276 7.276 7.758 -0.482 19193 2848 1 9 . 1 1 9 9 ILE N N 9 117.880 117.880 116.087 1.793 19193 2849 1 9 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.694 -0.252 19193 2850 1 9 . 1 1 9 9 ILE C C 9 177.620 177.620 176.546 1.074 19193 2851 1 9 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.164 1.247 19193 2852 1 9 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.890 0.821 19193 2853 1 9 . 1 1 9 9 ILE H H 9 7.166 7.166 7.436 -0.270 19193 2854 1 9 . 1 1 10 10 ASP N N 10 119.154 119.154 121.608 -2.454 19193 2855 1 9 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.451 -0.599 19193 2856 1 9 . 1 1 10 10 ASP C C 10 174.446 174.446 177.016 -2.570 19193 2857 1 9 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.568 -1.181 19193 2858 1 9 . 1 1 10 10 ASP CB C 10 38.297 38.297 39.154 -0.857 19193 2859 1 9 . 1 1 10 10 ASP H H 10 7.629 7.629 7.469 0.160 19193 2860 1 9 . 1 1 11 11 VAL N N 11 124.080 124.080 123.678 0.402 19193 2861 1 9 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.783 0.027 19193 2862 1 9 . 1 1 11 11 VAL C C 11 174.883 174.883 176.730 -1.847 19193 2863 1 9 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.567 0.321 19193 2864 1 9 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.311 0.609 19193 2865 1 9 . 1 1 11 11 VAL H H 11 7.956 7.956 7.855 0.101 19193 2866 1 9 . 1 1 12 12 ASN N N 12 114.490 114.490 116.654 -2.164 19193 2867 1 9 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.634 0.126 19193 2868 1 9 . 1 1 12 12 ASN C C 12 173.671 173.671 176.506 -2.835 19193 2869 1 9 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.550 -0.932 19193 2870 1 9 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.402 -0.830 19193 2871 1 9 . 1 1 12 12 ASN H H 12 7.630 7.630 7.895 -0.265 19193 2872 1 9 . 1 1 13 13 GLY N N 13 109.255 109.255 109.413 -0.158 19193 2873 1 9 . 1 1 13 13 GLY C C 13 172.031 172.031 174.831 -2.800 19193 2874 1 9 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.376 0.622 19193 2875 1 9 . 1 1 13 13 GLY H H 13 7.643 7.643 7.907 -0.264 19193 2876 1 9 . 1 1 14 14 ASP N N 14 118.441 118.441 118.564 -0.123 19193 2877 1 9 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.630 -0.100 19193 2878 1 9 . 1 1 14 14 ASP C C 14 174.877 174.877 177.316 -2.439 19193 2879 1 9 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.229 -0.356 19193 2880 1 9 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.931 -1.902 19193 2881 1 9 . 1 1 14 14 ASP H H 14 7.956 7.956 7.827 0.129 19193 2882 1 9 . 1 1 15 15 GLY N N 15 118.441 118.441 107.444 10.997 19193 2883 1 9 . 1 1 15 15 GLY C C 15 169.627 169.627 173.219 -3.592 19193 2884 1 9 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.709 0.164 19193 2885 1 9 . 1 1 15 15 GLY H H 15 10.286 10.286 8.760 1.526 19193 2886 1 9 . 1 1 16 16 ALA N N 16 122.512 122.512 121.603 0.909 19193 2887 1 9 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.747 -0.817 19193 2888 1 9 . 1 1 16 16 ALA C C 16 172.696 172.696 176.039 -3.343 19193 2889 1 9 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.683 -0.804 19193 2890 1 9 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.535 -0.397 19193 2891 1 9 . 1 1 16 16 ALA H H 16 7.883 7.883 8.002 -0.119 19193 2892 1 9 . 1 1 17 17 VAL N N 17 124.615 124.615 117.743 6.872 19193 2893 1 9 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.568 0.372 19193 2894 1 9 . 1 1 17 17 VAL C C 17 172.461 172.461 175.115 -2.654 19193 2895 1 9 . 1 1 17 17 VAL CA C 17 60.441 60.441 60.773 -0.332 19193 2896 1 9 . 1 1 17 17 VAL CB C 17 32.536 32.536 33.956 -1.420 19193 2897 1 9 . 1 1 17 17 VAL H H 17 9.373 9.373 8.802 0.571 19193 2898 1 9 . 1 1 18 18 SER N N 18 125.090 125.090 122.620 2.470 19193 2899 1 9 . 1 1 18 18 SER HA H 18 4.970 4.970 5.165 -0.195 19193 2900 1 9 . 1 1 18 18 SER C C 18 172.145 172.145 176.201 -4.056 19193 2901 1 9 . 1 1 18 18 SER CA C 18 55.641 55.641 57.522 -1.881 19193 2902 1 9 . 1 1 18 18 SER CB C 18 66.313 66.313 64.906 1.407 19193 2903 1 9 . 1 1 18 18 SER H H 18 8.885 8.885 8.600 0.285 19193 2904 1 9 . 1 1 19 19 TYR N N 19 123.319 123.319 120.054 3.265 19193 2905 1 9 . 1 1 19 19 TYR HA H 19 4.960 4.960 4.037 0.923 19193 2906 1 9 . 1 1 19 19 TYR C C 19 174.218 174.218 177.373 -3.155 19193 2907 1 9 . 1 1 19 19 TYR CA C 19 62.398 62.398 61.134 1.264 19193 2908 1 9 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.829 0.030 19193 2909 1 9 . 1 1 19 19 TYR H H 19 9.180 9.180 8.124 1.056 19193 2910 1 9 . 1 1 20 20 GLU N N 20 117.323 117.323 119.308 -1.985 19193 2911 1 9 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.775 1.005 19193 2912 1 9 . 1 1 20 20 GLU C C 20 177.285 177.285 178.953 -1.668 19193 2913 1 9 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.668 0.102 19193 2914 1 9 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.457 0.008 19193 2915 1 9 . 1 1 20 20 GLU H H 20 8.520 8.520 7.537 0.983 19193 2916 1 9 . 1 1 21 21 GLU N N 21 120.067 120.067 118.673 1.394 19193 2917 1 9 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.917 0.863 19193 2918 1 9 . 1 1 21 21 GLU C C 21 177.617 177.617 179.071 -1.454 19193 2919 1 9 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.619 -0.718 19193 2920 1 9 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.147 -1.249 19193 2921 1 9 . 1 1 21 21 GLU H H 21 7.738 7.738 7.428 0.310 19193 2922 1 9 . 1 1 22 22 VAL N N 22 122.931 122.931 120.169 2.762 19193 2923 1 9 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.845 -0.345 19193 2924 1 9 . 1 1 22 22 VAL C C 22 173.899 173.899 178.132 -4.233 19193 2925 1 9 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.890 0.640 19193 2926 1 9 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.226 -0.445 19193 2927 1 9 . 1 1 22 22 VAL H H 22 8.110 8.110 8.284 -0.174 19193 2928 1 9 . 1 1 23 23 LYS N N 23 120.609 120.609 118.481 2.128 19193 2929 1 9 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.977 -0.477 19193 2930 1 9 . 1 1 23 23 LYS C C 23 175.965 175.965 179.342 -3.377 19193 2931 1 9 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.746 0.409 19193 2932 1 9 . 1 1 23 23 LYS CB C 23 31.640 31.640 32.011 -0.371 19193 2933 1 9 . 1 1 23 23 LYS H H 23 8.613 8.613 7.930 0.683 19193 2934 1 9 . 1 1 24 24 ALA N N 24 121.619 121.619 122.501 -0.882 19193 2935 1 9 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.146 -0.126 19193 2936 1 9 . 1 1 24 24 ALA C C 24 176.843 176.843 179.656 -2.813 19193 2937 1 9 . 1 1 24 24 ALA CA C 24 54.755 54.755 54.969 -0.214 19193 2938 1 9 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.100 -0.016 19193 2939 1 9 . 1 1 24 24 ALA H H 24 8.038 8.038 7.894 0.144 19193 2940 1 9 . 1 1 25 25 PHE N N 25 118.380 118.380 119.374 -0.994 19193 2941 1 9 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.169 0.051 19193 2942 1 9 . 1 1 25 25 PHE C C 25 174.657 174.657 178.325 -3.668 19193 2943 1 9 . 1 1 25 25 PHE CA C 25 61.143 61.143 60.065 1.078 19193 2944 1 9 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.832 0.734 19193 2945 1 9 . 1 1 25 25 PHE H H 25 7.668 7.668 8.061 -0.393 19193 2946 1 9 . 1 1 26 26 VAL N N 26 117.975 117.975 118.818 -0.843 19193 2947 1 9 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.755 -0.575 19193 2948 1 9 . 1 1 26 26 VAL C C 26 175.212 175.212 177.930 -2.718 19193 2949 1 9 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.660 0.879 19193 2950 1 9 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.894 -0.488 19193 2951 1 9 . 1 1 26 26 VAL H H 26 8.667 8.667 7.896 0.771 19193 2952 1 9 . 1 1 27 27 SER N N 27 112.988 112.988 114.727 -1.739 19193 2953 1 9 . 1 1 27 27 SER HA H 27 4.900 4.900 4.510 0.390 19193 2954 1 9 . 1 1 27 27 SER C C 27 172.256 172.256 174.754 -2.498 19193 2955 1 9 . 1 1 27 27 SER CA C 27 60.403 60.403 60.849 -0.446 19193 2956 1 9 . 1 1 27 27 SER CB C 27 63.131 63.131 63.188 -0.057 19193 2957 1 9 . 1 1 27 27 SER H H 27 8.138 8.138 7.730 0.408 19193 2958 1 9 . 1 1 28 28 LYS N N 28 119.278 119.278 118.450 0.828 19193 2959 1 9 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.200 -0.140 19193 2960 1 9 . 1 1 28 28 LYS C C 28 174.753 174.753 177.282 -2.529 19193 2961 1 9 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.346 0.553 19193 2962 1 9 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.410 -0.187 19193 2963 1 9 . 1 1 28 28 LYS H H 28 7.077 7.077 7.415 -0.338 19193 2964 1 9 . 1 1 29 29 LYS N N 29 116.136 116.136 117.457 -1.321 19193 2965 1 9 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.418 -0.158 19193 2966 1 9 . 1 1 29 29 LYS C C 29 173.137 173.137 176.862 -3.725 19193 2967 1 9 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.904 -1.897 19193 2968 1 9 . 1 1 29 29 LYS CB C 29 33.689 33.689 33.869 -0.180 19193 2969 1 9 . 1 1 29 29 LYS H H 29 7.452 7.452 7.899 -0.447 19193 2970 1 9 . 1 1 30 30 ARG N N 30 116.823 116.823 117.048 -0.225 19193 2971 1 9 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.527 -0.057 19193 2972 1 9 . 1 1 30 30 ARG C C 30 169.632 169.632 173.858 -4.226 19193 2973 1 9 . 1 1 30 30 ARG CA C 30 54.380 54.380 54.343 0.037 19193 2974 1 9 . 1 1 30 30 ARG CB C 30 31.072 31.072 30.567 0.506 19193 2975 1 9 . 1 1 30 30 ARG H H 30 8.079 8.079 7.703 0.376 19193 2976 1 9 . 1 1 31 31 ALA N N 31 121.111 121.111 122.820 -1.709 19193 2977 1 9 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.709 -0.249 19193 2978 1 9 . 1 1 31 31 ALA C C 31 175.120 175.120 176.289 -1.169 19193 2979 1 9 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.499 -0.502 19193 2980 1 9 . 1 1 31 31 ALA CB C 31 18.095 18.095 19.437 -1.342 19193 2981 1 9 . 1 1 31 31 ALA H H 31 7.929 7.929 8.330 -0.401 19193 2982 1 9 . 1 1 32 32 ILE N N 32 123.829 123.829 125.217 -1.388 19193 2983 1 9 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.387 0.003 19193 2984 1 9 . 1 1 32 32 ILE C C 32 173.398 173.398 174.750 -1.352 19193 2985 1 9 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.017 1.014 19193 2986 1 9 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.226 -2.061 19193 2987 1 9 . 1 1 32 32 ILE H H 32 8.552 8.552 8.491 0.061 19193 2988 1 9 . 1 1 33 33 LYS N N 33 130.536 130.536 128.540 1.996 19193 2989 1 9 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.366 -0.346 19193 2990 1 9 . 1 1 33 33 LYS C C 33 174.009 174.009 175.507 -1.498 19193 2991 1 9 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.429 0.212 19193 2992 1 9 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.392 5.018 19193 2993 1 9 . 1 1 33 33 LYS H H 33 9.444 9.444 8.575 0.869 19193 2994 1 9 . 1 1 34 34 ASN N N 34 120.119 120.119 124.832 -4.713 19193 2995 1 9 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.972 -0.192 19193 2996 1 9 . 1 1 34 34 ASN C C 34 171.824 171.824 175.166 -3.342 19193 2997 1 9 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.274 -1.271 19193 2998 1 9 . 1 1 34 34 ASN CB C 34 38.288 38.288 40.070 -1.782 19193 2999 1 9 . 1 1 34 34 ASN H H 34 8.724 8.724 8.617 0.107 19193 3000 1 9 . 1 1 35 35 GLU N N 35 124.613 124.613 124.320 0.293 19193 3001 1 9 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.057 0.233 19193 3002 1 9 . 1 1 35 35 GLU C C 35 174.770 174.770 177.599 -2.829 19193 3003 1 9 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.916 -0.609 19193 3004 1 9 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.723 -0.967 19193 3005 1 9 . 1 1 35 35 GLU H H 35 8.860 8.860 8.877 -0.017 19193 3006 1 9 . 1 1 36 36 GLN N N 36 118.117 118.117 120.101 -1.984 19193 3007 1 9 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.170 0.610 19193 3008 1 9 . 1 1 36 36 GLN C C 36 176.083 176.083 178.579 -2.496 19193 3009 1 9 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.699 0.442 19193 3010 1 9 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.552 -0.956 19193 3011 1 9 . 1 1 36 36 GLN H H 36 8.346 8.346 8.346 0.000 19193 3012 1 9 . 1 1 37 37 LEU N N 37 119.945 119.945 121.134 -1.189 19193 3013 1 9 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.134 -0.034 19193 3014 1 9 . 1 1 37 37 LEU C C 37 175.096 175.096 178.652 -3.556 19193 3015 1 9 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.841 -0.454 19193 3016 1 9 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.428 -0.225 19193 3017 1 9 . 1 1 37 37 LEU H H 37 7.469 7.469 8.195 -0.726 19193 3018 1 9 . 1 1 38 38 LEU N N 38 119.102 119.102 119.393 -0.291 19193 3019 1 9 . 1 1 38 38 LEU HA H 38 4.130 4.130 4.001 0.129 19193 3020 1 9 . 1 1 38 38 LEU C C 38 175.531 175.531 178.954 -3.423 19193 3021 1 9 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.496 -0.623 19193 3022 1 9 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.054 -0.189 19193 3023 1 9 . 1 1 38 38 LEU H H 38 7.110 7.110 7.774 -0.664 19193 3024 1 9 . 1 1 39 39 GLN N N 39 118.022 118.022 118.758 -0.736 19193 3025 1 9 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.108 -0.178 19193 3026 1 9 . 1 1 39 39 GLN C C 39 175.315 175.315 178.966 -3.651 19193 3027 1 9 . 1 1 39 39 GLN CA C 39 59.511 59.511 58.799 0.712 19193 3028 1 9 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.468 -0.574 19193 3029 1 9 . 1 1 39 39 GLN H H 39 8.579 8.579 7.692 0.887 19193 3030 1 9 . 1 1 40 40 LEU N N 40 120.372 120.372 121.263 -0.891 19193 3031 1 9 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.034 -0.094 19193 3032 1 9 . 1 1 40 40 LEU C C 40 176.514 176.514 179.131 -2.617 19193 3033 1 9 . 1 1 40 40 LEU CA C 40 57.627 57.627 57.989 -0.362 19193 3034 1 9 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.213 -0.165 19193 3035 1 9 . 1 1 40 40 LEU H H 40 7.890 7.890 8.283 -0.393 19193 3036 1 9 . 1 1 41 41 ILE N N 41 120.723 120.723 119.646 1.077 19193 3037 1 9 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.674 0.466 19193 3038 1 9 . 1 1 41 41 ILE C C 41 174.220 174.220 177.654 -3.434 19193 3039 1 9 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.902 1.117 19193 3040 1 9 . 1 1 41 41 ILE CB C 41 38.279 38.279 37.987 0.292 19193 3041 1 9 . 1 1 41 41 ILE H H 41 8.106 8.106 8.574 -0.468 19193 3042 1 9 . 1 1 42 42 PHE N N 42 119.850 119.850 121.805 -1.955 19193 3043 1 9 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.102 0.678 19193 3044 1 9 . 1 1 42 42 PHE C C 42 173.670 173.670 177.005 -3.335 19193 3045 1 9 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.758 1.138 19193 3046 1 9 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.765 1.253 19193 3047 1 9 . 1 1 42 42 PHE H H 42 8.695 8.695 8.338 0.357 19193 3048 1 9 . 1 1 43 43 LYS N N 43 115.976 115.976 117.322 -1.346 19193 3049 1 9 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.648 0.372 19193 3050 1 9 . 1 1 43 43 LYS C C 43 175.313 175.313 177.777 -2.464 19193 3051 1 9 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.703 0.187 19193 3052 1 9 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.435 0.084 19193 3053 1 9 . 1 1 43 43 LYS H H 43 8.405 8.405 7.778 0.627 19193 3054 1 9 . 1 1 44 44 SER N N 44 112.481 112.481 113.897 -1.416 19193 3055 1 9 . 1 1 44 44 SER HA H 44 4.100 4.100 4.170 -0.070 19193 3056 1 9 . 1 1 44 44 SER C C 44 172.469 172.469 175.723 -3.254 19193 3057 1 9 . 1 1 44 44 SER CA C 44 61.017 61.017 61.248 -0.231 19193 3058 1 9 . 1 1 44 44 SER CB C 44 63.450 63.450 63.632 -0.182 19193 3059 1 9 . 1 1 44 44 SER H H 44 7.492 7.492 7.681 -0.189 19193 3060 1 9 . 1 1 45 45 ILE N N 45 120.793 120.793 118.128 2.665 19193 3061 1 9 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.170 1.390 19193 3062 1 9 . 1 1 45 45 ILE C C 45 174.535 174.535 175.570 -1.035 19193 3063 1 9 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.095 -0.320 19193 3064 1 9 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.194 -0.215 19193 3065 1 9 . 1 1 45 45 ILE H H 45 7.407 7.407 7.733 -0.326 19193 3066 1 9 . 1 1 46 46 ASP N N 46 118.226 118.226 119.358 -1.132 19193 3067 1 9 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.476 -0.076 19193 3068 1 9 . 1 1 46 46 ASP C C 46 173.226 173.226 175.753 -2.527 19193 3069 1 9 . 1 1 46 46 ASP CA C 46 52.245 52.245 53.448 -1.203 19193 3070 1 9 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.583 -3.550 19193 3071 1 9 . 1 1 46 46 ASP H H 46 7.343 7.343 7.425 -0.082 19193 3072 1 9 . 1 1 47 47 ALA N N 47 130.084 130.084 128.500 1.584 19193 3073 1 9 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.967 0.423 19193 3074 1 9 . 1 1 47 47 ALA C C 47 176.299 176.299 177.886 -1.587 19193 3075 1 9 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.348 0.218 19193 3076 1 9 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.305 -0.085 19193 3077 1 9 . 1 1 47 47 ALA H H 47 7.742 7.742 8.510 -0.768 19193 3078 1 9 . 1 1 48 48 ASP N N 48 113.283 113.283 113.543 -0.260 19193 3079 1 9 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.624 -0.024 19193 3080 1 9 . 1 1 48 48 ASP C C 48 175.111 175.111 177.009 -1.898 19193 3081 1 9 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.247 -0.737 19193 3082 1 9 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.133 -1.694 19193 3083 1 9 . 1 1 48 48 ASP H H 48 8.038 8.038 7.824 0.214 19193 3084 1 9 . 1 1 49 49 GLY C C 49 172.256 172.256 174.697 -2.441 19193 3085 1 9 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.706 1.028 19193 3086 1 9 . 1 1 49 49 GLY H H 49 7.775 7.775 7.897 -0.122 19193 3087 1 9 . 1 1 50 50 ASN N N 50 119.017 119.017 118.800 0.217 19193 3088 1 9 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.636 -0.006 19193 3089 1 9 . 1 1 50 50 ASN C C 50 173.670 173.670 176.713 -3.043 19193 3090 1 9 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.166 1.210 19193 3091 1 9 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.810 0.602 19193 3092 1 9 . 1 1 50 50 ASN H H 50 8.155 8.155 7.921 0.234 19193 3093 1 9 . 1 1 51 51 GLY C C 51 169.963 169.963 173.642 -3.679 19193 3094 1 9 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.263 -2.026 19193 3095 1 9 . 1 1 51 51 GLY H H 51 10.668 10.668 8.763 1.905 19193 3096 1 9 . 1 1 52 52 GLU N N 52 116.254 116.254 119.025 -2.771 19193 3097 1 9 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.111 -0.151 19193 3098 1 9 . 1 1 52 52 GLU C C 52 171.378 171.378 175.311 -3.933 19193 3099 1 9 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.234 -0.928 19193 3100 1 9 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.360 0.721 19193 3101 1 9 . 1 1 52 52 GLU H H 52 7.579 7.579 8.314 -0.735 19193 3102 1 9 . 1 1 53 53 ILE N N 53 126.770 126.770 121.940 4.830 19193 3103 1 9 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.983 -0.003 19193 3104 1 9 . 1 1 53 53 ILE C C 53 172.922 172.922 176.469 -3.547 19193 3105 1 9 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.129 -1.483 19193 3106 1 9 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.871 -0.854 19193 3107 1 9 . 1 1 53 53 ILE H H 53 9.661 9.661 9.122 0.539 19193 3108 1 9 . 1 1 54 54 ASP N N 54 128.225 128.225 127.270 0.955 19193 3109 1 9 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.228 -0.318 19193 3110 1 9 . 1 1 54 54 ASP C C 54 173.562 173.562 178.117 -4.555 19193 3111 1 9 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.514 -1.622 19193 3112 1 9 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.636 0.264 19193 3113 1 9 . 1 1 54 54 ASP H H 54 8.771 8.771 9.353 -0.582 19193 3114 1 9 . 1 1 55 55 GLN N N 55 116.090 116.090 120.628 -4.538 19193 3115 1 9 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.548 0.792 19193 3116 1 9 . 1 1 55 55 GLN C C 55 175.643 175.643 177.456 -1.813 19193 3117 1 9 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.424 0.221 19193 3118 1 9 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.171 -0.274 19193 3119 1 9 . 1 1 55 55 GLN H H 55 8.563 8.563 8.480 0.083 19193 3120 1 9 . 1 1 56 56 ASN N N 56 119.830 119.830 119.573 0.257 19193 3121 1 9 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.245 0.525 19193 3122 1 9 . 1 1 56 56 ASN C C 56 178.242 178.242 177.456 0.786 19193 3123 1 9 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.487 -0.600 19193 3124 1 9 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.839 0.424 19193 3125 1 9 . 1 1 56 56 ASN H H 56 8.205 8.205 8.628 -0.423 19193 3126 1 9 . 1 1 57 57 GLU N N 57 123.242 123.242 120.195 3.047 19193 3127 1 9 . 1 1 57 57 GLU HA H 57 4.010 4.010 4.005 0.005 19193 3128 1 9 . 1 1 57 57 GLU C C 57 177.498 177.498 179.174 -1.676 19193 3129 1 9 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.354 -0.714 19193 3130 1 9 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.388 0.236 19193 3131 1 9 . 1 1 57 57 GLU H H 57 9.079 9.079 8.135 0.944 19193 3132 1 9 . 1 1 58 58 PHE N N 58 119.057 119.057 120.698 -1.641 19193 3133 1 9 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.381 -0.351 19193 3134 1 9 . 1 1 58 58 PHE C C 58 173.784 173.784 177.336 -3.552 19193 3135 1 9 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.492 0.252 19193 3136 1 9 . 1 1 58 58 PHE CB C 58 39.581 39.581 39.108 0.473 19193 3137 1 9 . 1 1 58 58 PHE H H 58 8.795 8.795 8.181 0.614 19193 3138 1 9 . 1 1 59 59 ALA N N 59 120.919 120.919 121.764 -0.845 19193 3139 1 9 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.060 -0.100 19193 3140 1 9 . 1 1 59 59 ALA C C 59 177.602 177.602 179.280 -1.678 19193 3141 1 9 . 1 1 59 59 ALA CA C 59 54.928 54.928 54.943 -0.015 19193 3142 1 9 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.275 -0.484 19193 3143 1 9 . 1 1 59 59 ALA H H 59 8.158 8.158 8.164 -0.006 19193 3144 1 9 . 1 1 60 60 LYS N N 60 116.767 116.767 116.949 -0.182 19193 3145 1 9 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.072 -0.022 19193 3146 1 9 . 1 1 60 60 LYS C C 60 175.309 175.309 178.277 -2.968 19193 3147 1 9 . 1 1 60 60 LYS CA C 60 58.274 58.274 58.337 -0.063 19193 3148 1 9 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.641 -0.419 19193 3149 1 9 . 1 1 60 60 LYS H H 60 7.554 7.554 7.891 -0.337 19193 3150 1 9 . 1 1 61 61 PHE N N 61 118.086 118.086 120.485 -2.399 19193 3151 1 9 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.319 0.171 19193 3152 1 9 . 1 1 61 61 PHE C C 61 173.559 173.559 175.264 -1.705 19193 3153 1 9 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.543 0.978 19193 3154 1 9 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.960 0.079 19193 3155 1 9 . 1 1 61 61 PHE H H 61 7.231 7.231 7.717 -0.486 19193 3156 1 9 . 1 1 62 62 TYR N N 62 120.802 120.802 122.468 -1.666 19193 3157 1 9 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.636 0.834 19193 3158 1 9 . 1 1 62 62 TYR C C 62 173.559 173.559 175.494 -1.935 19193 3159 1 9 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.597 1.291 19193 3160 1 9 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.857 0.417 19193 3161 1 9 . 1 1 62 62 TYR H H 62 8.301 8.301 7.849 0.452 19193 3162 1 9 . 1 1 63 63 GLY N N 63 132.741 132.741 115.970 16.771 19193 3163 1 9 . 1 1 63 63 GLY C C 63 172.799 172.799 174.733 -1.934 19193 3164 1 9 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.868 1.384 19193 3165 1 9 . 1 1 63 63 GLY H H 63 8.293 8.293 7.864 0.429 19193 3166 1 9 . 1 1 64 64 SER N N 64 115.064 115.064 115.344 -0.280 19193 3167 1 9 . 1 1 64 64 SER HA H 64 4.780 4.780 4.574 0.206 19193 3168 1 9 . 1 1 64 64 SER C C 64 170.939 170.939 175.228 -4.289 19193 3169 1 9 . 1 1 64 64 SER CA C 64 60.525 60.525 57.842 2.683 19193 3170 1 9 . 1 1 64 64 SER CB C 64 63.430 63.430 63.328 0.102 19193 3171 1 9 . 1 1 64 64 SER H H 64 7.833 7.833 7.702 0.131 19193 3172 1 9 . 1 1 65 65 ILE N N 65 112.928 112.928 120.675 -7.747 19193 3173 1 9 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.180 0.080 19193 3174 1 9 . 1 1 65 65 ILE C C 65 175.695 175.695 176.156 -0.461 19193 3175 1 9 . 1 1 65 65 ILE CA C 65 59.752 59.752 61.038 -1.286 19193 3176 1 9 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.441 2.281 19193 3177 1 9 . 1 1 65 65 ILE H H 65 6.935 6.935 7.744 -0.809 19193 3178 1 10 . 1 1 5 5 LEU N N 5 120.669 120.669 117.727 2.942 19193 3179 1 10 . 1 1 5 5 LEU HA H 5 4.210 4.210 4.003 0.207 19193 3180 1 10 . 1 1 5 5 LEU CA C 5 58.825 58.825 57.205 1.620 19193 3181 1 10 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.240 1.025 19193 3182 1 10 . 1 1 5 5 LEU H H 5 7.998 7.998 7.981 0.017 19193 3183 1 10 . 1 1 6 6 PHE N N 6 117.996 117.996 120.045 -2.049 19193 3184 1 10 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.775 0.085 19193 3185 1 10 . 1 1 6 6 PHE C C 6 175.520 175.520 176.731 -1.211 19193 3186 1 10 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.145 2.069 19193 3187 1 10 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.554 0.464 19193 3188 1 10 . 1 1 6 6 PHE H H 6 7.276 7.276 7.991 -0.715 19193 3189 1 10 . 1 1 7 7 LYS N N 7 114.616 114.616 117.184 -2.568 19193 3190 1 10 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.805 0.156 19193 3191 1 10 . 1 1 7 7 LYS C C 7 175.105 175.105 177.899 -2.794 19193 3192 1 10 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.873 -0.103 19193 3193 1 10 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.205 0.032 19193 3194 1 10 . 1 1 7 7 LYS H H 7 7.523 7.523 7.520 0.003 19193 3195 1 10 . 1 1 8 8 GLU N N 8 117.996 117.996 118.919 -0.923 19193 3196 1 10 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.010 -0.150 19193 3197 1 10 . 1 1 8 8 GLU C C 8 174.994 174.994 178.238 -3.244 19193 3198 1 10 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.643 -0.384 19193 3199 1 10 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.980 -0.677 19193 3200 1 10 . 1 1 8 8 GLU H H 8 7.276 7.276 7.649 -0.373 19193 3201 1 10 . 1 1 9 9 ILE N N 9 117.880 117.880 116.173 1.707 19193 3202 1 10 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.725 -0.283 19193 3203 1 10 . 1 1 9 9 ILE C C 9 177.620 177.620 176.612 1.008 19193 3204 1 10 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.061 1.350 19193 3205 1 10 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.890 0.821 19193 3206 1 10 . 1 1 9 9 ILE H H 9 7.166 7.166 7.448 -0.282 19193 3207 1 10 . 1 1 10 10 ASP N N 10 119.154 119.154 121.751 -2.597 19193 3208 1 10 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.494 -0.642 19193 3209 1 10 . 1 1 10 10 ASP C C 10 174.446 174.446 177.250 -2.804 19193 3210 1 10 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.527 -1.140 19193 3211 1 10 . 1 1 10 10 ASP CB C 10 38.297 38.297 38.583 -0.286 19193 3212 1 10 . 1 1 10 10 ASP H H 10 7.629 7.629 7.416 0.213 19193 3213 1 10 . 1 1 11 11 VAL N N 11 124.080 124.080 122.948 1.132 19193 3214 1 10 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.672 0.138 19193 3215 1 10 . 1 1 11 11 VAL C C 11 174.883 174.883 176.481 -1.598 19193 3216 1 10 . 1 1 11 11 VAL CA C 11 64.888 64.888 65.145 -0.257 19193 3217 1 10 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.700 0.220 19193 3218 1 10 . 1 1 11 11 VAL H H 11 7.956 7.956 7.823 0.133 19193 3219 1 10 . 1 1 12 12 ASN N N 12 114.490 114.490 116.431 -1.941 19193 3220 1 10 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.625 0.135 19193 3221 1 10 . 1 1 12 12 ASN C C 12 173.671 173.671 176.480 -2.809 19193 3222 1 10 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.444 -0.826 19193 3223 1 10 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.057 -0.485 19193 3224 1 10 . 1 1 12 12 ASN H H 12 7.630 7.630 7.750 -0.120 19193 3225 1 10 . 1 1 13 13 GLY N N 13 109.255 109.255 108.827 0.428 19193 3226 1 10 . 1 1 13 13 GLY C C 13 172.031 172.031 174.796 -2.765 19193 3227 1 10 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.573 0.425 19193 3228 1 10 . 1 1 13 13 GLY H H 13 7.643 7.643 8.078 -0.435 19193 3229 1 10 . 1 1 14 14 ASP N N 14 118.441 118.441 119.035 -0.594 19193 3230 1 10 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.639 -0.109 19193 3231 1 10 . 1 1 14 14 ASP C C 14 174.877 174.877 177.515 -2.638 19193 3232 1 10 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.101 -0.228 19193 3233 1 10 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.361 -1.332 19193 3234 1 10 . 1 1 14 14 ASP H H 14 7.956 7.956 7.774 0.182 19193 3235 1 10 . 1 1 15 15 GLY N N 15 118.441 118.441 107.551 10.890 19193 3236 1 10 . 1 1 15 15 GLY C C 15 169.627 169.627 173.215 -3.588 19193 3237 1 10 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.733 0.140 19193 3238 1 10 . 1 1 15 15 GLY H H 15 10.286 10.286 8.771 1.515 19193 3239 1 10 . 1 1 16 16 ALA N N 16 122.512 122.512 121.381 1.131 19193 3240 1 10 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.561 -0.631 19193 3241 1 10 . 1 1 16 16 ALA C C 16 172.696 172.696 175.970 -3.274 19193 3242 1 10 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.933 -1.054 19193 3243 1 10 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.532 -0.394 19193 3244 1 10 . 1 1 16 16 ALA H H 16 7.883 7.883 7.964 -0.081 19193 3245 1 10 . 1 1 17 17 VAL N N 17 124.615 124.615 123.918 0.697 19193 3246 1 10 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.586 0.354 19193 3247 1 10 . 1 1 17 17 VAL C C 17 172.461 172.461 175.629 -3.168 19193 3248 1 10 . 1 1 17 17 VAL CA C 17 60.441 60.441 60.376 0.065 19193 3249 1 10 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.221 -1.685 19193 3250 1 10 . 1 1 17 17 VAL H H 17 9.373 9.373 8.861 0.512 19193 3251 1 10 . 1 1 18 18 SER N N 18 125.090 125.090 123.568 1.522 19193 3252 1 10 . 1 1 18 18 SER HA H 18 4.970 4.970 5.278 -0.308 19193 3253 1 10 . 1 1 18 18 SER C C 18 172.145 172.145 176.322 -4.177 19193 3254 1 10 . 1 1 18 18 SER CA C 18 55.641 55.641 57.973 -2.332 19193 3255 1 10 . 1 1 18 18 SER CB C 18 66.313 66.313 65.193 1.120 19193 3256 1 10 . 1 1 18 18 SER H H 18 8.885 8.885 8.202 0.683 19193 3257 1 10 . 1 1 19 19 TYR N N 19 123.319 123.319 120.135 3.184 19193 3258 1 10 . 1 1 19 19 TYR HA H 19 4.960 4.960 4.147 0.813 19193 3259 1 10 . 1 1 19 19 TYR C C 19 174.218 174.218 177.458 -3.240 19193 3260 1 10 . 1 1 19 19 TYR CA C 19 62.398 62.398 60.988 1.410 19193 3261 1 10 . 1 1 19 19 TYR CB C 19 36.859 36.859 37.046 -0.187 19193 3262 1 10 . 1 1 19 19 TYR H H 19 9.180 9.180 8.284 0.896 19193 3263 1 10 . 1 1 20 20 GLU N N 20 117.323 117.323 119.297 -1.974 19193 3264 1 10 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.694 1.086 19193 3265 1 10 . 1 1 20 20 GLU C C 20 177.285 177.285 178.748 -1.463 19193 3266 1 10 . 1 1 20 20 GLU CA C 20 59.770 59.770 58.993 0.777 19193 3267 1 10 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.108 0.357 19193 3268 1 10 . 1 1 20 20 GLU H H 20 8.520 8.520 7.634 0.886 19193 3269 1 10 . 1 1 21 21 GLU N N 21 120.067 120.067 120.324 -0.257 19193 3270 1 10 . 1 1 21 21 GLU HA H 21 4.780 4.780 4.005 0.775 19193 3271 1 10 . 1 1 21 21 GLU C C 21 177.617 177.617 179.261 -1.644 19193 3272 1 10 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.568 -0.667 19193 3273 1 10 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.425 -1.528 19193 3274 1 10 . 1 1 21 21 GLU H H 21 7.738 7.738 7.784 -0.046 19193 3275 1 10 . 1 1 22 22 VAL N N 22 122.931 122.931 120.672 2.259 19193 3276 1 10 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.845 -0.345 19193 3277 1 10 . 1 1 22 22 VAL C C 22 173.899 173.899 177.432 -3.533 19193 3278 1 10 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.384 1.146 19193 3279 1 10 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.955 -1.174 19193 3280 1 10 . 1 1 22 22 VAL H H 22 8.110 8.110 8.629 -0.519 19193 3281 1 10 . 1 1 23 23 LYS N N 23 120.609 120.609 119.852 0.757 19193 3282 1 10 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.981 -0.481 19193 3283 1 10 . 1 1 23 23 LYS C C 23 175.965 175.965 179.040 -3.075 19193 3284 1 10 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.239 0.916 19193 3285 1 10 . 1 1 23 23 LYS CB C 23 31.640 31.640 32.071 -0.431 19193 3286 1 10 . 1 1 23 23 LYS H H 23 8.613 8.613 7.683 0.930 19193 3287 1 10 . 1 1 24 24 ALA N N 24 121.619 121.619 122.015 -0.396 19193 3288 1 10 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.035 -0.015 19193 3289 1 10 . 1 1 24 24 ALA C C 24 176.843 176.843 179.074 -2.231 19193 3290 1 10 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.076 -0.321 19193 3291 1 10 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.280 -0.196 19193 3292 1 10 . 1 1 24 24 ALA H H 24 8.038 8.038 7.998 0.040 19193 3293 1 10 . 1 1 25 25 PHE N N 25 118.380 118.380 119.535 -1.155 19193 3294 1 10 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.173 0.047 19193 3295 1 10 . 1 1 25 25 PHE C C 25 174.657 174.657 178.190 -3.533 19193 3296 1 10 . 1 1 25 25 PHE CA C 25 61.143 61.143 59.610 1.533 19193 3297 1 10 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.681 0.886 19193 3298 1 10 . 1 1 25 25 PHE H H 25 7.668 7.668 8.126 -0.458 19193 3299 1 10 . 1 1 26 26 VAL N N 26 117.975 117.975 119.011 -1.036 19193 3300 1 10 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.560 -0.380 19193 3301 1 10 . 1 1 26 26 VAL C C 26 175.212 175.212 178.096 -2.884 19193 3302 1 10 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.493 1.046 19193 3303 1 10 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.891 -0.485 19193 3304 1 10 . 1 1 26 26 VAL H H 26 8.667 8.667 7.793 0.874 19193 3305 1 10 . 1 1 27 27 SER N N 27 112.988 112.988 115.675 -2.687 19193 3306 1 10 . 1 1 27 27 SER HA H 27 4.900 4.900 4.400 0.500 19193 3307 1 10 . 1 1 27 27 SER C C 27 172.256 172.256 175.234 -2.978 19193 3308 1 10 . 1 1 27 27 SER CA C 27 60.403 60.403 60.958 -0.555 19193 3309 1 10 . 1 1 27 27 SER CB C 27 63.131 63.131 62.980 0.151 19193 3310 1 10 . 1 1 27 27 SER H H 27 8.138 8.138 7.645 0.493 19193 3311 1 10 . 1 1 28 28 LYS N N 28 119.278 119.278 117.343 1.935 19193 3312 1 10 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.224 -0.164 19193 3313 1 10 . 1 1 28 28 LYS C C 28 174.753 174.753 177.527 -2.774 19193 3314 1 10 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.136 0.763 19193 3315 1 10 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.503 -0.280 19193 3316 1 10 . 1 1 28 28 LYS H H 28 7.077 7.077 7.486 -0.409 19193 3317 1 10 . 1 1 29 29 LYS N N 29 116.136 116.136 117.086 -0.950 19193 3318 1 10 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.367 -0.107 19193 3319 1 10 . 1 1 29 29 LYS C C 29 173.137 173.137 176.509 -3.372 19193 3320 1 10 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.502 -1.494 19193 3321 1 10 . 1 1 29 29 LYS CB C 29 33.689 33.689 33.726 -0.037 19193 3322 1 10 . 1 1 29 29 LYS H H 29 7.452 7.452 7.800 -0.348 19193 3323 1 10 . 1 1 30 30 ARG N N 30 116.823 116.823 116.686 0.137 19193 3324 1 10 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.385 0.085 19193 3325 1 10 . 1 1 30 30 ARG C C 30 169.632 169.632 173.657 -4.025 19193 3326 1 10 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.366 -0.986 19193 3327 1 10 . 1 1 30 30 ARG CB C 30 31.072 31.072 30.687 0.385 19193 3328 1 10 . 1 1 30 30 ARG H H 30 8.079 8.079 7.391 0.688 19193 3329 1 10 . 1 1 31 31 ALA N N 31 121.111 121.111 122.588 -1.477 19193 3330 1 10 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.712 -0.252 19193 3331 1 10 . 1 1 31 31 ALA C C 31 175.120 175.120 176.603 -1.483 19193 3332 1 10 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.402 -0.405 19193 3333 1 10 . 1 1 31 31 ALA CB C 31 18.095 18.095 19.268 -1.173 19193 3334 1 10 . 1 1 31 31 ALA H H 31 7.929 7.929 8.328 -0.399 19193 3335 1 10 . 1 1 32 32 ILE N N 32 123.829 123.829 123.560 0.269 19193 3336 1 10 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.304 0.086 19193 3337 1 10 . 1 1 32 32 ILE C C 32 173.398 173.398 174.620 -1.222 19193 3338 1 10 . 1 1 32 32 ILE CA C 32 61.031 61.031 61.342 -0.311 19193 3339 1 10 . 1 1 32 32 ILE CB C 32 37.165 37.165 40.066 -2.901 19193 3340 1 10 . 1 1 32 32 ILE H H 32 8.552 8.552 8.351 0.201 19193 3341 1 10 . 1 1 33 33 LYS N N 33 130.536 130.536 129.470 1.066 19193 3342 1 10 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.466 -0.446 19193 3343 1 10 . 1 1 33 33 LYS C C 33 174.009 174.009 175.664 -1.655 19193 3344 1 10 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.181 0.460 19193 3345 1 10 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.311 5.099 19193 3346 1 10 . 1 1 33 33 LYS H H 33 9.444 9.444 8.480 0.964 19193 3347 1 10 . 1 1 34 34 ASN N N 34 120.119 120.119 124.973 -4.854 19193 3348 1 10 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.900 -0.120 19193 3349 1 10 . 1 1 34 34 ASN C C 34 171.824 171.824 175.254 -3.430 19193 3350 1 10 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.952 -1.949 19193 3351 1 10 . 1 1 34 34 ASN CB C 34 38.288 38.288 40.162 -1.874 19193 3352 1 10 . 1 1 34 34 ASN H H 34 8.724 8.724 8.680 0.044 19193 3353 1 10 . 1 1 35 35 GLU N N 35 124.613 124.613 124.655 -0.042 19193 3354 1 10 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.061 0.229 19193 3355 1 10 . 1 1 35 35 GLU C C 35 174.770 174.770 177.345 -2.575 19193 3356 1 10 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.652 -0.345 19193 3357 1 10 . 1 1 35 35 GLU CB C 35 28.756 28.756 30.044 -1.288 19193 3358 1 10 . 1 1 35 35 GLU H H 35 8.860 8.860 8.823 0.037 19193 3359 1 10 . 1 1 36 36 GLN N N 36 118.117 118.117 120.400 -2.283 19193 3360 1 10 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.199 0.581 19193 3361 1 10 . 1 1 36 36 GLN C C 36 176.083 176.083 178.300 -2.217 19193 3362 1 10 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.836 0.305 19193 3363 1 10 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.464 -0.868 19193 3364 1 10 . 1 1 36 36 GLN H H 36 8.346 8.346 8.191 0.155 19193 3365 1 10 . 1 1 37 37 LEU N N 37 119.945 119.945 120.802 -0.857 19193 3366 1 10 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.096 0.004 19193 3367 1 10 . 1 1 37 37 LEU C C 37 175.096 175.096 178.546 -3.450 19193 3368 1 10 . 1 1 37 37 LEU CA C 37 57.387 57.387 58.191 -0.804 19193 3369 1 10 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.253 -0.050 19193 3370 1 10 . 1 1 37 37 LEU H H 37 7.469 7.469 8.249 -0.780 19193 3371 1 10 . 1 1 38 38 LEU N N 38 119.102 119.102 118.584 0.518 19193 3372 1 10 . 1 1 38 38 LEU HA H 38 4.130 4.130 4.014 0.116 19193 3373 1 10 . 1 1 38 38 LEU C C 38 175.531 175.531 179.263 -3.732 19193 3374 1 10 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.364 -0.491 19193 3375 1 10 . 1 1 38 38 LEU CB C 38 40.865 40.865 40.861 0.004 19193 3376 1 10 . 1 1 38 38 LEU H H 38 7.110 7.110 7.629 -0.519 19193 3377 1 10 . 1 1 39 39 GLN N N 39 118.022 118.022 118.734 -0.712 19193 3378 1 10 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.065 -0.135 19193 3379 1 10 . 1 1 39 39 GLN C C 39 175.315 175.315 178.940 -3.625 19193 3380 1 10 . 1 1 39 39 GLN CA C 39 59.511 59.511 58.835 0.676 19193 3381 1 10 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.479 -0.585 19193 3382 1 10 . 1 1 39 39 GLN H H 39 8.579 8.579 7.688 0.891 19193 3383 1 10 . 1 1 40 40 LEU N N 40 120.372 120.372 121.078 -0.706 19193 3384 1 10 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.008 -0.068 19193 3385 1 10 . 1 1 40 40 LEU C C 40 176.514 176.514 179.216 -2.702 19193 3386 1 10 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.063 -0.437 19193 3387 1 10 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.182 -0.134 19193 3388 1 10 . 1 1 40 40 LEU H H 40 7.890 7.890 8.576 -0.686 19193 3389 1 10 . 1 1 41 41 ILE N N 41 120.723 120.723 119.076 1.647 19193 3390 1 10 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.591 0.549 19193 3391 1 10 . 1 1 41 41 ILE C C 41 174.220 174.220 177.913 -3.693 19193 3392 1 10 . 1 1 41 41 ILE CA C 41 66.019 66.019 65.327 0.692 19193 3393 1 10 . 1 1 41 41 ILE CB C 41 38.279 38.279 37.794 0.485 19193 3394 1 10 . 1 1 41 41 ILE H H 41 8.106 8.106 8.574 -0.468 19193 3395 1 10 . 1 1 42 42 PHE N N 42 119.850 119.850 121.974 -2.124 19193 3396 1 10 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.049 0.731 19193 3397 1 10 . 1 1 42 42 PHE C C 42 173.670 173.670 176.943 -3.273 19193 3398 1 10 . 1 1 42 42 PHE CA C 42 62.896 62.896 62.254 0.642 19193 3399 1 10 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.915 1.103 19193 3400 1 10 . 1 1 42 42 PHE H H 42 8.695 8.695 8.381 0.314 19193 3401 1 10 . 1 1 43 43 LYS N N 43 115.976 115.976 118.043 -2.067 19193 3402 1 10 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.710 0.310 19193 3403 1 10 . 1 1 43 43 LYS C C 43 175.313 175.313 177.835 -2.522 19193 3404 1 10 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.724 0.166 19193 3405 1 10 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.331 0.188 19193 3406 1 10 . 1 1 43 43 LYS H H 43 8.405 8.405 7.753 0.652 19193 3407 1 10 . 1 1 44 44 SER N N 44 112.481 112.481 113.912 -1.431 19193 3408 1 10 . 1 1 44 44 SER HA H 44 4.100 4.100 4.196 -0.096 19193 3409 1 10 . 1 1 44 44 SER C C 44 172.469 172.469 175.912 -3.443 19193 3410 1 10 . 1 1 44 44 SER CA C 44 61.017 61.017 60.775 0.242 19193 3411 1 10 . 1 1 44 44 SER CB C 44 63.450 63.450 63.614 -0.164 19193 3412 1 10 . 1 1 44 44 SER H H 44 7.492 7.492 7.686 -0.194 19193 3413 1 10 . 1 1 45 45 ILE N N 45 120.793 120.793 118.844 1.949 19193 3414 1 10 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.578 0.982 19193 3415 1 10 . 1 1 45 45 ILE C C 45 174.535 174.535 175.962 -1.427 19193 3416 1 10 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.432 -0.657 19193 3417 1 10 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.032 -0.053 19193 3418 1 10 . 1 1 45 45 ILE H H 45 7.407 7.407 7.783 -0.376 19193 3419 1 10 . 1 1 46 46 ASP N N 46 118.226 118.226 119.773 -1.547 19193 3420 1 10 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.367 0.033 19193 3421 1 10 . 1 1 46 46 ASP C C 46 173.226 173.226 176.068 -2.842 19193 3422 1 10 . 1 1 46 46 ASP CA C 46 52.245 52.245 54.286 -2.041 19193 3423 1 10 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.468 -3.437 19193 3424 1 10 . 1 1 46 46 ASP H H 46 7.343 7.343 7.493 -0.150 19193 3425 1 10 . 1 1 47 47 ALA N N 47 130.084 130.084 128.713 1.371 19193 3426 1 10 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.978 0.412 19193 3427 1 10 . 1 1 47 47 ALA C C 47 176.299 176.299 177.896 -1.597 19193 3428 1 10 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.298 0.268 19193 3429 1 10 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.321 -0.101 19193 3430 1 10 . 1 1 47 47 ALA H H 47 7.742 7.742 8.476 -0.734 19193 3431 1 10 . 1 1 48 48 ASP N N 48 113.283 113.283 113.586 -0.303 19193 3432 1 10 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.630 -0.030 19193 3433 1 10 . 1 1 48 48 ASP C C 48 175.111 175.111 177.058 -1.947 19193 3434 1 10 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.266 -0.756 19193 3435 1 10 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.154 -1.715 19193 3436 1 10 . 1 1 48 48 ASP H H 48 8.038 8.038 7.829 0.209 19193 3437 1 10 . 1 1 49 49 GLY C C 49 172.256 172.256 174.729 -2.473 19193 3438 1 10 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.763 0.971 19193 3439 1 10 . 1 1 49 49 GLY H H 49 7.775 7.775 7.937 -0.162 19193 3440 1 10 . 1 1 50 50 ASN N N 50 119.017 119.017 118.848 0.169 19193 3441 1 10 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.626 0.004 19193 3442 1 10 . 1 1 50 50 ASN C C 50 173.670 173.670 176.742 -3.072 19193 3443 1 10 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.250 1.126 19193 3444 1 10 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.816 0.596 19193 3445 1 10 . 1 1 50 50 ASN H H 50 8.155 8.155 7.909 0.246 19193 3446 1 10 . 1 1 51 51 GLY C C 51 169.963 169.963 173.634 -3.671 19193 3447 1 10 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.240 -2.003 19193 3448 1 10 . 1 1 51 51 GLY H H 51 10.668 10.668 8.761 1.907 19193 3449 1 10 . 1 1 52 52 GLU N N 52 116.254 116.254 118.972 -2.718 19193 3450 1 10 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.133 -0.173 19193 3451 1 10 . 1 1 52 52 GLU C C 52 171.378 171.378 175.311 -3.933 19193 3452 1 10 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.238 -0.931 19193 3453 1 10 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.385 0.696 19193 3454 1 10 . 1 1 52 52 GLU H H 52 7.579 7.579 8.298 -0.719 19193 3455 1 10 . 1 1 53 53 ILE N N 53 126.770 126.770 121.980 4.790 19193 3456 1 10 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.926 0.054 19193 3457 1 10 . 1 1 53 53 ILE C C 53 172.922 172.922 176.487 -3.565 19193 3458 1 10 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.184 -1.538 19193 3459 1 10 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.738 -0.721 19193 3460 1 10 . 1 1 53 53 ILE H H 53 9.661 9.661 9.107 0.554 19193 3461 1 10 . 1 1 54 54 ASP N N 54 128.225 128.225 127.455 0.770 19193 3462 1 10 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.298 -0.388 19193 3463 1 10 . 1 1 54 54 ASP C C 54 173.562 173.562 177.826 -4.264 19193 3464 1 10 . 1 1 54 54 ASP CA C 54 51.892 51.892 54.630 -2.738 19193 3465 1 10 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.814 0.086 19193 3466 1 10 . 1 1 54 54 ASP H H 54 8.771 8.771 9.344 -0.573 19193 3467 1 10 . 1 1 55 55 GLN N N 55 116.090 116.090 122.091 -6.001 19193 3468 1 10 . 1 1 55 55 GLN HA H 55 3.340 3.340 3.085 0.255 19193 3469 1 10 . 1 1 55 55 GLN C C 55 175.643 175.643 177.732 -2.089 19193 3470 1 10 . 1 1 55 55 GLN CA C 55 59.645 59.645 60.169 -0.524 19193 3471 1 10 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.345 -0.448 19193 3472 1 10 . 1 1 55 55 GLN H H 55 8.563 8.563 8.737 -0.174 19193 3473 1 10 . 1 1 56 56 ASN N N 56 119.830 119.830 119.598 0.232 19193 3474 1 10 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.241 0.529 19193 3475 1 10 . 1 1 56 56 ASN C C 56 178.242 178.242 177.395 0.847 19193 3476 1 10 . 1 1 56 56 ASN CA C 56 55.887 55.887 57.627 -1.740 19193 3477 1 10 . 1 1 56 56 ASN CB C 56 38.263 38.263 38.013 0.250 19193 3478 1 10 . 1 1 56 56 ASN H H 56 8.205 8.205 8.710 -0.505 19193 3479 1 10 . 1 1 57 57 GLU N N 57 123.242 123.242 120.122 3.120 19193 3480 1 10 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.969 0.041 19193 3481 1 10 . 1 1 57 57 GLU C C 57 177.498 177.498 179.004 -1.506 19193 3482 1 10 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.350 -0.710 19193 3483 1 10 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.479 0.145 19193 3484 1 10 . 1 1 57 57 GLU H H 57 9.079 9.079 8.044 1.035 19193 3485 1 10 . 1 1 58 58 PHE N N 58 119.057 119.057 120.837 -1.780 19193 3486 1 10 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.254 -0.224 19193 3487 1 10 . 1 1 58 58 PHE C C 58 173.784 173.784 177.238 -3.454 19193 3488 1 10 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.497 0.247 19193 3489 1 10 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.976 0.605 19193 3490 1 10 . 1 1 58 58 PHE H H 58 8.795 8.795 8.481 0.314 19193 3491 1 10 . 1 1 59 59 ALA N N 59 120.919 120.919 121.885 -0.966 19193 3492 1 10 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.090 -0.130 19193 3493 1 10 . 1 1 59 59 ALA C C 59 177.602 177.602 179.426 -1.824 19193 3494 1 10 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.055 -0.127 19193 3495 1 10 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.343 -0.552 19193 3496 1 10 . 1 1 59 59 ALA H H 59 8.158 8.158 8.473 -0.315 19193 3497 1 10 . 1 1 60 60 LYS N N 60 116.767 116.767 116.664 0.103 19193 3498 1 10 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.095 -0.045 19193 3499 1 10 . 1 1 60 60 LYS C C 60 175.309 175.309 178.339 -3.030 19193 3500 1 10 . 1 1 60 60 LYS CA C 60 58.274 58.274 57.833 0.441 19193 3501 1 10 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.489 -0.268 19193 3502 1 10 . 1 1 60 60 LYS H H 60 7.554 7.554 7.858 -0.304 19193 3503 1 10 . 1 1 61 61 PHE N N 61 118.086 118.086 120.450 -2.364 19193 3504 1 10 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.250 0.240 19193 3505 1 10 . 1 1 61 61 PHE C C 61 173.559 173.559 175.263 -1.704 19193 3506 1 10 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.695 0.826 19193 3507 1 10 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.496 0.543 19193 3508 1 10 . 1 1 61 61 PHE H H 61 7.231 7.231 7.688 -0.457 19193 3509 1 10 . 1 1 62 62 TYR N N 62 120.802 120.802 121.875 -1.073 19193 3510 1 10 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.614 0.856 19193 3511 1 10 . 1 1 62 62 TYR C C 62 173.559 173.559 175.804 -2.245 19193 3512 1 10 . 1 1 62 62 TYR CA C 62 60.888 60.888 60.155 0.733 19193 3513 1 10 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.923 0.350 19193 3514 1 10 . 1 1 62 62 TYR H H 62 8.301 8.301 7.781 0.520 19193 3515 1 10 . 1 1 63 63 GLY N N 63 132.741 132.741 115.019 17.722 19193 3516 1 10 . 1 1 63 63 GLY C C 63 172.799 172.799 175.268 -2.469 19193 3517 1 10 . 1 1 63 63 GLY CA C 63 46.252 46.252 45.272 0.980 19193 3518 1 10 . 1 1 63 63 GLY H H 63 8.293 8.293 8.064 0.229 19193 3519 1 10 . 1 1 64 64 SER N N 64 115.064 115.064 115.970 -0.906 19193 3520 1 10 . 1 1 64 64 SER HA H 64 4.780 4.780 4.566 0.214 19193 3521 1 10 . 1 1 64 64 SER C C 64 170.939 170.939 175.528 -4.589 19193 3522 1 10 . 1 1 64 64 SER CA C 64 60.525 60.525 58.377 2.147 19193 3523 1 10 . 1 1 64 64 SER CB C 64 63.430 63.430 63.296 0.134 19193 3524 1 10 . 1 1 64 64 SER H H 64 7.833 7.833 7.907 -0.074 19193 3525 1 10 . 1 1 65 65 ILE N N 65 112.928 112.928 121.108 -8.180 19193 3526 1 10 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.201 0.059 19193 3527 1 10 . 1 1 65 65 ILE C C 65 175.695 175.695 175.965 -0.270 19193 3528 1 10 . 1 1 65 65 ILE CA C 65 59.752 59.752 60.972 -1.220 19193 3529 1 10 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.871 1.851 19193 3530 1 10 . 1 1 65 65 ILE H H 65 6.935 6.935 7.694 -0.759 19193 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 59 3.487 -0.140 3.514 19193 2 1 1 "Average Difference" HA 62 0.470 -0.156 0.447 19193 3 1 1 "Average Difference" C 60 2.859 2.641 1.104 19193 4 1 1 "Average Difference" CA 61 1.143 -0.009 1.152 19193 5 1 1 "Average Difference" CB 56 1.214 0.086 1.222 19193 6 1 1 "Average Difference" HN 61 0.587 -0.061 0.589 19193 7 1 2 "Average Difference" N 59 3.517 -0.126 3.545 19193 8 1 2 "Average Difference" HA 62 0.460 -0.152 0.438 19193 9 1 2 "Average Difference" C 60 2.883 2.636 1.179 19193 10 1 2 "Average Difference" CA 61 1.059 0.024 1.067 19193 11 1 2 "Average Difference" CB 56 1.169 0.070 1.178 19193 12 1 2 "Average Difference" HN 61 0.617 -0.069 0.618 19193 13 1 3 "Average Difference" N 59 3.582 -0.287 3.601 19193 14 1 3 "Average Difference" HA 62 0.474 -0.146 0.455 19193 15 1 3 "Average Difference" C 60 2.884 2.655 1.137 19193 16 1 3 "Average Difference" CA 61 1.018 -0.010 1.027 19193 17 1 3 "Average Difference" CB 56 1.134 0.121 1.137 19193 18 1 3 "Average Difference" HN 61 0.599 -0.087 0.597 19193 19 1 4 "Average Difference" N 59 3.717 -0.120 3.747 19193 20 1 4 "Average Difference" HA 62 0.491 -0.161 0.467 19193 21 1 4 "Average Difference" C 60 2.897 2.678 1.116 19193 22 1 4 "Average Difference" CA 61 1.061 -0.008 1.070 19193 23 1 4 "Average Difference" CB 56 1.246 0.065 1.256 19193 24 1 4 "Average Difference" HN 61 0.634 -0.085 0.633 19193 25 1 5 "Average Difference" N 59 3.572 -0.088 3.601 19193 26 1 5 "Average Difference" HA 62 0.482 -0.158 0.459 19193 27 1 5 "Average Difference" C 60 2.906 2.678 1.139 19193 28 1 5 "Average Difference" CA 61 1.021 -0.010 1.029 19193 29 1 5 "Average Difference" CB 56 1.160 0.096 1.166 19193 30 1 5 "Average Difference" HN 61 0.609 -0.075 0.609 19193 31 1 6 "Average Difference" N 59 3.506 -0.191 3.531 19193 32 1 6 "Average Difference" HA 62 0.468 -0.159 0.444 19193 33 1 6 "Average Difference" C 60 2.836 2.605 1.130 19193 34 1 6 "Average Difference" CA 61 1.065 -0.029 1.074 19193 35 1 6 "Average Difference" CB 56 1.226 0.101 1.232 19193 36 1 6 "Average Difference" HN 61 0.617 -0.089 0.615 19193 37 1 7 "Average Difference" N 59 3.536 -0.111 3.564 19193 38 1 7 "Average Difference" HA 62 0.480 -0.164 0.455 19193 39 1 7 "Average Difference" C 60 2.834 2.607 1.120 19193 40 1 7 "Average Difference" CA 61 1.047 0.019 1.055 19193 41 1 7 "Average Difference" CB 56 1.245 0.123 1.250 19193 42 1 7 "Average Difference" HN 61 0.631 -0.089 0.630 19193 43 1 8 "Average Difference" N 59 3.484 -0.105 3.513 19193 44 1 8 "Average Difference" HA 62 0.464 -0.156 0.440 19193 45 1 8 "Average Difference" C 60 2.846 2.610 1.144 19193 46 1 8 "Average Difference" CA 61 1.044 0.007 1.053 19193 47 1 8 "Average Difference" CB 56 1.228 0.158 1.229 19193 48 1 8 "Average Difference" HN 61 0.604 -0.091 0.602 19193 49 1 9 "Average Difference" N 59 3.515 -0.159 3.541 19193 50 1 9 "Average Difference" HA 62 0.497 -0.159 0.475 19193 51 1 9 "Average Difference" C 60 2.846 2.612 1.138 19193 52 1 9 "Average Difference" CA 61 0.996 -0.010 1.004 19193 53 1 9 "Average Difference" CB 56 1.165 0.136 1.167 19193 54 1 9 "Average Difference" HN 61 0.578 -0.083 0.577 19193 55 1 10 "Average Difference" N 59 3.488 -0.016 3.518 19193 56 1 10 "Average Difference" HA 62 0.455 -0.157 0.430 19193 57 1 10 "Average Difference" C 60 2.856 2.633 1.116 19193 58 1 10 "Average Difference" CA 61 1.087 0.097 1.092 19193 59 1 10 "Average Difference" CB 56 1.186 0.141 1.188 19193 60 1 10 "Average Difference" HN 61 0.590 -0.069 0.591 19193 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 19193 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 5 5 LEU N N 5 120.669 120.669 117.396 3.273 19193 2 1 . 1 1 5 5 LEU HA H 5 4.210 4.210 4.003 0.207 19193 3 1 . 1 1 5 5 LEU CA C 5 58.825 58.825 57.061 1.764 19193 4 1 . 1 1 5 5 LEU CB C 5 42.265 42.265 41.291 0.974 19193 5 1 . 1 1 5 5 LEU H H 5 7.998 7.998 7.859 0.139 19193 6 1 . 1 1 6 6 PHE N N 6 117.996 117.996 119.999 -2.003 19193 7 1 . 1 1 6 6 PHE HA H 6 3.860 3.860 3.828 0.032 19193 8 1 . 1 1 6 6 PHE C C 6 175.520 175.520 176.851 -1.331 19193 9 1 . 1 1 6 6 PHE CA C 6 63.214 63.214 61.229 1.985 19193 10 1 . 1 1 6 6 PHE CB C 6 39.018 39.018 38.644 0.375 19193 11 1 . 1 1 6 6 PHE H H 6 7.276 7.276 8.061 -0.785 19193 12 1 . 1 1 7 7 LYS N N 7 114.616 114.616 118.167 -3.551 19193 13 1 . 1 1 7 7 LYS HA H 7 3.961 3.961 3.853 0.108 19193 14 1 . 1 1 7 7 LYS C C 7 175.105 175.105 177.990 -2.885 19193 15 1 . 1 1 7 7 LYS CA C 7 58.770 58.770 58.755 0.015 19193 16 1 . 1 1 7 7 LYS CB C 7 32.237 32.237 32.229 0.008 19193 17 1 . 1 1 7 7 LYS H H 7 7.523 7.523 7.575 -0.052 19193 18 1 . 1 1 8 8 GLU N N 8 117.996 117.996 119.149 -1.153 19193 19 1 . 1 1 8 8 GLU HA H 8 3.860 3.860 4.040 -0.180 19193 20 1 . 1 1 8 8 GLU C C 8 174.994 174.994 178.368 -3.374 19193 21 1 . 1 1 8 8 GLU CA C 8 58.259 58.259 58.739 -0.480 19193 22 1 . 1 1 8 8 GLU CB C 8 29.303 29.303 29.883 -0.580 19193 23 1 . 1 1 8 8 GLU H H 8 7.276 7.276 7.713 -0.437 19193 24 1 . 1 1 9 9 ILE N N 9 117.880 117.880 116.241 1.639 19193 25 1 . 1 1 9 9 ILE HA H 9 3.442 3.442 3.699 -0.257 19193 26 1 . 1 1 9 9 ILE C C 9 177.620 177.620 176.560 1.060 19193 27 1 . 1 1 9 9 ILE CA C 9 63.411 63.411 62.290 1.121 19193 28 1 . 1 1 9 9 ILE CB C 9 37.711 37.711 36.939 0.771 19193 29 1 . 1 1 9 9 ILE H H 9 7.166 7.166 7.485 -0.319 19193 30 1 . 1 1 10 10 ASP N N 10 119.154 119.154 121.855 -2.701 19193 31 1 . 1 1 10 10 ASP HA H 10 3.852 3.852 4.546 -0.694 19193 32 1 . 1 1 10 10 ASP C C 10 174.446 174.446 177.175 -2.729 19193 33 1 . 1 1 10 10 ASP CA C 10 52.387 52.387 53.681 -1.294 19193 34 1 . 1 1 10 10 ASP CB C 10 38.297 38.297 38.980 -0.683 19193 35 1 . 1 1 10 10 ASP H H 10 7.629 7.629 7.436 0.192 19193 36 1 . 1 1 11 11 VAL N N 11 124.080 124.080 123.295 0.785 19193 37 1 . 1 1 11 11 VAL HA H 11 3.810 3.810 3.733 0.077 19193 38 1 . 1 1 11 11 VAL C C 11 174.883 174.883 176.651 -1.768 19193 39 1 . 1 1 11 11 VAL CA C 11 64.888 64.888 64.867 0.021 19193 40 1 . 1 1 11 11 VAL CB C 11 31.920 31.920 31.442 0.478 19193 41 1 . 1 1 11 11 VAL H H 11 7.956 7.956 7.878 0.079 19193 42 1 . 1 1 12 12 ASN N N 12 114.490 114.490 116.537 -2.047 19193 43 1 . 1 1 12 12 ASN HA H 12 4.760 4.760 4.635 0.125 19193 44 1 . 1 1 12 12 ASN C C 12 173.671 173.671 176.551 -2.880 19193 45 1 . 1 1 12 12 ASN CA C 12 51.618 51.618 52.536 -0.918 19193 46 1 . 1 1 12 12 ASN CB C 12 36.572 36.572 37.255 -0.683 19193 47 1 . 1 1 12 12 ASN H H 12 7.630 7.630 7.840 -0.210 19193 48 1 . 1 1 13 13 GLY N N 13 109.255 109.255 108.830 0.425 19193 49 1 . 1 1 13 13 GLY C C 13 172.031 172.031 174.875 -2.844 19193 50 1 . 1 1 13 13 GLY CA C 13 46.998 46.998 46.566 0.432 19193 51 1 . 1 1 13 13 GLY H H 13 7.643 7.643 8.011 -0.368 19193 52 1 . 1 1 14 14 ASP N N 14 118.441 118.441 118.950 -0.508 19193 53 1 . 1 1 14 14 ASP HA H 14 4.530 4.530 4.626 -0.096 19193 54 1 . 1 1 14 14 ASP C C 14 174.877 174.877 177.556 -2.679 19193 55 1 . 1 1 14 14 ASP CA C 14 52.873 52.873 53.237 -0.364 19193 56 1 . 1 1 14 14 ASP CB C 14 40.029 40.029 41.397 -1.368 19193 57 1 . 1 1 14 14 ASP H H 14 7.956 7.956 7.829 0.127 19193 58 1 . 1 1 15 15 GLY N N 15 118.441 118.441 107.459 10.982 19193 59 1 . 1 1 15 15 GLY C C 15 169.627 169.627 173.233 -3.606 19193 60 1 . 1 1 15 15 GLY CA C 15 45.873 45.873 45.768 0.106 19193 61 1 . 1 1 15 15 GLY H H 15 10.286 10.286 8.759 1.528 19193 62 1 . 1 1 16 16 ALA N N 16 122.512 122.512 121.565 0.947 19193 63 1 . 1 1 16 16 ALA HA H 16 4.930 4.930 5.666 -0.736 19193 64 1 . 1 1 16 16 ALA C C 16 172.696 172.696 176.043 -3.347 19193 65 1 . 1 1 16 16 ALA CA C 16 49.879 49.879 50.864 -0.985 19193 66 1 . 1 1 16 16 ALA CB C 16 22.138 22.138 22.489 -0.351 19193 67 1 . 1 1 16 16 ALA H H 16 7.883 7.883 7.897 -0.014 19193 68 1 . 1 1 17 17 VAL N N 17 124.615 124.615 121.090 3.525 19193 69 1 . 1 1 17 17 VAL HA H 17 4.940 4.940 4.648 0.292 19193 70 1 . 1 1 17 17 VAL C C 17 172.461 172.461 175.355 -2.894 19193 71 1 . 1 1 17 17 VAL CA C 17 60.441 60.441 60.392 0.049 19193 72 1 . 1 1 17 17 VAL CB C 17 32.536 32.536 34.289 -1.753 19193 73 1 . 1 1 17 17 VAL H H 17 9.373 9.373 8.856 0.517 19193 74 1 . 1 1 18 18 SER N N 18 125.090 125.090 123.091 1.999 19193 75 1 . 1 1 18 18 SER HA H 18 4.970 4.970 5.145 -0.175 19193 76 1 . 1 1 18 18 SER C C 18 172.145 172.145 176.066 -3.921 19193 77 1 . 1 1 18 18 SER CA C 18 55.641 55.641 57.546 -1.905 19193 78 1 . 1 1 18 18 SER CB C 18 66.313 66.313 64.831 1.482 19193 79 1 . 1 1 18 18 SER H H 18 8.885 8.885 8.396 0.489 19193 80 1 . 1 1 19 19 TYR N N 19 123.319 123.319 119.971 3.348 19193 81 1 . 1 1 19 19 TYR HA H 19 4.960 4.960 3.912 1.048 19193 82 1 . 1 1 19 19 TYR C C 19 174.218 174.218 177.407 -3.190 19193 83 1 . 1 1 19 19 TYR CA C 19 62.398 62.398 61.009 1.389 19193 84 1 . 1 1 19 19 TYR CB C 19 36.859 36.859 36.645 0.214 19193 85 1 . 1 1 19 19 TYR H H 19 9.180 9.180 8.002 1.178 19193 86 1 . 1 1 20 20 GLU N N 20 117.323 117.323 119.388 -2.064 19193 87 1 . 1 1 20 20 GLU HA H 20 4.780 4.780 3.758 1.022 19193 88 1 . 1 1 20 20 GLU C C 20 177.285 177.285 178.864 -1.579 19193 89 1 . 1 1 20 20 GLU CA C 20 59.770 59.770 59.572 0.199 19193 90 1 . 1 1 20 20 GLU CB C 20 28.465 28.465 28.357 0.108 19193 91 1 . 1 1 20 20 GLU H H 20 8.520 8.520 7.451 1.070 19193 92 1 . 1 1 21 21 GLU N N 21 120.067 120.067 119.218 0.849 19193 93 1 . 1 1 21 21 GLU HA H 21 4.780 4.780 3.947 0.833 19193 94 1 . 1 1 21 21 GLU C C 21 177.617 177.617 179.010 -1.393 19193 95 1 . 1 1 21 21 GLU CA C 21 58.901 58.901 59.458 -0.557 19193 96 1 . 1 1 21 21 GLU CB C 21 27.898 27.898 29.172 -1.274 19193 97 1 . 1 1 21 21 GLU H H 21 7.738 7.738 7.674 0.064 19193 98 1 . 1 1 22 22 VAL N N 22 122.931 122.931 120.605 2.326 19193 99 1 . 1 1 22 22 VAL HA H 22 3.500 3.500 3.693 -0.193 19193 100 1 . 1 1 22 22 VAL C C 22 173.899 173.899 177.886 -3.987 19193 101 1 . 1 1 22 22 VAL CA C 22 67.530 67.530 66.663 0.867 19193 102 1 . 1 1 22 22 VAL CB C 22 30.781 30.781 31.423 -0.642 19193 103 1 . 1 1 22 22 VAL H H 22 8.110 8.110 8.320 -0.210 19193 104 1 . 1 1 23 23 LYS N N 23 120.609 120.609 119.105 1.504 19193 105 1 . 1 1 23 23 LYS HA H 23 3.500 3.500 3.978 -0.478 19193 106 1 . 1 1 23 23 LYS C C 23 175.965 175.965 179.216 -3.251 19193 107 1 . 1 1 23 23 LYS CA C 23 60.155 60.155 59.247 0.908 19193 108 1 . 1 1 23 23 LYS CB C 23 31.640 31.640 32.023 -0.384 19193 109 1 . 1 1 23 23 LYS H H 23 8.613 8.613 7.802 0.811 19193 110 1 . 1 1 24 24 ALA N N 24 121.619 121.619 122.390 -0.771 19193 111 1 . 1 1 24 24 ALA HA H 24 4.020 4.020 4.098 -0.078 19193 112 1 . 1 1 24 24 ALA C C 24 176.843 176.843 179.369 -2.526 19193 113 1 . 1 1 24 24 ALA CA C 24 54.755 54.755 55.059 -0.304 19193 114 1 . 1 1 24 24 ALA CB C 24 18.084 18.084 18.316 -0.232 19193 115 1 . 1 1 24 24 ALA H H 24 8.038 8.038 7.979 0.058 19193 116 1 . 1 1 25 25 PHE N N 25 118.380 118.380 119.037 -0.657 19193 117 1 . 1 1 25 25 PHE HA H 25 4.220 4.220 4.160 0.060 19193 118 1 . 1 1 25 25 PHE C C 25 174.657 174.657 178.373 -3.716 19193 119 1 . 1 1 25 25 PHE CA C 25 61.143 61.143 59.898 1.245 19193 120 1 . 1 1 25 25 PHE CB C 25 39.566 39.566 38.595 0.971 19193 121 1 . 1 1 25 25 PHE H H 25 7.668 7.668 8.271 -0.603 19193 122 1 . 1 1 26 26 VAL N N 26 117.975 117.975 118.926 -0.951 19193 123 1 . 1 1 26 26 VAL HA H 26 3.180 3.180 3.678 -0.498 19193 124 1 . 1 1 26 26 VAL C C 26 175.212 175.212 178.044 -2.832 19193 125 1 . 1 1 26 26 VAL CA C 26 66.539 66.539 65.496 1.043 19193 126 1 . 1 1 26 26 VAL CB C 26 31.406 31.406 31.570 -0.164 19193 127 1 . 1 1 26 26 VAL H H 26 8.667 8.667 7.891 0.776 19193 128 1 . 1 1 27 27 SER N N 27 112.988 112.988 115.626 -2.638 19193 129 1 . 1 1 27 27 SER HA H 27 4.900 4.900 4.444 0.456 19193 130 1 . 1 1 27 27 SER C C 27 172.256 172.256 175.191 -2.935 19193 131 1 . 1 1 27 27 SER CA C 27 60.403 60.403 60.855 -0.452 19193 132 1 . 1 1 27 27 SER CB C 27 63.131 63.131 63.149 -0.018 19193 133 1 . 1 1 27 27 SER H H 27 8.138 8.138 7.732 0.406 19193 134 1 . 1 1 28 28 LYS N N 28 119.278 119.278 118.637 0.641 19193 135 1 . 1 1 28 28 LYS HA H 28 4.060 4.060 4.205 -0.145 19193 136 1 . 1 1 28 28 LYS C C 28 174.753 174.753 177.206 -2.453 19193 137 1 . 1 1 28 28 LYS CA C 28 57.899 57.899 57.484 0.415 19193 138 1 . 1 1 28 28 LYS CB C 28 32.223 32.223 32.465 -0.242 19193 139 1 . 1 1 28 28 LYS H H 28 7.077 7.077 7.455 -0.378 19193 140 1 . 1 1 29 29 LYS N N 29 116.136 116.136 116.955 -0.819 19193 141 1 . 1 1 29 29 LYS HA H 29 4.260 4.260 4.402 -0.142 19193 142 1 . 1 1 29 29 LYS C C 29 173.137 173.137 176.475 -3.338 19193 143 1 . 1 1 29 29 LYS CA C 29 55.008 55.008 56.685 -1.677 19193 144 1 . 1 1 29 29 LYS CB C 29 33.689 33.689 33.985 -0.296 19193 145 1 . 1 1 29 29 LYS H H 29 7.452 7.452 7.963 -0.511 19193 146 1 . 1 1 30 30 ARG N N 30 116.823 116.823 116.445 0.378 19193 147 1 . 1 1 30 30 ARG HA H 30 4.470 4.470 4.465 0.006 19193 148 1 . 1 1 30 30 ARG C C 30 169.632 169.632 173.617 -3.984 19193 149 1 . 1 1 30 30 ARG CA C 30 54.380 54.380 55.244 -0.864 19193 150 1 . 1 1 30 30 ARG CB C 30 31.072 31.072 31.395 -0.323 19193 151 1 . 1 1 30 30 ARG H H 30 8.079 8.079 7.511 0.568 19193 152 1 . 1 1 31 31 ALA N N 31 121.111 121.111 122.896 -1.785 19193 153 1 . 1 1 31 31 ALA HA H 31 4.460 4.460 4.733 -0.273 19193 154 1 . 1 1 31 31 ALA C C 31 175.120 175.120 176.641 -1.521 19193 155 1 . 1 1 31 31 ALA CA C 31 50.997 50.997 51.434 -0.436 19193 156 1 . 1 1 31 31 ALA CB C 31 18.095 18.095 18.937 -0.841 19193 157 1 . 1 1 31 31 ALA H H 31 7.929 7.929 8.352 -0.423 19193 158 1 . 1 1 32 32 ILE N N 32 123.829 123.829 122.450 1.379 19193 159 1 . 1 1 32 32 ILE HA H 32 4.390 4.390 4.404 -0.014 19193 160 1 . 1 1 32 32 ILE C C 32 173.398 173.398 174.750 -1.352 19193 161 1 . 1 1 32 32 ILE CA C 32 61.031 61.031 60.641 0.389 19193 162 1 . 1 1 32 32 ILE CB C 32 37.165 37.165 39.833 -2.668 19193 163 1 . 1 1 32 32 ILE H H 32 8.552 8.552 8.216 0.336 19193 164 1 . 1 1 33 33 LYS N N 33 130.536 130.536 128.436 2.100 19193 165 1 . 1 1 33 33 LYS HA H 33 4.020 4.020 4.412 -0.393 19193 166 1 . 1 1 33 33 LYS C C 33 174.009 174.009 175.597 -1.588 19193 167 1 . 1 1 33 33 LYS CA C 33 56.641 56.641 56.236 0.405 19193 168 1 . 1 1 33 33 LYS CB C 33 37.410 37.410 32.373 5.037 19193 169 1 . 1 1 33 33 LYS H H 33 9.444 9.444 8.485 0.959 19193 170 1 . 1 1 34 34 ASN N N 34 120.119 120.119 125.193 -5.074 19193 171 1 . 1 1 34 34 ASN HA H 34 4.780 4.780 4.923 -0.143 19193 172 1 . 1 1 34 34 ASN C C 34 171.824 171.824 175.150 -3.326 19193 173 1 . 1 1 34 34 ASN CA C 34 51.003 51.003 52.536 -1.533 19193 174 1 . 1 1 34 34 ASN CB C 34 38.288 38.288 40.102 -1.814 19193 175 1 . 1 1 34 34 ASN H H 34 8.724 8.724 8.595 0.129 19193 176 1 . 1 1 35 35 GLU N N 35 124.613 124.613 124.522 0.091 19193 177 1 . 1 1 35 35 GLU HA H 35 4.290 4.290 4.079 0.211 19193 178 1 . 1 1 35 35 GLU C C 35 174.770 174.770 177.506 -2.736 19193 179 1 . 1 1 35 35 GLU CA C 35 59.307 59.307 59.592 -0.285 19193 180 1 . 1 1 35 35 GLU CB C 35 28.756 28.756 29.778 -1.022 19193 181 1 . 1 1 35 35 GLU H H 35 8.860 8.860 8.848 0.012 19193 182 1 . 1 1 36 36 GLN N N 36 118.117 118.117 120.289 -2.172 19193 183 1 . 1 1 36 36 GLN HA H 36 4.780 4.780 4.202 0.578 19193 184 1 . 1 1 36 36 GLN C C 36 176.083 176.083 178.407 -2.324 19193 185 1 . 1 1 36 36 GLN CA C 36 59.141 59.141 58.895 0.246 19193 186 1 . 1 1 36 36 GLN CB C 36 27.596 27.596 28.459 -0.863 19193 187 1 . 1 1 36 36 GLN H H 36 8.346 8.346 8.383 -0.037 19193 188 1 . 1 1 37 37 LEU N N 37 119.945 119.945 120.465 -0.520 19193 189 1 . 1 1 37 37 LEU HA H 37 4.100 4.100 4.099 0.001 19193 190 1 . 1 1 37 37 LEU C C 37 175.096 175.096 178.854 -3.758 19193 191 1 . 1 1 37 37 LEU CA C 37 57.387 57.387 57.791 -0.404 19193 192 1 . 1 1 37 37 LEU CB C 37 41.203 41.203 41.271 -0.069 19193 193 1 . 1 1 37 37 LEU H H 37 7.469 7.469 8.250 -0.781 19193 194 1 . 1 1 38 38 LEU N N 38 119.102 119.102 119.435 -0.333 19193 195 1 . 1 1 38 38 LEU HA H 38 4.130 4.130 3.999 0.131 19193 196 1 . 1 1 38 38 LEU C C 38 175.531 175.531 179.062 -3.531 19193 197 1 . 1 1 38 38 LEU CA C 38 57.873 57.873 58.394 -0.521 19193 198 1 . 1 1 38 38 LEU CB C 38 40.865 40.865 41.015 -0.150 19193 199 1 . 1 1 38 38 LEU H H 38 7.110 7.110 7.774 -0.664 19193 200 1 . 1 1 39 39 GLN N N 39 118.022 118.022 118.744 -0.722 19193 201 1 . 1 1 39 39 GLN HA H 39 3.930 3.930 4.102 -0.172 19193 202 1 . 1 1 39 39 GLN C C 39 175.315 175.315 178.902 -3.587 19193 203 1 . 1 1 39 39 GLN CA C 39 59.511 59.511 59.065 0.446 19193 204 1 . 1 1 39 39 GLN CB C 39 27.894 27.894 28.631 -0.737 19193 205 1 . 1 1 39 39 GLN H H 39 8.579 8.579 7.710 0.869 19193 206 1 . 1 1 40 40 LEU N N 40 120.372 120.372 121.005 -0.633 19193 207 1 . 1 1 40 40 LEU HA H 40 3.940 3.940 4.006 -0.066 19193 208 1 . 1 1 40 40 LEU C C 40 176.514 176.514 179.179 -2.665 19193 209 1 . 1 1 40 40 LEU CA C 40 57.627 57.627 58.101 -0.474 19193 210 1 . 1 1 40 40 LEU CB C 40 42.048 42.048 42.198 -0.150 19193 211 1 . 1 1 40 40 LEU H H 40 7.890 7.890 8.404 -0.514 19193 212 1 . 1 1 41 41 ILE N N 41 120.723 120.723 119.064 1.659 19193 213 1 . 1 1 41 41 ILE HA H 41 4.140 4.140 3.684 0.456 19193 214 1 . 1 1 41 41 ILE C C 41 174.220 174.220 178.133 -3.913 19193 215 1 . 1 1 41 41 ILE CA C 41 66.019 66.019 64.582 1.437 19193 216 1 . 1 1 41 41 ILE CB C 41 38.279 38.279 37.201 1.078 19193 217 1 . 1 1 41 41 ILE H H 41 8.106 8.106 8.557 -0.452 19193 218 1 . 1 1 42 42 PHE N N 42 119.850 119.850 122.136 -2.286 19193 219 1 . 1 1 42 42 PHE HA H 42 4.780 4.780 4.068 0.713 19193 220 1 . 1 1 42 42 PHE C C 42 173.670 173.670 177.062 -3.392 19193 221 1 . 1 1 42 42 PHE CA C 42 62.896 62.896 61.748 1.148 19193 222 1 . 1 1 42 42 PHE CB C 42 40.018 40.018 38.745 1.273 19193 223 1 . 1 1 42 42 PHE H H 42 8.695 8.695 8.389 0.306 19193 224 1 . 1 1 43 43 LYS N N 43 115.976 115.976 117.803 -1.827 19193 225 1 . 1 1 43 43 LYS HA H 43 4.020 4.020 3.638 0.382 19193 226 1 . 1 1 43 43 LYS C C 43 175.313 175.313 177.833 -2.520 19193 227 1 . 1 1 43 43 LYS CA C 43 58.890 58.890 58.638 0.252 19193 228 1 . 1 1 43 43 LYS CB C 43 32.519 32.519 32.318 0.201 19193 229 1 . 1 1 43 43 LYS H H 43 8.405 8.405 7.703 0.702 19193 230 1 . 1 1 44 44 SER N N 44 112.481 112.481 113.859 -1.378 19193 231 1 . 1 1 44 44 SER HA H 44 4.100 4.100 4.154 -0.054 19193 232 1 . 1 1 44 44 SER C C 44 172.469 172.469 175.886 -3.417 19193 233 1 . 1 1 44 44 SER CA C 44 61.017 61.017 61.033 -0.016 19193 234 1 . 1 1 44 44 SER CB C 44 63.450 63.450 63.655 -0.205 19193 235 1 . 1 1 44 44 SER H H 44 7.492 7.492 7.693 -0.201 19193 236 1 . 1 1 45 45 ILE N N 45 120.793 120.793 118.405 2.388 19193 237 1 . 1 1 45 45 ILE HA H 45 3.560 3.560 2.509 1.051 19193 238 1 . 1 1 45 45 ILE C C 45 174.535 174.535 175.769 -1.234 19193 239 1 . 1 1 45 45 ILE CA C 45 62.775 62.775 63.339 -0.564 19193 240 1 . 1 1 45 45 ILE CB C 45 37.979 37.979 38.162 -0.183 19193 241 1 . 1 1 45 45 ILE H H 45 7.407 7.407 7.765 -0.358 19193 242 1 . 1 1 46 46 ASP N N 46 118.226 118.226 119.316 -1.090 19193 243 1 . 1 1 46 46 ASP HA H 46 4.400 4.400 4.445 -0.045 19193 244 1 . 1 1 46 46 ASP C C 46 173.226 173.226 175.867 -2.641 19193 245 1 . 1 1 46 46 ASP CA C 46 52.245 52.245 53.871 -1.626 19193 246 1 . 1 1 46 46 ASP CB C 46 38.032 38.032 41.431 -3.399 19193 247 1 . 1 1 46 46 ASP H H 46 7.343 7.343 7.447 -0.104 19193 248 1 . 1 1 47 47 ALA N N 47 130.084 130.084 128.653 1.431 19193 249 1 . 1 1 47 47 ALA HA H 47 4.390 4.390 3.985 0.405 19193 250 1 . 1 1 47 47 ALA C C 47 176.299 176.299 177.877 -1.578 19193 251 1 . 1 1 47 47 ALA CA C 47 54.566 54.566 54.275 0.291 19193 252 1 . 1 1 47 47 ALA CB C 47 19.220 19.220 19.344 -0.124 19193 253 1 . 1 1 47 47 ALA H H 47 7.742 7.742 8.477 -0.735 19193 254 1 . 1 1 48 48 ASP N N 48 113.283 113.283 113.519 -0.236 19193 255 1 . 1 1 48 48 ASP HA H 48 4.600 4.600 4.616 -0.016 19193 256 1 . 1 1 48 48 ASP C C 48 175.111 175.111 177.055 -1.944 19193 257 1 . 1 1 48 48 ASP CA C 48 52.510 52.510 53.159 -0.649 19193 258 1 . 1 1 48 48 ASP CB C 48 39.439 39.439 41.269 -1.830 19193 259 1 . 1 1 48 48 ASP H H 48 8.038 8.038 7.806 0.232 19193 260 1 . 1 1 49 49 GLY C C 49 172.256 172.256 174.692 -2.436 19193 261 1 . 1 1 49 49 GLY CA C 49 46.734 46.734 45.729 1.005 19193 262 1 . 1 1 49 49 GLY H H 49 7.775 7.775 7.915 -0.140 19193 263 1 . 1 1 50 50 ASN N N 50 119.017 119.017 118.777 0.240 19193 264 1 . 1 1 50 50 ASN HA H 50 4.630 4.630 4.625 0.005 19193 265 1 . 1 1 50 50 ASN C C 50 173.670 173.670 176.682 -3.012 19193 266 1 . 1 1 50 50 ASN CA C 50 52.376 52.376 51.112 1.264 19193 267 1 . 1 1 50 50 ASN CB C 50 37.412 37.412 36.797 0.615 19193 268 1 . 1 1 50 50 ASN H H 50 8.155 8.155 7.927 0.228 19193 269 1 . 1 1 51 51 GLY C C 51 169.963 169.963 173.636 -3.673 19193 270 1 . 1 1 51 51 GLY CA C 51 45.237 45.237 47.237 -2.000 19193 271 1 . 1 1 51 51 GLY H H 51 10.668 10.668 8.701 1.967 19193 272 1 . 1 1 52 52 GLU N N 52 116.254 116.254 118.964 -2.710 19193 273 1 . 1 1 52 52 GLU HA H 52 4.960 4.960 5.080 -0.120 19193 274 1 . 1 1 52 52 GLU C C 52 171.378 171.378 175.292 -3.914 19193 275 1 . 1 1 52 52 GLU CA C 52 53.307 53.307 54.236 -0.929 19193 276 1 . 1 1 52 52 GLU CB C 52 33.081 33.081 32.336 0.745 19193 277 1 . 1 1 52 52 GLU H H 52 7.579 7.579 8.295 -0.717 19193 278 1 . 1 1 53 53 ILE N N 53 126.770 126.770 121.968 4.802 19193 279 1 . 1 1 53 53 ILE HA H 53 4.980 4.980 4.962 0.018 19193 280 1 . 1 1 53 53 ILE C C 53 172.922 172.922 176.442 -3.520 19193 281 1 . 1 1 53 53 ILE CA C 53 59.646 59.646 61.139 -1.493 19193 282 1 . 1 1 53 53 ILE CB C 53 38.017 38.017 38.730 -0.713 19193 283 1 . 1 1 53 53 ILE H H 53 9.661 9.661 9.106 0.555 19193 284 1 . 1 1 54 54 ASP N N 54 128.225 128.225 127.282 0.943 19193 285 1 . 1 1 54 54 ASP HA H 54 4.910 4.910 5.222 -0.312 19193 286 1 . 1 1 54 54 ASP C C 54 173.562 173.562 178.026 -4.465 19193 287 1 . 1 1 54 54 ASP CA C 54 51.892 51.892 53.672 -1.780 19193 288 1 . 1 1 54 54 ASP CB C 54 41.900 41.900 41.662 0.238 19193 289 1 . 1 1 54 54 ASP H H 54 8.771 8.771 9.297 -0.526 19193 290 1 . 1 1 55 55 GLN N N 55 116.090 116.090 121.117 -5.027 19193 291 1 . 1 1 55 55 GLN HA H 55 3.340 3.340 2.850 0.491 19193 292 1 . 1 1 55 55 GLN C C 55 175.643 175.643 177.604 -1.961 19193 293 1 . 1 1 55 55 GLN CA C 55 59.645 59.645 59.721 -0.075 19193 294 1 . 1 1 55 55 GLN CB C 55 27.897 27.897 28.239 -0.342 19193 295 1 . 1 1 55 55 GLN H H 55 8.563 8.563 8.592 -0.029 19193 296 1 . 1 1 56 56 ASN N N 56 119.830 119.830 119.554 0.276 19193 297 1 . 1 1 56 56 ASN HA H 56 4.770 4.770 4.310 0.460 19193 298 1 . 1 1 56 56 ASN C C 56 178.242 178.242 177.597 0.645 19193 299 1 . 1 1 56 56 ASN CA C 56 55.887 55.887 56.637 -0.750 19193 300 1 . 1 1 56 56 ASN CB C 56 38.263 38.263 37.726 0.537 19193 301 1 . 1 1 56 56 ASN H H 56 8.205 8.205 8.680 -0.474 19193 302 1 . 1 1 57 57 GLU N N 57 123.242 123.242 120.218 3.024 19193 303 1 . 1 1 57 57 GLU HA H 57 4.010 4.010 3.985 0.025 19193 304 1 . 1 1 57 57 GLU C C 57 177.498 177.498 179.094 -1.596 19193 305 1 . 1 1 57 57 GLU CA C 57 58.640 58.640 59.383 -0.743 19193 306 1 . 1 1 57 57 GLU CB C 57 29.624 29.624 29.424 0.200 19193 307 1 . 1 1 57 57 GLU H H 57 9.079 9.079 8.077 1.002 19193 308 1 . 1 1 58 58 PHE N N 58 119.057 119.057 120.722 -1.665 19193 309 1 . 1 1 58 58 PHE HA H 58 4.030 4.030 4.326 -0.296 19193 310 1 . 1 1 58 58 PHE C C 58 173.784 173.784 177.299 -3.515 19193 311 1 . 1 1 58 58 PHE CA C 58 61.744 61.744 61.463 0.281 19193 312 1 . 1 1 58 58 PHE CB C 58 39.581 39.581 38.994 0.587 19193 313 1 . 1 1 58 58 PHE H H 58 8.795 8.795 8.327 0.468 19193 314 1 . 1 1 59 59 ALA N N 59 120.919 120.919 122.002 -1.083 19193 315 1 . 1 1 59 59 ALA HA H 59 3.960 3.960 4.103 -0.143 19193 316 1 . 1 1 59 59 ALA C C 59 177.602 177.602 179.337 -1.735 19193 317 1 . 1 1 59 59 ALA CA C 59 54.928 54.928 55.013 -0.085 19193 318 1 . 1 1 59 59 ALA CB C 59 17.791 17.791 18.337 -0.546 19193 319 1 . 1 1 59 59 ALA H H 59 8.158 8.158 8.327 -0.169 19193 320 1 . 1 1 60 60 LYS N N 60 116.767 116.767 116.666 0.101 19193 321 1 . 1 1 60 60 LYS HA H 60 4.050 4.050 4.109 -0.059 19193 322 1 . 1 1 60 60 LYS C C 60 175.309 175.309 178.127 -2.818 19193 323 1 . 1 1 60 60 LYS CA C 60 58.274 58.274 57.981 0.293 19193 324 1 . 1 1 60 60 LYS CB C 60 32.221 32.221 32.453 -0.232 19193 325 1 . 1 1 60 60 LYS H H 60 7.554 7.554 7.914 -0.359 19193 326 1 . 1 1 61 61 PHE N N 61 118.086 118.086 119.727 -1.641 19193 327 1 . 1 1 61 61 PHE HA H 61 4.490 4.490 4.290 0.200 19193 328 1 . 1 1 61 61 PHE C C 61 173.559 173.559 175.444 -1.885 19193 329 1 . 1 1 61 61 PHE CA C 61 58.521 58.521 57.555 0.966 19193 330 1 . 1 1 61 61 PHE CB C 61 40.039 40.039 39.827 0.212 19193 331 1 . 1 1 61 61 PHE H H 61 7.231 7.231 7.649 -0.418 19193 332 1 . 1 1 62 62 TYR N N 62 120.802 120.802 122.246 -1.444 19193 333 1 . 1 1 62 62 TYR HA H 62 4.470 4.470 3.651 0.819 19193 334 1 . 1 1 62 62 TYR C C 62 173.559 173.559 175.640 -2.081 19193 335 1 . 1 1 62 62 TYR CA C 62 60.888 60.888 59.802 1.086 19193 336 1 . 1 1 62 62 TYR CB C 62 38.274 38.274 37.953 0.321 19193 337 1 . 1 1 62 62 TYR H H 62 8.301 8.301 7.863 0.438 19193 338 1 . 1 1 63 63 GLY N N 63 132.741 132.741 115.544 17.197 19193 339 1 . 1 1 63 63 GLY C C 63 172.799 172.799 174.887 -2.088 19193 340 1 . 1 1 63 63 GLY CA C 63 46.252 46.252 44.991 1.261 19193 341 1 . 1 1 63 63 GLY H H 63 8.293 8.293 7.916 0.377 19193 342 1 . 1 1 64 64 SER N N 64 115.064 115.064 115.664 -0.600 19193 343 1 . 1 1 64 64 SER HA H 64 4.780 4.780 4.554 0.226 19193 344 1 . 1 1 64 64 SER C C 64 170.939 170.939 175.386 -4.447 19193 345 1 . 1 1 64 64 SER CA C 64 60.525 60.525 57.801 2.724 19193 346 1 . 1 1 64 64 SER CB C 64 63.430 63.430 63.226 0.204 19193 347 1 . 1 1 64 64 SER H H 64 7.833 7.833 7.707 0.126 19193 348 1 . 1 1 65 65 ILE N N 65 112.928 112.928 121.161 -8.233 19193 349 1 . 1 1 65 65 ILE HA H 65 4.260 4.260 4.156 0.104 19193 350 1 . 1 1 65 65 ILE C C 65 175.695 175.695 175.907 -0.212 19193 351 1 . 1 1 65 65 ILE CA C 65 59.752 59.752 61.074 -1.322 19193 352 1 . 1 1 65 65 ILE CB C 65 39.722 39.722 37.611 2.111 19193 353 1 . 1 1 65 65 ILE H H 65 6.935 6.935 7.786 -0.851 19193 stop_ save_